Program PWSCF v.5.1.1 starts on 16Jul2015 at 16:37:46 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: ./PdCl2.save/ file Pd.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4D 4D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 51 20 6 4759 1239 206 Max 52 21 7 4766 1269 213 Sum 1643 669 207 152399 40137 6695 bravais-lattice index = 14 lattice parameter (alat) = 6.3306 a.u. unit-cell volume = 951.6698 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 448.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.330582 celldm(2)= 1.140299 celldm(3)= 3.289552 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 1.140299 0.000000 ) a(3) = ( 0.000000 0.000000 3.289552 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.876963 -0.000000 ) b(3) = ( 0.000000 0.000000 0.303993 ) PseudoPot. # 1 for Cl read from file: /home/autes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 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 Pd read from file: /home/autes/Pseudo/Pd.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: c739162b63f03a64c3c1b37175d261f3 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1235 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 Cl 7.00 35.45300 Cl( 1.00) Pd 10.00 106.42000 Pd( 1.00) 4 Sym. Ops., with inversion, found (note: 4 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 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 s_h -s_h i -i G_3+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_4+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_3- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 imaginary part E -E C2 -C2 s_h -s_h i -i G_3+ 0.00 0.00 1.00 -1.00 1.00 -1.00 0.00 0.00 G_4+ 0.00 0.00 -1.00 1.00 -1.00 1.00 0.00 0.00 G_3- 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 the symmetry operations in each class: E 1 C2 2 i 3 s_h 4 -E -1 -C2 -2 -i -3 -s_h -4 Cartesian axes number of k points= 428 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023364 k( 2) = ( 0.0106383 -0.0000000 -0.0000000), wk = 0.0023364 k( 3) = ( 0.0212766 -0.0000000 -0.0000000), wk = 0.0023364 k( 4) = ( 0.0319149 -0.0000000 -0.0000000), wk = 0.0023364 k( 5) = ( 0.0425532 -0.0000000 -0.0000000), wk = 0.0023364 k( 6) = ( 0.0531915 -0.0000000 -0.0000000), wk = 0.0023364 k( 7) = ( 0.0638298 -0.0000000 -0.0000000), wk = 0.0023364 k( 8) = ( 0.0744681 -0.0000000 -0.0000000), wk = 0.0023364 k( 9) = ( 0.0851064 -0.0000000 -0.0000000), wk = 0.0023364 k( 10) = ( 0.0957447 -0.0000000 -0.0000000), wk = 0.0023364 k( 11) = ( 0.1063830 -0.0000000 -0.0000000), wk = 0.0023364 k( 12) = ( 0.1170213 -0.0000000 -0.0000000), wk = 0.0023364 k( 13) = ( 0.1276596 -0.0000000 -0.0000000), wk = 0.0023364 k( 14) = ( 0.1382979 -0.0000000 -0.0000000), wk = 0.0023364 k( 15) = ( 0.1489362 -0.0000000 -0.0000000), wk = 0.0023364 k( 16) = ( 0.1595745 -0.0000000 -0.0000000), wk = 0.0023364 k( 17) = ( 0.1702128 -0.0000000 -0.0000000), wk = 0.0023364 k( 18) = ( 0.1808511 -0.0000000 -0.0000000), wk = 0.0023364 k( 19) = ( 0.1914894 -0.0000000 -0.0000000), wk = 0.0023364 k( 20) = ( 0.2021277 -0.0000000 -0.0000000), wk = 0.0023364 k( 21) = ( 0.2127660 -0.0000000 -0.0000000), wk = 0.0023364 k( 22) = ( 0.2234043 -0.0000000 -0.0000000), wk = 0.0023364 k( 23) = ( 0.2340425 -0.0000000 -0.0000000), wk = 0.0023364 k( 24) = ( 0.2446809 -0.0000000 -0.0000000), wk = 0.0023364 k( 25) = ( 0.2553191 -0.0000000 -0.0000000), wk = 0.0023364 k( 26) = ( 0.2659574 -0.0000000 -0.0000000), wk = 0.0023364 k( 27) = ( 0.2765957 -0.0000000 -0.0000000), wk = 0.0023364 k( 28) = ( 0.2872340 -0.0000000 -0.0000000), wk = 0.0023364 k( 29) = ( 0.2978723 -0.0000000 -0.0000000), wk = 0.0023364 k( 30) = ( 0.3085106 -0.0000000 -0.0000000), wk = 0.0023364 k( 31) = ( 0.3191489 -0.0000000 -0.0000000), wk = 0.0023364 k( 32) = ( 0.3297872 -0.0000000 -0.0000000), wk = 0.0023364 k( 33) = ( 0.3404255 -0.0000000 -0.0000000), wk = 0.0023364 k( 34) = ( 0.3510638 -0.0000000 -0.0000000), wk = 0.0023364 k( 35) = ( 0.3617021 -0.0000000 -0.0000000), wk = 0.0023364 k( 36) = ( 0.3723404 -0.0000000 -0.0000000), wk = 0.0023364 k( 37) = ( 0.3829787 -0.0000000 -0.0000000), wk = 0.0023364 k( 38) = ( 0.3936170 -0.0000000 -0.0000000), wk = 0.0023364 k( 39) = ( 0.4042553 -0.0000000 -0.0000000), wk = 0.0023364 k( 40) = ( 0.4148936 -0.0000000 -0.0000000), wk = 0.0023364 k( 41) = ( 0.4255319 -0.0000000 -0.0000000), wk = 0.0023364 k( 42) = ( 0.4361702 -0.0000000 -0.0000000), wk = 0.0023364 k( 43) = ( 0.4468085 -0.0000000 -0.0000000), wk = 0.0023364 k( 44) = ( 0.4574468 -0.0000000 -0.0000000), wk = 0.0023364 k( 45) = ( 0.4680851 -0.0000000 -0.0000000), wk = 0.0023364 k( 46) = ( 0.4787234 -0.0000000 -0.0000000), wk = 0.0023364 k( 47) = ( 0.4893617 -0.0000000 -0.0000000), wk = 0.0023364 k( 48) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023364 k( 49) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023364 k( 50) = ( 0.5000000 0.0104400 -0.0000000), wk = 0.0023364 k( 51) = ( 0.5000000 0.0208801 -0.0000000), wk = 0.0023364 k( 52) = ( 0.5000000 0.0313201 -0.0000000), wk = 0.0023364 k( 53) = ( 0.5000000 0.0417602 -0.0000000), wk = 0.0023364 k( 54) = ( 0.5000000 0.0522002 -0.0000000), wk = 0.0023364 k( 55) = ( 0.5000000 0.0626402 -0.0000000), wk = 0.0023364 k( 56) = ( 0.5000000 0.0730803 -0.0000000), wk = 0.0023364 k( 57) = ( 0.5000000 0.0835203 -0.0000000), wk = 0.0023364 k( 58) = ( 0.5000000 0.0939604 -0.0000000), wk = 0.0023364 k( 59) = ( 0.5000000 0.1044004 -0.0000000), wk = 0.0023364 k( 60) = ( 0.5000000 0.1148404 -0.0000000), wk = 0.0023364 k( 61) = ( 0.5000000 0.1252805 -0.0000000), wk = 0.0023364 k( 62) = ( 0.5000000 0.1357205 -0.0000000), wk = 0.0023364 k( 63) = ( 0.5000000 0.1461606 -0.0000000), wk = 0.0023364 k( 64) = ( 0.5000000 0.1566006 -0.0000000), wk = 0.0023364 k( 65) = ( 0.5000000 0.1670406 -0.0000000), wk = 0.0023364 k( 66) = ( 0.5000000 0.1774807 -0.0000000), wk = 0.0023364 k( 67) = ( 0.5000000 0.1879207 -0.0000000), wk = 0.0023364 k( 68) = ( 0.5000000 0.1983608 -0.0000000), wk = 0.0023364 k( 69) = ( 0.5000000 0.2088008 -0.0000000), wk = 0.0023364 k( 70) = ( 0.5000000 0.2192408 -0.0000000), wk = 0.0023364 k( 71) = ( 0.5000000 0.2296809 -0.0000000), wk = 0.0023364 k( 72) = ( 0.5000000 0.2401209 -0.0000000), wk = 0.0023364 k( 73) = ( 0.5000000 0.2505610 -0.0000000), wk = 0.0023364 k( 74) = ( 0.5000000 0.2610010 -0.0000000), wk = 0.0023364 k( 75) = ( 0.5000000 0.2714410 -0.0000000), wk = 0.0023364 k( 76) = ( 0.5000000 0.2818811 -0.0000000), wk = 0.0023364 k( 77) = ( 0.5000000 0.2923211 -0.0000000), wk = 0.0023364 k( 78) = ( 0.5000000 0.3027612 -0.0000000), wk = 0.0023364 k( 79) = ( 0.5000000 0.3132012 -0.0000000), wk = 0.0023364 k( 80) = ( 0.5000000 0.3236412 -0.0000000), wk = 0.0023364 k( 81) = ( 0.5000000 0.3340813 -0.0000000), wk = 0.0023364 k( 82) = ( 0.5000000 0.3445213 -0.0000000), wk = 0.0023364 k( 83) = ( 0.5000000 0.3549614 -0.0000000), wk = 0.0023364 k( 84) = ( 0.5000000 0.3654014 -0.0000000), wk = 0.0023364 k( 85) = ( 0.5000000 0.3758414 -0.0000000), wk = 0.0023364 k( 86) = ( 0.5000000 0.3862815 -0.0000000), wk = 0.0023364 k( 87) = ( 0.5000000 0.3967215 -0.0000000), wk = 0.0023364 k( 88) = ( 0.5000000 0.4071616 -0.0000000), wk = 0.0023364 k( 89) = ( 0.5000000 0.4176016 -0.0000000), wk = 0.0023364 k( 90) = ( 0.5000000 0.4280416 -0.0000000), wk = 0.0023364 k( 91) = ( 0.5000000 0.4384817 -0.0000000), wk = 0.0023364 k( 92) = ( 0.5000000 0.4384817 -0.0000000), wk = 0.0023364 k( 93) = ( 0.4893617 0.4384817 -0.0000000), wk = 0.0023364 k( 94) = ( 0.4787234 0.4384817 -0.0000000), wk = 0.0023364 k( 95) = ( 0.4680851 0.4384817 -0.0000000), wk = 0.0023364 k( 96) = ( 0.4574468 0.4384817 -0.0000000), wk = 0.0023364 k( 97) = ( 0.4468085 0.4384817 -0.0000000), wk = 0.0023364 k( 98) = ( 0.4361702 0.4384817 -0.0000000), wk = 0.0023364 k( 99) = ( 0.4255319 0.4384817 -0.0000000), wk = 0.0023364 k( 100) = ( 0.4148936 0.4384817 -0.0000000), wk = 0.0023364 k( 101) = ( 0.4042553 0.4384817 -0.0000000), wk = 0.0023364 k( 102) = ( 0.3936170 0.4384817 -0.0000000), wk = 0.0023364 k( 103) = ( 0.3829787 0.4384817 -0.0000000), wk = 0.0023364 k( 104) = ( 0.3723404 0.4384817 -0.0000000), wk = 0.0023364 k( 105) = ( 0.3617021 0.4384817 -0.0000000), wk = 0.0023364 k( 106) = ( 0.3510638 0.4384817 -0.0000000), wk = 0.0023364 k( 107) = ( 0.3404255 0.4384817 -0.0000000), wk = 0.0023364 k( 108) = ( 0.3297872 0.4384817 -0.0000000), wk = 0.0023364 k( 109) = ( 0.3191489 0.4384817 -0.0000000), wk = 0.0023364 k( 110) = ( 0.3085106 0.4384817 -0.0000000), wk = 0.0023364 k( 111) = ( 0.2978723 0.4384817 -0.0000000), wk = 0.0023364 k( 112) = ( 0.2872340 0.4384817 -0.0000000), wk = 0.0023364 k( 113) = ( 0.2765957 0.4384817 -0.0000000), wk = 0.0023364 k( 114) = ( 0.2659574 0.4384817 -0.0000000), wk = 0.0023364 k( 115) = ( 0.2553191 0.4384817 -0.0000000), wk = 0.0023364 k( 116) = ( 0.2446809 0.4384817 -0.0000000), wk = 0.0023364 k( 117) = ( 0.2340425 0.4384817 -0.0000000), wk = 0.0023364 k( 118) = ( 0.2234043 0.4384817 -0.0000000), wk = 0.0023364 k( 119) = ( 0.2127660 0.4384817 -0.0000000), wk = 0.0023364 k( 120) = ( 0.2021277 0.4384817 -0.0000000), wk = 0.0023364 k( 121) = ( 0.1914894 0.4384817 -0.0000000), wk = 0.0023364 k( 122) = ( 0.1808511 0.4384817 -0.0000000), wk = 0.0023364 k( 123) = ( 0.1702128 0.4384817 -0.0000000), wk = 0.0023364 k( 124) = ( 0.1595745 0.4384817 -0.0000000), wk = 0.0023364 k( 125) = ( 0.1489362 0.4384817 -0.0000000), wk = 0.0023364 k( 126) = ( 0.1382979 0.4384817 -0.0000000), wk = 0.0023364 k( 127) = ( 0.1276596 0.4384817 -0.0000000), wk = 0.0023364 k( 128) = ( 0.1170213 0.4384817 -0.0000000), wk = 0.0023364 k( 129) = ( 0.1063830 0.4384817 -0.0000000), wk = 0.0023364 k( 130) = ( 0.0957447 0.4384817 -0.0000000), wk = 0.0023364 k( 131) = ( 0.0851064 0.4384817 -0.0000000), wk = 0.0023364 k( 132) = ( 0.0744681 0.4384817 -0.0000000), wk = 0.0023364 k( 133) = ( 0.0638298 0.4384817 -0.0000000), wk = 0.0023364 k( 134) = ( 0.0531915 0.4384817 -0.0000000), wk = 0.0023364 k( 135) = ( 0.0425532 0.4384817 -0.0000000), wk = 0.0023364 k( 136) = ( 0.0319149 0.4384817 -0.0000000), wk = 0.0023364 k( 137) = ( 0.0212766 0.4384817 -0.0000000), wk = 0.0023364 k( 138) = ( 0.0106383 0.4384817 -0.0000000), wk = 0.0023364 k( 139) = ( 0.0000000 0.4384817 -0.0000000), wk = 0.0023364 k( 140) = ( 0.0000000 0.4384817 -0.0000000), wk = 0.0023364 k( 141) = ( 0.0000000 0.4280416 -0.0000000), wk = 0.0023364 k( 142) = ( 0.0000000 0.4176016 -0.0000000), wk = 0.0023364 k( 143) = ( 0.0000000 0.4071616 -0.0000000), wk = 0.0023364 k( 144) = ( 0.0000000 0.3967215 -0.0000000), wk = 0.0023364 k( 145) = ( 0.0000000 0.3862815 -0.0000000), wk = 0.0023364 k( 146) = ( 0.0000000 0.3758414 -0.0000000), wk = 0.0023364 k( 147) = ( 0.0000000 0.3654014 -0.0000000), wk = 0.0023364 k( 148) = ( 0.0000000 0.3549614 -0.0000000), wk = 0.0023364 k( 149) = ( 0.0000000 0.3445213 -0.0000000), wk = 0.0023364 k( 150) = ( 0.0000000 0.3340813 -0.0000000), wk = 0.0023364 k( 151) = ( 0.0000000 0.3236412 -0.0000000), wk = 0.0023364 k( 152) = ( 0.0000000 0.3132012 -0.0000000), wk = 0.0023364 k( 153) = ( 0.0000000 0.3027612 -0.0000000), wk = 0.0023364 k( 154) = ( 0.0000000 0.2923211 -0.0000000), wk = 0.0023364 k( 155) = ( 0.0000000 0.2818811 -0.0000000), wk = 0.0023364 k( 156) = ( 0.0000000 0.2714410 -0.0000000), wk = 0.0023364 k( 157) = ( 0.0000000 0.2610010 -0.0000000), wk = 0.0023364 k( 158) = ( 0.0000000 0.2505610 -0.0000000), wk = 0.0023364 k( 159) = ( 0.0000000 0.2401209 -0.0000000), wk = 0.0023364 k( 160) = ( 0.0000000 0.2296809 -0.0000000), wk = 0.0023364 k( 161) = ( 0.0000000 0.2192408 -0.0000000), wk = 0.0023364 k( 162) = ( 0.0000000 0.2088008 -0.0000000), wk = 0.0023364 k( 163) = ( 0.0000000 0.1983608 -0.0000000), wk = 0.0023364 k( 164) = ( 0.0000000 0.1879207 -0.0000000), wk = 0.0023364 k( 165) = ( 0.0000000 0.1774807 -0.0000000), wk = 0.0023364 k( 166) = ( 0.0000000 0.1670406 -0.0000000), wk = 0.0023364 k( 167) = ( 0.0000000 0.1566006 -0.0000000), wk = 0.0023364 k( 168) = ( 0.0000000 0.1461606 -0.0000000), wk = 0.0023364 k( 169) = ( 0.0000000 0.1357205 -0.0000000), wk = 0.0023364 k( 170) = ( 0.0000000 0.1252805 -0.0000000), wk = 0.0023364 k( 171) = ( 0.0000000 0.1148404 -0.0000000), wk = 0.0023364 k( 172) = ( 0.0000000 0.1044004 -0.0000000), wk = 0.0023364 k( 173) = ( 0.0000000 0.0939604 -0.0000000), wk = 0.0023364 k( 174) = ( 0.0000000 0.0835203 -0.0000000), wk = 0.0023364 k( 175) = ( 0.0000000 0.0730803 -0.0000000), wk = 0.0023364 k( 176) = ( 0.0000000 0.0626402 -0.0000000), wk = 0.0023364 k( 177) = ( 0.0000000 0.0522002 -0.0000000), wk = 0.0023364 k( 178) = ( 0.0000000 0.0417602 -0.0000000), wk = 0.0023364 k( 179) = ( 0.0000000 0.0313201 -0.0000000), wk = 0.0023364 k( 180) = ( 0.0000000 0.0208801 -0.0000000), wk = 0.0023364 k( 181) = ( 0.0000000 0.0104400 -0.0000000), wk = 0.0023364 k( 182) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023364 k( 183) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023364 k( 184) = ( 0.0000000 0.0000000 0.0101331), wk = 0.0023364 k( 185) = ( 0.0000000 0.0000000 0.0202662), wk = 0.0023364 k( 186) = ( 0.0000000 0.0000000 0.0303993), wk = 0.0023364 k( 187) = ( 0.0000000 0.0000000 0.0405324), wk = 0.0023364 k( 188) = ( 0.0000000 0.0000000 0.0506655), wk = 0.0023364 k( 189) = ( 0.0000000 0.0000000 0.0607985), wk = 0.0023364 k( 190) = ( 0.0000000 0.0000000 0.0709316), wk = 0.0023364 k( 191) = ( 0.0000000 0.0000000 0.0810647), wk = 0.0023364 k( 192) = ( 0.0000000 0.0000000 0.0911978), wk = 0.0023364 k( 193) = ( 0.0000000 0.0000000 0.1013309), wk = 0.0023364 k( 194) = ( 0.0000000 0.0000000 0.1114640), wk = 0.0023364 k( 195) = ( 0.0000000 0.0000000 0.1215971), wk = 0.0023364 k( 196) = ( 0.0000000 0.0000000 0.1317302), wk = 0.0023364 k( 197) = ( 0.0000000 0.0000000 0.1418633), wk = 0.0023364 k( 198) = ( 0.0000000 0.0000000 0.1519964), wk = 0.0023364 k( 199) = ( 0.0000000 0.0000000 0.1519964), wk = 0.0023364 k( 200) = ( 0.0106383 -0.0000000 0.1519964), wk = 0.0023364 k( 201) = ( 0.0212766 -0.0000000 0.1519964), wk = 0.0023364 k( 202) = ( 0.0319149 -0.0000000 0.1519964), wk = 0.0023364 k( 203) = ( 0.0425532 -0.0000000 0.1519964), wk = 0.0023364 k( 204) = ( 0.0531915 -0.0000000 0.1519964), wk = 0.0023364 k( 205) = ( 0.0638298 -0.0000000 0.1519964), wk = 0.0023364 k( 206) = ( 0.0744681 -0.0000000 0.1519964), wk = 0.0023364 k( 207) = ( 0.0851064 -0.0000000 0.1519964), wk = 0.0023364 k( 208) = ( 0.0957447 -0.0000000 0.1519964), wk = 0.0023364 k( 209) = ( 0.1063830 -0.0000000 0.1519964), wk = 0.0023364 k( 210) = ( 0.1170213 -0.0000000 0.1519964), wk = 0.0023364 k( 211) = ( 0.1276596 -0.0000000 0.1519964), wk = 0.0023364 k( 212) = ( 0.1382979 -0.0000000 0.1519964), wk = 0.0023364 k( 213) = ( 0.1489362 -0.0000000 0.1519964), wk = 0.0023364 k( 214) = ( 0.1595745 -0.0000000 0.1519964), wk = 0.0023364 k( 215) = ( 0.1702128 -0.0000000 0.1519964), wk = 0.0023364 k( 216) = ( 0.1808511 -0.0000000 0.1519964), wk = 0.0023364 k( 217) = ( 0.1914894 -0.0000000 0.1519964), wk = 0.0023364 k( 218) = ( 0.2021277 -0.0000000 0.1519964), wk = 0.0023364 k( 219) = ( 0.2127660 -0.0000000 0.1519964), wk = 0.0023364 k( 220) = ( 0.2234043 -0.0000000 0.1519964), wk = 0.0023364 k( 221) = ( 0.2340425 -0.0000000 0.1519964), wk = 0.0023364 k( 222) = ( 0.2446809 -0.0000000 0.1519964), wk = 0.0023364 k( 223) = ( 0.2553191 -0.0000000 0.1519964), wk = 0.0023364 k( 224) = ( 0.2659574 -0.0000000 0.1519964), wk = 0.0023364 k( 225) = ( 0.2765957 -0.0000000 0.1519964), wk = 0.0023364 k( 226) = ( 0.2872340 -0.0000000 0.1519964), wk = 0.0023364 k( 227) = ( 0.2978723 -0.0000000 0.1519964), wk = 0.0023364 k( 228) = ( 0.3085106 -0.0000000 0.1519964), wk = 0.0023364 k( 229) = ( 0.3191489 -0.0000000 0.1519964), wk = 0.0023364 k( 230) = ( 0.3297872 -0.0000000 0.1519964), wk = 0.0023364 k( 231) = ( 0.3404255 -0.0000000 0.1519964), wk = 0.0023364 k( 232) = ( 0.3510638 -0.0000000 0.1519964), wk = 0.0023364 k( 233) = ( 0.3617021 -0.0000000 0.1519964), wk = 0.0023364 k( 234) = ( 0.3723404 -0.0000000 0.1519964), wk = 0.0023364 k( 235) = ( 0.3829787 -0.0000000 0.1519964), wk = 0.0023364 k( 236) = ( 0.3936170 -0.0000000 0.1519964), wk = 0.0023364 k( 237) = ( 0.4042553 -0.0000000 0.1519964), wk = 0.0023364 k( 238) = ( 0.4148936 -0.0000000 0.1519964), wk = 0.0023364 k( 239) = ( 0.4255319 -0.0000000 0.1519964), wk = 0.0023364 k( 240) = ( 0.4361702 -0.0000000 0.1519964), wk = 0.0023364 k( 241) = ( 0.4468085 -0.0000000 0.1519964), wk = 0.0023364 k( 242) = ( 0.4574468 -0.0000000 0.1519964), wk = 0.0023364 k( 243) = ( 0.4680851 -0.0000000 0.1519964), wk = 0.0023364 k( 244) = ( 0.4787234 -0.0000000 0.1519964), wk = 0.0023364 k( 245) = ( 0.4893617 -0.0000000 0.1519964), wk = 0.0023364 k( 246) = ( 0.5000000 -0.0000000 0.1519964), wk = 0.0023364 k( 247) = ( 0.5000000 -0.0000000 0.1519964), wk = 0.0023364 k( 248) = ( 0.5000000 0.0104400 0.1519964), wk = 0.0023364 k( 249) = ( 0.5000000 0.0208801 0.1519964), wk = 0.0023364 k( 250) = ( 0.5000000 0.0313201 0.1519964), wk = 0.0023364 k( 251) = ( 0.5000000 0.0417602 0.1519964), wk = 0.0023364 k( 252) = ( 0.5000000 0.0522002 0.1519964), wk = 0.0023364 k( 253) = ( 0.5000000 0.0626402 0.1519964), wk = 0.0023364 k( 254) = ( 0.5000000 0.0730803 0.1519964), wk = 0.0023364 k( 255) = ( 0.5000000 0.0835203 0.1519964), wk = 0.0023364 k( 256) = ( 0.5000000 0.0939604 0.1519964), wk = 0.0023364 k( 257) = ( 0.5000000 0.1044004 0.1519964), wk = 0.0023364 k( 258) = ( 0.5000000 0.1148404 0.1519964), wk = 0.0023364 k( 259) = ( 0.5000000 0.1252805 0.1519964), wk = 0.0023364 k( 260) = ( 0.5000000 0.1357205 0.1519964), wk = 0.0023364 k( 261) = ( 0.5000000 0.1461606 0.1519964), wk = 0.0023364 k( 262) = ( 0.5000000 0.1566006 0.1519964), wk = 0.0023364 k( 263) = ( 0.5000000 0.1670406 0.1519964), wk = 0.0023364 k( 264) = ( 0.5000000 0.1774807 0.1519964), wk = 0.0023364 k( 265) = ( 0.5000000 0.1879207 0.1519964), wk = 0.0023364 k( 266) = ( 0.5000000 0.1983608 0.1519964), wk = 0.0023364 k( 267) = ( 0.5000000 0.2088008 0.1519964), wk = 0.0023364 k( 268) = ( 0.5000000 0.2192408 0.1519964), wk = 0.0023364 k( 269) = ( 0.5000000 0.2296809 0.1519964), wk = 0.0023364 k( 270) = ( 0.5000000 0.2401209 0.1519964), wk = 0.0023364 k( 271) = ( 0.5000000 0.2505610 0.1519964), wk = 0.0023364 k( 272) = ( 0.5000000 0.2610010 0.1519964), wk = 0.0023364 k( 273) = ( 0.5000000 0.2714410 0.1519964), wk = 0.0023364 k( 274) = ( 0.5000000 0.2818811 0.1519964), wk = 0.0023364 k( 275) = ( 0.5000000 0.2923211 0.1519964), wk = 0.0023364 k( 276) = ( 0.5000000 0.3027612 0.1519964), wk = 0.0023364 k( 277) = ( 0.5000000 0.3132012 0.1519964), wk = 0.0023364 k( 278) = ( 0.5000000 0.3236412 0.1519964), wk = 0.0023364 k( 279) = ( 0.5000000 0.3340813 0.1519964), wk = 0.0023364 k( 280) = ( 0.5000000 0.3445213 0.1519964), wk = 0.0023364 k( 281) = ( 0.5000000 0.3549614 0.1519964), wk = 0.0023364 k( 282) = ( 0.5000000 0.3654014 0.1519964), wk = 0.0023364 k( 283) = ( 0.5000000 0.3758414 0.1519964), wk = 0.0023364 k( 284) = ( 0.5000000 0.3862815 0.1519964), wk = 0.0023364 k( 285) = ( 0.5000000 0.3967215 0.1519964), wk = 0.0023364 k( 286) = ( 0.5000000 0.4071616 0.1519964), wk = 0.0023364 k( 287) = ( 0.5000000 0.4176016 0.1519964), wk = 0.0023364 k( 288) = ( 0.5000000 0.4280416 0.1519964), wk = 0.0023364 k( 289) = ( 0.5000000 0.4384817 0.1519964), wk = 0.0023364 k( 290) = ( 0.5000000 0.4384817 0.1519964), wk = 0.0023364 k( 291) = ( 0.4893617 0.4384817 0.1519964), wk = 0.0023364 k( 292) = ( 0.4787234 0.4384817 0.1519964), wk = 0.0023364 k( 293) = ( 0.4680851 0.4384817 0.1519964), wk = 0.0023364 k( 294) = ( 0.4574468 0.4384817 0.1519964), wk = 0.0023364 k( 295) = ( 0.4468085 0.4384817 0.1519964), wk = 0.0023364 k( 296) = ( 0.4361702 0.4384817 0.1519964), wk = 0.0023364 k( 297) = ( 0.4255319 0.4384817 0.1519964), wk = 0.0023364 k( 298) = ( 0.4148936 0.4384817 0.1519964), wk = 0.0023364 k( 299) = ( 0.4042553 0.4384817 0.1519964), wk = 0.0023364 k( 300) = ( 0.3936170 0.4384817 0.1519964), wk = 0.0023364 k( 301) = ( 0.3829787 0.4384817 0.1519964), wk = 0.0023364 k( 302) = ( 0.3723404 0.4384817 0.1519964), wk = 0.0023364 k( 303) = ( 0.3617021 0.4384817 0.1519964), wk = 0.0023364 k( 304) = ( 0.3510638 0.4384817 0.1519964), wk = 0.0023364 k( 305) = ( 0.3404255 0.4384817 0.1519964), wk = 0.0023364 k( 306) = ( 0.3297872 0.4384817 0.1519964), wk = 0.0023364 k( 307) = ( 0.3191489 0.4384817 0.1519964), wk = 0.0023364 k( 308) = ( 0.3085106 0.4384817 0.1519964), wk = 0.0023364 k( 309) = ( 0.2978723 0.4384817 0.1519964), wk = 0.0023364 k( 310) = ( 0.2872340 0.4384817 0.1519964), wk = 0.0023364 k( 311) = ( 0.2765957 0.4384817 0.1519964), wk = 0.0023364 k( 312) = ( 0.2659574 0.4384817 0.1519964), wk = 0.0023364 k( 313) = ( 0.2553191 0.4384817 0.1519964), wk = 0.0023364 k( 314) = ( 0.2446809 0.4384817 0.1519964), wk = 0.0023364 k( 315) = ( 0.2340425 0.4384817 0.1519964), wk = 0.0023364 k( 316) = ( 0.2234043 0.4384817 0.1519964), wk = 0.0023364 k( 317) = ( 0.2127660 0.4384817 0.1519964), wk = 0.0023364 k( 318) = ( 0.2021277 0.4384817 0.1519964), wk = 0.0023364 k( 319) = ( 0.1914894 0.4384817 0.1519964), wk = 0.0023364 k( 320) = ( 0.1808511 0.4384817 0.1519964), wk = 0.0023364 k( 321) = ( 0.1702128 0.4384817 0.1519964), wk = 0.0023364 k( 322) = ( 0.1595745 0.4384817 0.1519964), wk = 0.0023364 k( 323) = ( 0.1489362 0.4384817 0.1519964), wk = 0.0023364 k( 324) = ( 0.1382979 0.4384817 0.1519964), wk = 0.0023364 k( 325) = ( 0.1276596 0.4384817 0.1519964), wk = 0.0023364 k( 326) = ( 0.1170213 0.4384817 0.1519964), wk = 0.0023364 k( 327) = ( 0.1063830 0.4384817 0.1519964), wk = 0.0023364 k( 328) = ( 0.0957447 0.4384817 0.1519964), wk = 0.0023364 k( 329) = ( 0.0851064 0.4384817 0.1519964), wk = 0.0023364 k( 330) = ( 0.0744681 0.4384817 0.1519964), wk = 0.0023364 k( 331) = ( 0.0638298 0.4384817 0.1519964), wk = 0.0023364 k( 332) = ( 0.0531915 0.4384817 0.1519964), wk = 0.0023364 k( 333) = ( 0.0425532 0.4384817 0.1519964), wk = 0.0023364 k( 334) = ( 0.0319149 0.4384817 0.1519964), wk = 0.0023364 k( 335) = ( 0.0212766 0.4384817 0.1519964), wk = 0.0023364 k( 336) = ( 0.0106383 0.4384817 0.1519964), wk = 0.0023364 k( 337) = ( 0.0000000 0.4384817 0.1519964), wk = 0.0023364 k( 338) = ( 0.0000000 0.4384817 0.1519964), wk = 0.0023364 k( 339) = ( 0.0000000 0.4280416 0.1519964), wk = 0.0023364 k( 340) = ( 0.0000000 0.4176016 0.1519964), wk = 0.0023364 k( 341) = ( 0.0000000 0.4071616 0.1519964), wk = 0.0023364 k( 342) = ( 0.0000000 0.3967215 0.1519964), wk = 0.0023364 k( 343) = ( 0.0000000 0.3862815 0.1519964), wk = 0.0023364 k( 344) = ( 0.0000000 0.3758414 0.1519964), wk = 0.0023364 k( 345) = ( 0.0000000 0.3654014 0.1519964), wk = 0.0023364 k( 346) = ( 0.0000000 0.3549614 0.1519964), wk = 0.0023364 k( 347) = ( 0.0000000 0.3445213 0.1519964), wk = 0.0023364 k( 348) = ( 0.0000000 0.3340813 0.1519964), wk = 0.0023364 k( 349) = ( 0.0000000 0.3236412 0.1519964), wk = 0.0023364 k( 350) = ( 0.0000000 0.3132012 0.1519964), wk = 0.0023364 k( 351) = ( 0.0000000 0.3027612 0.1519964), wk = 0.0023364 k( 352) = ( 0.0000000 0.2923211 0.1519964), wk = 0.0023364 k( 353) = ( 0.0000000 0.2818811 0.1519964), wk = 0.0023364 k( 354) = ( 0.0000000 0.2714410 0.1519964), wk = 0.0023364 k( 355) = ( 0.0000000 0.2610010 0.1519964), wk = 0.0023364 k( 356) = ( 0.0000000 0.2505610 0.1519964), wk = 0.0023364 k( 357) = ( 0.0000000 0.2401209 0.1519964), wk = 0.0023364 k( 358) = ( 0.0000000 0.2296809 0.1519964), wk = 0.0023364 k( 359) = ( 0.0000000 0.2192408 0.1519964), wk = 0.0023364 k( 360) = ( 0.0000000 0.2088008 0.1519964), wk = 0.0023364 k( 361) = ( 0.0000000 0.1983608 0.1519964), wk = 0.0023364 k( 362) = ( 0.0000000 0.1879207 0.1519964), wk = 0.0023364 k( 363) = ( 0.0000000 0.1774807 0.1519964), wk = 0.0023364 k( 364) = ( 0.0000000 0.1670406 0.1519964), wk = 0.0023364 k( 365) = ( 0.0000000 0.1566006 0.1519964), wk = 0.0023364 k( 366) = ( 0.0000000 0.1461606 0.1519964), wk = 0.0023364 k( 367) = ( 0.0000000 0.1357205 0.1519964), wk = 0.0023364 k( 368) = ( 0.0000000 0.1252805 0.1519964), wk = 0.0023364 k( 369) = ( 0.0000000 0.1148404 0.1519964), wk = 0.0023364 k( 370) = ( 0.0000000 0.1044004 0.1519964), wk = 0.0023364 k( 371) = ( 0.0000000 0.0939604 0.1519964), wk = 0.0023364 k( 372) = ( 0.0000000 0.0835203 0.1519964), wk = 0.0023364 k( 373) = ( 0.0000000 0.0730803 0.1519964), wk = 0.0023364 k( 374) = ( 0.0000000 0.0626402 0.1519964), wk = 0.0023364 k( 375) = ( 0.0000000 0.0522002 0.1519964), wk = 0.0023364 k( 376) = ( 0.0000000 0.0417602 0.1519964), wk = 0.0023364 k( 377) = ( 0.0000000 0.0313201 0.1519964), wk = 0.0023364 k( 378) = ( 0.0000000 0.0208801 0.1519964), wk = 0.0023364 k( 379) = ( 0.0000000 0.0104400 0.1519964), wk = 0.0023364 k( 380) = ( 0.0000000 0.0000000 0.1519964), wk = 0.0023364 k( 381) = ( 0.0000000 0.4384817 -0.0000000), wk = 0.0023364 k( 382) = ( 0.0000000 0.4384817 0.0101331), wk = 0.0023364 k( 383) = ( 0.0000000 0.4384817 0.0202662), wk = 0.0023364 k( 384) = ( 0.0000000 0.4384817 0.0303993), wk = 0.0023364 k( 385) = ( 0.0000000 0.4384817 0.0405324), wk = 0.0023364 k( 386) = ( 0.0000000 0.4384817 0.0506655), wk = 0.0023364 k( 387) = ( 0.0000000 0.4384817 0.0607985), wk = 0.0023364 k( 388) = ( 0.0000000 0.4384817 0.0709316), wk = 0.0023364 k( 389) = ( 0.0000000 0.4384817 0.0810647), wk = 0.0023364 k( 390) = ( 0.0000000 0.4384817 0.0911978), wk = 0.0023364 k( 391) = ( 0.0000000 0.4384817 0.1013309), wk = 0.0023364 k( 392) = ( 0.0000000 0.4384817 0.1114640), wk = 0.0023364 k( 393) = ( 0.0000000 0.4384817 0.1215971), wk = 0.0023364 k( 394) = ( 0.0000000 0.4384817 0.1317302), wk = 0.0023364 k( 395) = ( 0.0000000 0.4384817 0.1418633), wk = 0.0023364 k( 396) = ( 0.0000000 0.4384817 0.1519964), wk = 0.0023364 k( 397) = ( 0.5000000 -0.0000000 0.1519964), wk = 0.0023364 k( 398) = ( 0.5000000 -0.0000000 0.1418633), wk = 0.0023364 k( 399) = ( 0.5000000 -0.0000000 0.1317302), wk = 0.0023364 k( 400) = ( 0.5000000 -0.0000000 0.1215971), wk = 0.0023364 k( 401) = ( 0.5000000 -0.0000000 0.1114640), wk = 0.0023364 k( 402) = ( 0.5000000 -0.0000000 0.1013309), wk = 0.0023364 k( 403) = ( 0.5000000 -0.0000000 0.0911978), wk = 0.0023364 k( 404) = ( 0.5000000 -0.0000000 0.0810647), wk = 0.0023364 k( 405) = ( 0.5000000 -0.0000000 0.0709316), wk = 0.0023364 k( 406) = ( 0.5000000 -0.0000000 0.0607985), wk = 0.0023364 k( 407) = ( 0.5000000 -0.0000000 0.0506655), wk = 0.0023364 k( 408) = ( 0.5000000 -0.0000000 0.0405324), wk = 0.0023364 k( 409) = ( 0.5000000 -0.0000000 0.0303993), wk = 0.0023364 k( 410) = ( 0.5000000 -0.0000000 0.0202662), wk = 0.0023364 k( 411) = ( 0.5000000 -0.0000000 0.0101331), wk = 0.0023364 k( 412) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023364 k( 413) = ( 0.5000000 0.4384817 -0.0000000), wk = 0.0023364 k( 414) = ( 0.5000000 0.4384817 0.0101331), wk = 0.0023364 k( 415) = ( 0.5000000 0.4384817 0.0202662), wk = 0.0023364 k( 416) = ( 0.5000000 0.4384817 0.0303993), wk = 0.0023364 k( 417) = ( 0.5000000 0.4384817 0.0405324), wk = 0.0023364 k( 418) = ( 0.5000000 0.4384817 0.0506655), wk = 0.0023364 k( 419) = ( 0.5000000 0.4384817 0.0607985), wk = 0.0023364 k( 420) = ( 0.5000000 0.4384817 0.0709316), wk = 0.0023364 k( 421) = ( 0.5000000 0.4384817 0.0810647), wk = 0.0023364 k( 422) = ( 0.5000000 0.4384817 0.0911978), wk = 0.0023364 k( 423) = ( 0.5000000 0.4384817 0.1013309), wk = 0.0023364 k( 424) = ( 0.5000000 0.4384817 0.1114640), wk = 0.0023364 k( 425) = ( 0.5000000 0.4384817 0.1215971), wk = 0.0023364 k( 426) = ( 0.5000000 0.4384817 0.1317302), wk = 0.0023364 k( 427) = ( 0.5000000 0.4384817 0.1418633), wk = 0.0023364 k( 428) = ( 0.5000000 0.4384817 0.1519964), wk = 0.0023364 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023364 k( 2) = ( 0.0106383 0.0000000 0.0000000), wk = 0.0023364 k( 3) = ( 0.0212766 0.0000000 0.0000000), wk = 0.0023364 k( 4) = ( 0.0319149 0.0000000 0.0000000), wk = 0.0023364 k( 5) = ( 0.0425532 -0.0000000 0.0000000), wk = 0.0023364 k( 6) = ( 0.0531915 -0.0000000 0.0000000), wk = 0.0023364 k( 7) = ( 0.0638298 0.0000000 0.0000000), wk = 0.0023364 k( 8) = ( 0.0744681 0.0000000 0.0000000), wk = 0.0023364 k( 9) = ( 0.0851064 -0.0000000 0.0000000), wk = 0.0023364 k( 10) = ( 0.0957447 0.0000000 0.0000000), wk = 0.0023364 k( 11) = ( 0.1063830 -0.0000000 0.0000000), wk = 0.0023364 k( 12) = ( 0.1170213 0.0000000 -0.0000000), wk = 0.0023364 k( 13) = ( 0.1276596 0.0000000 0.0000000), wk = 0.0023364 k( 14) = ( 0.1382979 0.0000000 0.0000000), wk = 0.0023364 k( 15) = ( 0.1489362 -0.0000000 0.0000000), wk = 0.0023364 k( 16) = ( 0.1595745 -0.0000000 0.0000000), wk = 0.0023364 k( 17) = ( 0.1702128 0.0000000 0.0000000), wk = 0.0023364 k( 18) = ( 0.1808511 -0.0000000 0.0000000), wk = 0.0023364 k( 19) = ( 0.1914894 0.0000000 0.0000000), wk = 0.0023364 k( 20) = ( 0.2021277 -0.0000000 -0.0000000), wk = 0.0023364 k( 21) = ( 0.2127660 -0.0000000 0.0000000), wk = 0.0023364 k( 22) = ( 0.2234043 0.0000000 0.0000000), wk = 0.0023364 k( 23) = ( 0.2340425 -0.0000000 0.0000000), wk = 0.0023364 k( 24) = ( 0.2446809 -0.0000000 0.0000000), wk = 0.0023364 k( 25) = ( 0.2553191 0.0000000 -0.0000000), wk = 0.0023364 k( 26) = ( 0.2659574 0.0000000 0.0000000), wk = 0.0023364 k( 27) = ( 0.2765957 0.0000000 0.0000000), wk = 0.0023364 k( 28) = ( 0.2872340 0.0000000 0.0000000), wk = 0.0023364 k( 29) = ( 0.2978723 -0.0000000 0.0000000), wk = 0.0023364 k( 30) = ( 0.3085106 0.0000000 0.0000000), wk = 0.0023364 k( 31) = ( 0.3191489 -0.0000000 0.0000000), wk = 0.0023364 k( 32) = ( 0.3297872 -0.0000000 0.0000000), wk = 0.0023364 k( 33) = ( 0.3404255 -0.0000000 0.0000000), wk = 0.0023364 k( 34) = ( 0.3510638 0.0000000 0.0000000), wk = 0.0023364 k( 35) = ( 0.3617021 0.0000000 0.0000000), wk = 0.0023364 k( 36) = ( 0.3723404 0.0000000 0.0000000), wk = 0.0023364 k( 37) = ( 0.3829787 0.0000000 0.0000000), wk = 0.0023364 k( 38) = ( 0.3936170 0.0000000 0.0000000), wk = 0.0023364 k( 39) = ( 0.4042553 -0.0000000 -0.0000000), wk = 0.0023364 k( 40) = ( 0.4148936 0.0000000 0.0000000), wk = 0.0023364 k( 41) = ( 0.4255319 0.0000000 -0.0000000), wk = 0.0023364 k( 42) = ( 0.4361702 -0.0000000 0.0000000), wk = 0.0023364 k( 43) = ( 0.4468085 -0.0000000 0.0000000), wk = 0.0023364 k( 44) = ( 0.4574468 0.0000000 0.0000000), wk = 0.0023364 k( 45) = ( 0.4680851 -0.0000000 0.0000000), wk = 0.0023364 k( 46) = ( 0.4787234 0.0000000 0.0000000), wk = 0.0023364 k( 47) = ( 0.4893617 -0.0000000 0.0000000), wk = 0.0023364 k( 48) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023364 k( 49) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023364 k( 50) = ( 0.5000000 0.0119048 0.0000000), wk = 0.0023364 k( 51) = ( 0.5000000 0.0238095 0.0000000), wk = 0.0023364 k( 52) = ( 0.5000000 0.0357143 0.0000000), wk = 0.0023364 k( 53) = ( 0.5000000 0.0476191 0.0000000), wk = 0.0023364 k( 54) = ( 0.5000000 0.0595238 0.0000000), wk = 0.0023364 k( 55) = ( 0.5000000 0.0714286 0.0000000), wk = 0.0023364 k( 56) = ( 0.5000000 0.0833333 0.0000000), wk = 0.0023364 k( 57) = ( 0.5000000 0.0952381 0.0000000), wk = 0.0023364 k( 58) = ( 0.5000000 0.1071429 0.0000000), wk = 0.0023364 k( 59) = ( 0.5000000 0.1190476 0.0000000), wk = 0.0023364 k( 60) = ( 0.5000000 0.1309524 0.0000000), wk = 0.0023364 k( 61) = ( 0.5000000 0.1428571 0.0000000), wk = 0.0023364 k( 62) = ( 0.5000000 0.1547619 0.0000000), wk = 0.0023364 k( 63) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0023364 k( 64) = ( 0.5000000 0.1785714 0.0000000), wk = 0.0023364 k( 65) = ( 0.5000000 0.1904762 0.0000000), wk = 0.0023364 k( 66) = ( 0.5000000 0.2023810 0.0000000), wk = 0.0023364 k( 67) = ( 0.5000000 0.2142857 0.0000000), wk = 0.0023364 k( 68) = ( 0.5000000 0.2261905 0.0000000), wk = 0.0023364 k( 69) = ( 0.5000000 0.2380952 0.0000000), wk = 0.0023364 k( 70) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0023364 k( 71) = ( 0.5000000 0.2619048 0.0000000), wk = 0.0023364 k( 72) = ( 0.5000000 0.2738095 0.0000000), wk = 0.0023364 k( 73) = ( 0.5000000 0.2857143 0.0000000), wk = 0.0023364 k( 74) = ( 0.5000000 0.2976191 0.0000000), wk = 0.0023364 k( 75) = ( 0.5000000 0.3095238 0.0000000), wk = 0.0023364 k( 76) = ( 0.5000000 0.3214286 0.0000000), wk = 0.0023364 k( 77) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0023364 k( 78) = ( 0.5000000 0.3452381 0.0000000), wk = 0.0023364 k( 79) = ( 0.5000000 0.3571429 0.0000000), wk = 0.0023364 k( 80) = ( 0.5000000 0.3690476 0.0000000), wk = 0.0023364 k( 81) = ( 0.5000000 0.3809524 0.0000000), wk = 0.0023364 k( 82) = ( 0.5000000 0.3928571 0.0000000), wk = 0.0023364 k( 83) = ( 0.5000000 0.4047619 -0.0000000), wk = 0.0023364 k( 84) = ( 0.5000000 0.4166667 0.0000000), wk = 0.0023364 k( 85) = ( 0.5000000 0.4285714 0.0000000), wk = 0.0023364 k( 86) = ( 0.5000000 0.4404762 0.0000000), wk = 0.0023364 k( 87) = ( 0.5000000 0.4523810 0.0000000), wk = 0.0023364 k( 88) = ( 0.5000000 0.4642857 0.0000000), wk = 0.0023364 k( 89) = ( 0.5000000 0.4761905 0.0000000), wk = 0.0023364 k( 90) = ( 0.5000000 0.4880952 0.0000000), wk = 0.0023364 k( 91) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023364 k( 92) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023364 k( 93) = ( 0.4893617 0.5000000 0.0000000), wk = 0.0023364 k( 94) = ( 0.4787234 0.5000000 0.0000000), wk = 0.0023364 k( 95) = ( 0.4680851 0.5000000 0.0000000), wk = 0.0023364 k( 96) = ( 0.4574468 0.5000000 -0.0000000), wk = 0.0023364 k( 97) = ( 0.4468085 0.5000000 0.0000000), wk = 0.0023364 k( 98) = ( 0.4361702 0.5000000 0.0000000), wk = 0.0023364 k( 99) = ( 0.4255319 0.5000000 0.0000000), wk = 0.0023364 k( 100) = ( 0.4148936 0.5000000 0.0000000), wk = 0.0023364 k( 101) = ( 0.4042553 0.5000000 0.0000000), wk = 0.0023364 k( 102) = ( 0.3936170 0.5000000 0.0000000), wk = 0.0023364 k( 103) = ( 0.3829787 0.5000000 0.0000000), wk = 0.0023364 k( 104) = ( 0.3723404 0.5000000 0.0000000), wk = 0.0023364 k( 105) = ( 0.3617021 0.5000000 -0.0000000), wk = 0.0023364 k( 106) = ( 0.3510638 0.5000000 0.0000000), wk = 0.0023364 k( 107) = ( 0.3404255 0.5000000 0.0000000), wk = 0.0023364 k( 108) = ( 0.3297872 0.5000000 0.0000000), wk = 0.0023364 k( 109) = ( 0.3191489 0.5000000 0.0000000), wk = 0.0023364 k( 110) = ( 0.3085106 0.5000000 0.0000000), wk = 0.0023364 k( 111) = ( 0.2978723 0.5000000 0.0000000), wk = 0.0023364 k( 112) = ( 0.2872340 0.5000000 -0.0000000), wk = 0.0023364 k( 113) = ( 0.2765957 0.5000000 0.0000000), wk = 0.0023364 k( 114) = ( 0.2659574 0.5000000 0.0000000), wk = 0.0023364 k( 115) = ( 0.2553191 0.5000000 0.0000000), wk = 0.0023364 k( 116) = ( 0.2446809 0.5000000 0.0000000), wk = 0.0023364 k( 117) = ( 0.2340425 0.5000000 0.0000000), wk = 0.0023364 k( 118) = ( 0.2234043 0.5000000 0.0000000), wk = 0.0023364 k( 119) = ( 0.2127660 0.5000000 0.0000000), wk = 0.0023364 k( 120) = ( 0.2021277 0.5000000 0.0000000), wk = 0.0023364 k( 121) = ( 0.1914894 0.5000000 0.0000000), wk = 0.0023364 k( 122) = ( 0.1808511 0.5000000 0.0000000), wk = 0.0023364 k( 123) = ( 0.1702128 0.5000000 0.0000000), wk = 0.0023364 k( 124) = ( 0.1595745 0.5000000 -0.0000000), wk = 0.0023364 k( 125) = ( 0.1489362 0.5000000 0.0000000), wk = 0.0023364 k( 126) = ( 0.1382979 0.5000000 -0.0000000), wk = 0.0023364 k( 127) = ( 0.1276596 0.5000000 0.0000000), wk = 0.0023364 k( 128) = ( 0.1170213 0.5000000 0.0000000), wk = 0.0023364 k( 129) = ( 0.1063830 0.5000000 0.0000000), wk = 0.0023364 k( 130) = ( 0.0957447 0.5000000 0.0000000), wk = 0.0023364 k( 131) = ( 0.0851064 0.5000000 0.0000000), wk = 0.0023364 k( 132) = ( 0.0744681 0.5000000 0.0000000), wk = 0.0023364 k( 133) = ( 0.0638298 0.5000000 0.0000000), wk = 0.0023364 k( 134) = ( 0.0531915 0.5000000 0.0000000), wk = 0.0023364 k( 135) = ( 0.0425532 0.5000000 0.0000000), wk = 0.0023364 k( 136) = ( 0.0319149 0.5000000 0.0000000), wk = 0.0023364 k( 137) = ( 0.0212766 0.5000000 0.0000000), wk = 0.0023364 k( 138) = ( 0.0106383 0.5000000 0.0000000), wk = 0.0023364 k( 139) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023364 k( 140) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023364 k( 141) = ( 0.0000000 0.4880952 0.0000000), wk = 0.0023364 k( 142) = ( 0.0000000 0.4761905 0.0000000), wk = 0.0023364 k( 143) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0023364 k( 144) = ( 0.0000000 0.4523810 0.0000000), wk = 0.0023364 k( 145) = ( 0.0000000 0.4404762 0.0000000), wk = 0.0023364 k( 146) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0023364 k( 147) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0023364 k( 148) = ( 0.0000000 0.4047619 0.0000000), wk = 0.0023364 k( 149) = ( 0.0000000 0.3928571 0.0000000), wk = 0.0023364 k( 150) = ( 0.0000000 0.3809524 0.0000000), wk = 0.0023364 k( 151) = ( 0.0000000 0.3690476 0.0000000), wk = 0.0023364 k( 152) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0023364 k( 153) = ( 0.0000000 0.3452381 0.0000000), wk = 0.0023364 k( 154) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0023364 k( 155) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0023364 k( 156) = ( 0.0000000 0.3095238 0.0000000), wk = 0.0023364 k( 157) = ( 0.0000000 0.2976191 0.0000000), wk = 0.0023364 k( 158) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0023364 k( 159) = ( 0.0000000 0.2738095 0.0000000), wk = 0.0023364 k( 160) = ( 0.0000000 0.2619048 0.0000000), wk = 0.0023364 k( 161) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0023364 k( 162) = ( 0.0000000 0.2380952 0.0000000), wk = 0.0023364 k( 163) = ( 0.0000000 0.2261905 0.0000000), wk = 0.0023364 k( 164) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0023364 k( 165) = ( 0.0000000 0.2023810 0.0000000), wk = 0.0023364 k( 166) = ( 0.0000000 0.1904762 0.0000000), wk = 0.0023364 k( 167) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0023364 k( 168) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0023364 k( 169) = ( 0.0000000 0.1547619 0.0000000), wk = 0.0023364 k( 170) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0023364 k( 171) = ( 0.0000000 0.1309524 0.0000000), wk = 0.0023364 k( 172) = ( 0.0000000 0.1190476 0.0000000), wk = 0.0023364 k( 173) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0023364 k( 174) = ( 0.0000000 0.0952381 0.0000000), wk = 0.0023364 k( 175) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0023364 k( 176) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0023364 k( 177) = ( 0.0000000 0.0595238 0.0000000), wk = 0.0023364 k( 178) = ( 0.0000000 0.0476191 0.0000000), wk = 0.0023364 k( 179) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0023364 k( 180) = ( 0.0000000 0.0238095 -0.0000000), wk = 0.0023364 k( 181) = ( 0.0000000 0.0119048 -0.0000000), wk = 0.0023364 k( 182) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023364 k( 183) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023364 k( 184) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0023364 k( 185) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0023364 k( 186) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0023364 k( 187) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0023364 k( 188) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0023364 k( 189) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0023364 k( 190) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0023364 k( 191) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0023364 k( 192) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0023364 k( 193) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0023364 k( 194) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0023364 k( 195) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0023364 k( 196) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0023364 k( 197) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0023364 k( 198) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023364 k( 199) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023364 k( 200) = ( 0.0106383 0.0000000 0.5000000), wk = 0.0023364 k( 201) = ( 0.0212766 0.0000000 0.5000000), wk = 0.0023364 k( 202) = ( 0.0319149 0.0000000 0.5000000), wk = 0.0023364 k( 203) = ( 0.0425532 -0.0000000 0.5000000), wk = 0.0023364 k( 204) = ( 0.0531915 -0.0000000 0.5000000), wk = 0.0023364 k( 205) = ( 0.0638298 0.0000000 0.5000000), wk = 0.0023364 k( 206) = ( 0.0744681 0.0000000 0.5000000), wk = 0.0023364 k( 207) = ( 0.0851064 -0.0000000 0.5000000), wk = 0.0023364 k( 208) = ( 0.0957447 0.0000000 0.5000000), wk = 0.0023364 k( 209) = ( 0.1063830 -0.0000000 0.5000000), wk = 0.0023364 k( 210) = ( 0.1170213 0.0000000 0.5000000), wk = 0.0023364 k( 211) = ( 0.1276596 0.0000000 0.5000000), wk = 0.0023364 k( 212) = ( 0.1382979 0.0000000 0.5000000), wk = 0.0023364 k( 213) = ( 0.1489362 -0.0000000 0.5000000), wk = 0.0023364 k( 214) = ( 0.1595745 -0.0000000 0.5000000), wk = 0.0023364 k( 215) = ( 0.1702128 0.0000000 0.5000000), wk = 0.0023364 k( 216) = ( 0.1808511 -0.0000000 0.5000000), wk = 0.0023364 k( 217) = ( 0.1914894 0.0000000 0.5000000), wk = 0.0023364 k( 218) = ( 0.2021277 -0.0000000 0.5000000), wk = 0.0023364 k( 219) = ( 0.2127660 -0.0000000 0.5000000), wk = 0.0023364 k( 220) = ( 0.2234043 0.0000000 0.5000000), wk = 0.0023364 k( 221) = ( 0.2340425 -0.0000000 0.5000000), wk = 0.0023364 k( 222) = ( 0.2446809 -0.0000000 0.5000000), wk = 0.0023364 k( 223) = ( 0.2553191 0.0000000 0.5000000), wk = 0.0023364 k( 224) = ( 0.2659574 0.0000000 0.5000000), wk = 0.0023364 k( 225) = ( 0.2765957 0.0000000 0.5000000), wk = 0.0023364 k( 226) = ( 0.2872340 0.0000000 0.5000000), wk = 0.0023364 k( 227) = ( 0.2978723 -0.0000000 0.5000000), wk = 0.0023364 k( 228) = ( 0.3085106 0.0000000 0.5000000), wk = 0.0023364 k( 229) = ( 0.3191489 -0.0000000 0.5000000), wk = 0.0023364 k( 230) = ( 0.3297872 -0.0000000 0.5000000), wk = 0.0023364 k( 231) = ( 0.3404255 -0.0000000 0.5000000), wk = 0.0023364 k( 232) = ( 0.3510638 0.0000000 0.5000000), wk = 0.0023364 k( 233) = ( 0.3617021 0.0000000 0.5000000), wk = 0.0023364 k( 234) = ( 0.3723404 0.0000000 0.5000000), wk = 0.0023364 k( 235) = ( 0.3829787 0.0000000 0.5000000), wk = 0.0023364 k( 236) = ( 0.3936170 0.0000000 0.5000000), wk = 0.0023364 k( 237) = ( 0.4042553 -0.0000000 0.5000000), wk = 0.0023364 k( 238) = ( 0.4148936 0.0000000 0.5000000), wk = 0.0023364 k( 239) = ( 0.4255319 0.0000000 0.5000000), wk = 0.0023364 k( 240) = ( 0.4361702 -0.0000000 0.5000000), wk = 0.0023364 k( 241) = ( 0.4468085 -0.0000000 0.5000000), wk = 0.0023364 k( 242) = ( 0.4574468 0.0000000 0.5000000), wk = 0.0023364 k( 243) = ( 0.4680851 -0.0000000 0.5000000), wk = 0.0023364 k( 244) = ( 0.4787234 0.0000000 0.5000000), wk = 0.0023364 k( 245) = ( 0.4893617 -0.0000000 0.5000000), wk = 0.0023364 k( 246) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023364 k( 247) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023364 k( 248) = ( 0.5000000 0.0119048 0.5000000), wk = 0.0023364 k( 249) = ( 0.5000000 0.0238095 0.5000000), wk = 0.0023364 k( 250) = ( 0.5000000 0.0357143 0.5000000), wk = 0.0023364 k( 251) = ( 0.5000000 0.0476191 0.5000000), wk = 0.0023364 k( 252) = ( 0.5000000 0.0595238 0.5000000), wk = 0.0023364 k( 253) = ( 0.5000000 0.0714286 0.5000000), wk = 0.0023364 k( 254) = ( 0.5000000 0.0833333 0.5000000), wk = 0.0023364 k( 255) = ( 0.5000000 0.0952381 0.5000000), wk = 0.0023364 k( 256) = ( 0.5000000 0.1071429 0.5000000), wk = 0.0023364 k( 257) = ( 0.5000000 0.1190476 0.5000000), wk = 0.0023364 k( 258) = ( 0.5000000 0.1309524 0.5000000), wk = 0.0023364 k( 259) = ( 0.5000000 0.1428571 0.5000000), wk = 0.0023364 k( 260) = ( 0.5000000 0.1547619 0.5000000), wk = 0.0023364 k( 261) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0023364 k( 262) = ( 0.5000000 0.1785714 0.5000000), wk = 0.0023364 k( 263) = ( 0.5000000 0.1904762 0.5000000), wk = 0.0023364 k( 264) = ( 0.5000000 0.2023810 0.5000000), wk = 0.0023364 k( 265) = ( 0.5000000 0.2142857 0.5000000), wk = 0.0023364 k( 266) = ( 0.5000000 0.2261905 0.5000000), wk = 0.0023364 k( 267) = ( 0.5000000 0.2380952 0.5000000), wk = 0.0023364 k( 268) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0023364 k( 269) = ( 0.5000000 0.2619048 0.5000000), wk = 0.0023364 k( 270) = ( 0.5000000 0.2738095 0.5000000), wk = 0.0023364 k( 271) = ( 0.5000000 0.2857143 0.5000000), wk = 0.0023364 k( 272) = ( 0.5000000 0.2976191 0.5000000), wk = 0.0023364 k( 273) = ( 0.5000000 0.3095238 0.5000000), wk = 0.0023364 k( 274) = ( 0.5000000 0.3214286 0.5000000), wk = 0.0023364 k( 275) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0023364 k( 276) = ( 0.5000000 0.3452381 0.5000000), wk = 0.0023364 k( 277) = ( 0.5000000 0.3571429 0.5000000), wk = 0.0023364 k( 278) = ( 0.5000000 0.3690476 0.5000000), wk = 0.0023364 k( 279) = ( 0.5000000 0.3809524 0.5000000), wk = 0.0023364 k( 280) = ( 0.5000000 0.3928571 0.5000000), wk = 0.0023364 k( 281) = ( 0.5000000 0.4047619 0.5000000), wk = 0.0023364 k( 282) = ( 0.5000000 0.4166667 0.5000000), wk = 0.0023364 k( 283) = ( 0.5000000 0.4285714 0.5000000), wk = 0.0023364 k( 284) = ( 0.5000000 0.4404762 0.5000000), wk = 0.0023364 k( 285) = ( 0.5000000 0.4523810 0.5000000), wk = 0.0023364 k( 286) = ( 0.5000000 0.4642857 0.5000000), wk = 0.0023364 k( 287) = ( 0.5000000 0.4761905 0.5000000), wk = 0.0023364 k( 288) = ( 0.5000000 0.4880952 0.5000000), wk = 0.0023364 k( 289) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023364 k( 290) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023364 k( 291) = ( 0.4893617 0.5000000 0.5000000), wk = 0.0023364 k( 292) = ( 0.4787234 0.5000000 0.5000000), wk = 0.0023364 k( 293) = ( 0.4680851 0.5000000 0.5000000), wk = 0.0023364 k( 294) = ( 0.4574468 0.5000000 0.5000000), wk = 0.0023364 k( 295) = ( 0.4468085 0.5000000 0.5000000), wk = 0.0023364 k( 296) = ( 0.4361702 0.5000000 0.5000000), wk = 0.0023364 k( 297) = ( 0.4255319 0.5000000 0.5000000), wk = 0.0023364 k( 298) = ( 0.4148936 0.5000000 0.5000000), wk = 0.0023364 k( 299) = ( 0.4042553 0.5000000 0.5000000), wk = 0.0023364 k( 300) = ( 0.3936170 0.5000000 0.5000000), wk = 0.0023364 k( 301) = ( 0.3829787 0.5000000 0.5000000), wk = 0.0023364 k( 302) = ( 0.3723404 0.5000000 0.5000000), wk = 0.0023364 k( 303) = ( 0.3617021 0.5000000 0.5000000), wk = 0.0023364 k( 304) = ( 0.3510638 0.5000000 0.5000000), wk = 0.0023364 k( 305) = ( 0.3404255 0.5000000 0.5000000), wk = 0.0023364 k( 306) = ( 0.3297872 0.5000000 0.5000000), wk = 0.0023364 k( 307) = ( 0.3191489 0.5000000 0.5000000), wk = 0.0023364 k( 308) = ( 0.3085106 0.5000000 0.5000000), wk = 0.0023364 k( 309) = ( 0.2978723 0.5000000 0.5000000), wk = 0.0023364 k( 310) = ( 0.2872340 0.5000000 0.5000000), wk = 0.0023364 k( 311) = ( 0.2765957 0.5000000 0.5000000), wk = 0.0023364 k( 312) = ( 0.2659574 0.5000000 0.5000000), wk = 0.0023364 k( 313) = ( 0.2553191 0.5000000 0.5000000), wk = 0.0023364 k( 314) = ( 0.2446809 0.5000000 0.5000000), wk = 0.0023364 k( 315) = ( 0.2340425 0.5000000 0.5000000), wk = 0.0023364 k( 316) = ( 0.2234043 0.5000000 0.5000000), wk = 0.0023364 k( 317) = ( 0.2127660 0.5000000 0.5000000), wk = 0.0023364 k( 318) = ( 0.2021277 0.5000000 0.5000000), wk = 0.0023364 k( 319) = ( 0.1914894 0.5000000 0.5000000), wk = 0.0023364 k( 320) = ( 0.1808511 0.5000000 0.5000000), wk = 0.0023364 k( 321) = ( 0.1702128 0.5000000 0.5000000), wk = 0.0023364 k( 322) = ( 0.1595745 0.5000000 0.5000000), wk = 0.0023364 k( 323) = ( 0.1489362 0.5000000 0.5000000), wk = 0.0023364 k( 324) = ( 0.1382979 0.5000000 0.5000000), wk = 0.0023364 k( 325) = ( 0.1276596 0.5000000 0.5000000), wk = 0.0023364 k( 326) = ( 0.1170213 0.5000000 0.5000000), wk = 0.0023364 k( 327) = ( 0.1063830 0.5000000 0.5000000), wk = 0.0023364 k( 328) = ( 0.0957447 0.5000000 0.5000000), wk = 0.0023364 k( 329) = ( 0.0851064 0.5000000 0.5000000), wk = 0.0023364 k( 330) = ( 0.0744681 0.5000000 0.5000000), wk = 0.0023364 k( 331) = ( 0.0638298 0.5000000 0.5000000), wk = 0.0023364 k( 332) = ( 0.0531915 0.5000000 0.5000000), wk = 0.0023364 k( 333) = ( 0.0425532 0.5000000 0.5000000), wk = 0.0023364 k( 334) = ( 0.0319149 0.5000000 0.5000000), wk = 0.0023364 k( 335) = ( 0.0212766 0.5000000 0.5000000), wk = 0.0023364 k( 336) = ( 0.0106383 0.5000000 0.5000000), wk = 0.0023364 k( 337) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023364 k( 338) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023364 k( 339) = ( 0.0000000 0.4880952 0.5000000), wk = 0.0023364 k( 340) = ( 0.0000000 0.4761905 0.5000000), wk = 0.0023364 k( 341) = ( 0.0000000 0.4642857 0.5000000), wk = 0.0023364 k( 342) = ( 0.0000000 0.4523810 0.5000000), wk = 0.0023364 k( 343) = ( 0.0000000 0.4404762 0.5000000), wk = 0.0023364 k( 344) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0023364 k( 345) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0023364 k( 346) = ( 0.0000000 0.4047619 0.5000000), wk = 0.0023364 k( 347) = ( 0.0000000 0.3928571 0.5000000), wk = 0.0023364 k( 348) = ( 0.0000000 0.3809524 0.5000000), wk = 0.0023364 k( 349) = ( 0.0000000 0.3690476 0.5000000), wk = 0.0023364 k( 350) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0023364 k( 351) = ( 0.0000000 0.3452381 0.5000000), wk = 0.0023364 k( 352) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0023364 k( 353) = ( 0.0000000 0.3214286 0.5000000), wk = 0.0023364 k( 354) = ( 0.0000000 0.3095238 0.5000000), wk = 0.0023364 k( 355) = ( 0.0000000 0.2976191 0.5000000), wk = 0.0023364 k( 356) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0023364 k( 357) = ( 0.0000000 0.2738095 0.5000000), wk = 0.0023364 k( 358) = ( 0.0000000 0.2619048 0.5000000), wk = 0.0023364 k( 359) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0023364 k( 360) = ( 0.0000000 0.2380952 0.5000000), wk = 0.0023364 k( 361) = ( 0.0000000 0.2261905 0.5000000), wk = 0.0023364 k( 362) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0023364 k( 363) = ( 0.0000000 0.2023810 0.5000000), wk = 0.0023364 k( 364) = ( 0.0000000 0.1904762 0.5000000), wk = 0.0023364 k( 365) = ( 0.0000000 0.1785714 0.5000000), wk = 0.0023364 k( 366) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0023364 k( 367) = ( 0.0000000 0.1547619 0.5000000), wk = 0.0023364 k( 368) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0023364 k( 369) = ( 0.0000000 0.1309524 0.5000000), wk = 0.0023364 k( 370) = ( 0.0000000 0.1190476 0.5000000), wk = 0.0023364 k( 371) = ( 0.0000000 0.1071429 0.5000000), wk = 0.0023364 k( 372) = ( 0.0000000 0.0952381 0.5000000), wk = 0.0023364 k( 373) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0023364 k( 374) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0023364 k( 375) = ( 0.0000000 0.0595238 0.5000000), wk = 0.0023364 k( 376) = ( 0.0000000 0.0476191 0.5000000), wk = 0.0023364 k( 377) = ( 0.0000000 0.0357143 0.5000000), wk = 0.0023364 k( 378) = ( 0.0000000 0.0238095 0.5000000), wk = 0.0023364 k( 379) = ( 0.0000000 0.0119048 0.5000000), wk = 0.0023364 k( 380) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023364 k( 381) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023364 k( 382) = ( 0.0000000 0.5000000 0.0333333), wk = 0.0023364 k( 383) = ( 0.0000000 0.5000000 0.0666667), wk = 0.0023364 k( 384) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0023364 k( 385) = ( 0.0000000 0.5000000 0.1333333), wk = 0.0023364 k( 386) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0023364 k( 387) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0023364 k( 388) = ( 0.0000000 0.5000000 0.2333333), wk = 0.0023364 k( 389) = ( 0.0000000 0.5000000 0.2666667), wk = 0.0023364 k( 390) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0023364 k( 391) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0023364 k( 392) = ( 0.0000000 0.5000000 0.3666667), wk = 0.0023364 k( 393) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0023364 k( 394) = ( 0.0000000 0.5000000 0.4333333), wk = 0.0023364 k( 395) = ( 0.0000000 0.5000000 0.4666667), wk = 0.0023364 k( 396) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023364 k( 397) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023364 k( 398) = ( 0.5000000 0.0000000 0.4666667), wk = 0.0023364 k( 399) = ( 0.5000000 0.0000000 0.4333333), wk = 0.0023364 k( 400) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0023364 k( 401) = ( 0.5000000 0.0000000 0.3666667), wk = 0.0023364 k( 402) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0023364 k( 403) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0023364 k( 404) = ( 0.5000000 0.0000000 0.2666667), wk = 0.0023364 k( 405) = ( 0.5000000 0.0000000 0.2333333), wk = 0.0023364 k( 406) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0023364 k( 407) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0023364 k( 408) = ( 0.5000000 0.0000000 0.1333333), wk = 0.0023364 k( 409) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0023364 k( 410) = ( 0.5000000 0.0000000 0.0666667), wk = 0.0023364 k( 411) = ( 0.5000000 0.0000000 0.0333333), wk = 0.0023364 k( 412) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023364 k( 413) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023364 k( 414) = ( 0.5000000 0.5000000 0.0333333), wk = 0.0023364 k( 415) = ( 0.5000000 0.5000000 0.0666667), wk = 0.0023364 k( 416) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0023364 k( 417) = ( 0.5000000 0.5000000 0.1333333), wk = 0.0023364 k( 418) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0023364 k( 419) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0023364 k( 420) = ( 0.5000000 0.5000000 0.2333333), wk = 0.0023364 k( 421) = ( 0.5000000 0.5000000 0.2666667), wk = 0.0023364 k( 422) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0023364 k( 423) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0023364 k( 424) = ( 0.5000000 0.5000000 0.3666667), wk = 0.0023364 k( 425) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0023364 k( 426) = ( 0.5000000 0.5000000 0.4333333), wk = 0.0023364 k( 427) = ( 0.5000000 0.5000000 0.4666667), wk = 0.0023364 k( 428) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023364 Dense grid: 152399 G-vectors FFT dimensions: ( 45, 50, 144) Smooth grid: 40137 G-vectors FFT dimensions: ( 27, 32, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.28 Mb ( 320, 58) NL pseudopotentials 0.50 Mb ( 160, 204) Each V/rho on FFT grid 0.17 Mb ( 11250) Each G-vector array 0.04 Mb ( 4759) G-vector shells 0.02 Mb ( 2405) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.13 Mb ( 320, 232) Each subspace H/S matrix 0.82 Mb ( 232, 232) Each matrix 0.36 Mb ( 204, 2, 58) The potential is recalculated from file : ./PdCl2.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 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 5.6 secs Computing kpt #: 3 total cpu time spent up to now is 6.8 secs Computing kpt #: 4 total cpu time spent up to now is 8.0 secs Computing kpt #: 5 total cpu time spent up to now is 9.1 secs Computing kpt #: 6 total cpu time spent up to now is 10.3 secs Computing kpt #: 7 total cpu time spent up to now is 11.5 secs Computing kpt #: 8 total cpu time spent up to now is 12.7 secs Computing kpt #: 9 total cpu time spent up to now is 13.9 secs Computing kpt #: 10 total cpu time spent up to now is 15.1 secs Computing kpt #: 11 total cpu time spent up to now is 16.3 secs Computing kpt #: 12 total cpu time spent up to now is 17.5 secs Computing kpt #: 13 total cpu time spent up to now is 18.7 secs Computing kpt #: 14 total cpu time spent up to now is 19.9 secs Computing kpt #: 15 total cpu time spent up to now is 21.2 secs Computing kpt #: 16 total cpu time spent up to now is 22.4 secs Computing kpt #: 17 total cpu time spent up to now is 23.6 secs Computing kpt #: 18 total cpu time spent up to now is 24.8 secs Computing kpt #: 19 total cpu time spent up to now is 26.0 secs Computing kpt #: 20 total cpu time spent up to now is 27.2 secs Computing kpt #: 21 total cpu time spent up to now is 28.5 secs Computing kpt #: 22 total cpu time spent up to now is 29.8 secs Computing kpt #: 23 total cpu time spent up to now is 31.0 secs Computing kpt #: 24 total cpu time spent up to now is 32.3 secs Computing kpt #: 25 total cpu time spent up to now is 33.6 secs Computing kpt #: 26 total cpu time spent up to now is 34.9 secs Computing kpt #: 27 total cpu time spent up to now is 36.2 secs Computing kpt #: 28 total cpu time spent up to now is 37.7 secs Computing kpt #: 29 total cpu time spent up to now is 39.1 secs Computing kpt #: 30 total cpu time spent up to now is 40.7 secs Computing kpt #: 31 total cpu time spent up to now is 42.1 secs Computing kpt #: 32 total cpu time spent up to now is 43.4 secs Computing kpt #: 33 total cpu time spent up to now is 44.7 secs Computing kpt #: 34 total cpu time spent up to now is 46.0 secs Computing kpt #: 35 total cpu time spent up to now is 47.2 secs Computing kpt #: 36 total cpu time spent up to now is 48.3 secs Computing kpt #: 37 total cpu time spent up to now is 49.4 secs Computing kpt #: 38 total cpu time spent up to now is 50.5 secs Computing kpt #: 39 total cpu time spent up to now is 51.6 secs Computing kpt #: 40 total cpu time spent up to now is 52.7 secs Computing kpt #: 41 total cpu time spent up to now is 53.8 secs Computing kpt #: 42 total cpu time spent up to now is 54.9 secs Computing kpt #: 43 total cpu time spent up to now is 56.0 secs Computing kpt #: 44 total cpu time spent up to now is 57.2 secs Computing kpt #: 45 total cpu time spent up to now is 58.3 secs Computing kpt #: 46 total cpu time spent up to now is 59.5 secs Computing kpt #: 47 total cpu time spent up to now is 60.7 secs Computing kpt #: 48 total cpu time spent up to now is 61.9 secs Computing kpt #: 49 total cpu time spent up to now is 63.0 secs Computing kpt #: 50 total cpu time spent up to now is 65.1 secs Computing kpt #: 51 total cpu time spent up to now is 66.9 secs Computing kpt #: 52 total cpu time spent up to now is 68.7 secs Computing kpt #: 53 total cpu time spent up to now is 71.1 secs Computing kpt #: 54 total cpu time spent up to now is 73.4 secs Computing kpt #: 55 total cpu time spent up to now is 75.7 secs Computing kpt #: 56 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 78.1 secs Computing kpt #: 57 total cpu time spent up to now is 80.4 secs Computing kpt #: 58 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 82.8 secs Computing kpt #: 59 total cpu time spent up to now is 85.0 secs Computing kpt #: 60 total cpu time spent up to now is 87.1 secs Computing kpt #: 61 total cpu time spent up to now is 89.2 secs Computing kpt #: 62 total cpu time spent up to now is 91.2 secs Computing kpt #: 63 total cpu time spent up to now is 93.0 secs Computing kpt #: 64 total cpu time spent up to now is 94.7 secs Computing kpt #: 65 total cpu time spent up to now is 96.2 secs Computing kpt #: 66 total cpu time spent up to now is 97.6 secs Computing kpt #: 67 total cpu time spent up to now is 99.0 secs Computing kpt #: 68 total cpu time spent up to now is 100.3 secs Computing kpt #: 69 total cpu time spent up to now is 101.4 secs Computing kpt #: 70 total cpu time spent up to now is 102.7 secs Computing kpt #: 71 total cpu time spent up to now is 103.9 secs Computing kpt #: 72 total cpu time spent up to now is 105.1 secs Computing kpt #: 73 total cpu time spent up to now is 106.3 secs Computing kpt #: 74 total cpu time spent up to now is 107.5 secs Computing kpt #: 75 total cpu time spent up to now is 110.3 secs Computing kpt #: 76 total cpu time spent up to now is 112.6 secs Computing kpt #: 77 total cpu time spent up to now is 113.9 secs Computing kpt #: 78 total cpu time spent up to now is 115.1 secs Computing kpt #: 79 total cpu time spent up to now is 116.3 secs Computing kpt #: 80 total cpu time spent up to now is 117.5 secs Computing kpt #: 81 total cpu time spent up to now is 118.8 secs Computing kpt #: 82 total cpu time spent up to now is 120.0 secs Computing kpt #: 83 total cpu time spent up to now is 121.2 secs Computing kpt #: 84 total cpu time spent up to now is 122.4 secs Computing kpt #: 85 total cpu time spent up to now is 123.7 secs Computing kpt #: 86 total cpu time spent up to now is 124.9 secs Computing kpt #: 87 total cpu time spent up to now is 126.1 secs Computing kpt #: 88 total cpu time spent up to now is 127.3 secs Computing kpt #: 89 total cpu time spent up to now is 128.6 secs Computing kpt #: 90 total cpu time spent up to now is 129.8 secs Computing kpt #: 91 total cpu time spent up to now is 131.1 secs Computing kpt #: 92 total cpu time spent up to now is 132.3 secs Computing kpt #: 93 total cpu time spent up to now is 133.5 secs Computing kpt #: 94 total cpu time spent up to now is 134.7 secs Computing kpt #: 95 total cpu time spent up to now is 136.0 secs Computing kpt #: 96 total cpu time spent up to now is 137.2 secs Computing kpt #: 97 total cpu time spent up to now is 138.5 secs Computing kpt #: 98 total cpu time spent up to now is 139.7 secs Computing kpt #: 99 total cpu time spent up to now is 140.9 secs Computing kpt #: 100 total cpu time spent up to now is 142.2 secs Computing kpt #: 101 total cpu time spent up to now is 143.4 secs Computing kpt #: 102 total cpu time spent up to now is 144.6 secs Computing kpt #: 103 total cpu time spent up to now is 145.9 secs Computing kpt #: 104 total cpu time spent up to now is 147.1 secs Computing kpt #: 105 total cpu time spent up to now is 148.4 secs Computing kpt #: 106 total cpu time spent up to now is 149.6 secs Computing kpt #: 107 total cpu time spent up to now is 150.9 secs Computing kpt #: 108 total cpu time spent up to now is 152.2 secs Computing kpt #: 109 total cpu time spent up to now is 153.6 secs Computing kpt #: 110 total cpu time spent up to now is 155.4 secs Computing kpt #: 111 total cpu time spent up to now is 157.1 secs Computing kpt #: 112 total cpu time spent up to now is 159.0 secs Computing kpt #: 113 total cpu time spent up to now is 161.0 secs Computing kpt #: 114 total cpu time spent up to now is 162.9 secs Computing kpt #: 115 total cpu time spent up to now is 164.6 secs Computing kpt #: 116 total cpu time spent up to now is 166.1 secs Computing kpt #: 117 total cpu time spent up to now is 167.9 secs Computing kpt #: 118 total cpu time spent up to now is 169.2 secs Computing kpt #: 119 total cpu time spent up to now is 170.4 secs Computing kpt #: 120 total cpu time spent up to now is 171.7 secs Computing kpt #: 121 total cpu time spent up to now is 173.0 secs Computing kpt #: 122 total cpu time spent up to now is 174.2 secs Computing kpt #: 123 total cpu time spent up to now is 175.9 secs Computing kpt #: 124 total cpu time spent up to now is 177.2 secs Computing kpt #: 125 total cpu time spent up to now is 178.5 secs Computing kpt #: 126 total cpu time spent up to now is 179.7 secs Computing kpt #: 127 total cpu time spent up to now is 181.0 secs Computing kpt #: 128 total cpu time spent up to now is 182.2 secs Computing kpt #: 129 total cpu time spent up to now is 183.5 secs Computing kpt #: 130 total cpu time spent up to now is 184.7 secs Computing kpt #: 131 total cpu time spent up to now is 186.0 secs Computing kpt #: 132 total cpu time spent up to now is 187.8 secs Computing kpt #: 133 total cpu time spent up to now is 189.1 secs Computing kpt #: 134 total cpu time spent up to now is 190.3 secs Computing kpt #: 135 total cpu time spent up to now is 191.6 secs Computing kpt #: 136 total cpu time spent up to now is 193.4 secs Computing kpt #: 137 total cpu time spent up to now is 194.7 secs Computing kpt #: 138 total cpu time spent up to now is 197.0 secs Computing kpt #: 139 total cpu time spent up to now is 198.2 secs Computing kpt #: 140 total cpu time spent up to now is 199.4 secs Computing kpt #: 141 total cpu time spent up to now is 200.7 secs Computing kpt #: 142 total cpu time spent up to now is 201.9 secs Computing kpt #: 143 total cpu time spent up to now is 203.1 secs Computing kpt #: 144 total cpu time spent up to now is 204.4 secs Computing kpt #: 145 total cpu time spent up to now is 205.6 secs Computing kpt #: 146 total cpu time spent up to now is 206.8 secs Computing kpt #: 147 total cpu time spent up to now is 208.0 secs Computing kpt #: 148 total cpu time spent up to now is 209.2 secs Computing kpt #: 149 total cpu time spent up to now is 210.5 secs Computing kpt #: 150 total cpu time spent up to now is 211.7 secs Computing kpt #: 151 total cpu time spent up to now is 212.9 secs Computing kpt #: 152 total cpu time spent up to now is 214.1 secs Computing kpt #: 153 total cpu time spent up to now is 215.4 secs Computing kpt #: 154 total cpu time spent up to now is 216.6 secs Computing kpt #: 155 total cpu time spent up to now is 218.0 secs Computing kpt #: 156 total cpu time spent up to now is 219.6 secs Computing kpt #: 157 total cpu time spent up to now is 221.4 secs Computing kpt #: 158 total cpu time spent up to now is 222.8 secs Computing kpt #: 159 total cpu time spent up to now is 224.3 secs Computing kpt #: 160 total cpu time spent up to now is 225.7 secs Computing kpt #: 161 total cpu time spent up to now is 226.9 secs Computing kpt #: 162 total cpu time spent up to now is 228.2 secs Computing kpt #: 163 total cpu time spent up to now is 229.5 secs Computing kpt #: 164 total cpu time spent up to now is 230.7 secs Computing kpt #: 165 total cpu time spent up to now is 231.9 secs Computing kpt #: 166 total cpu time spent up to now is 233.1 secs Computing kpt #: 167 total cpu time spent up to now is 234.3 secs Computing kpt #: 168 total cpu time spent up to now is 235.5 secs Computing kpt #: 169 total cpu time spent up to now is 236.7 secs Computing kpt #: 170 total cpu time spent up to now is 237.9 secs Computing kpt #: 171 total cpu time spent up to now is 239.1 secs Computing kpt #: 172 total cpu time spent up to now is 240.3 secs Computing kpt #: 173 total cpu time spent up to now is 241.5 secs Computing kpt #: 174 total cpu time spent up to now is 242.6 secs Computing kpt #: 175 total cpu time spent up to now is 243.8 secs Computing kpt #: 176 total cpu time spent up to now is 245.0 secs Computing kpt #: 177 total cpu time spent up to now is 246.1 secs Computing kpt #: 178 total cpu time spent up to now is 247.3 secs Computing kpt #: 179 total cpu time spent up to now is 248.5 secs Computing kpt #: 180 total cpu time spent up to now is 249.6 secs Computing kpt #: 181 total cpu time spent up to now is 250.8 secs Computing kpt #: 182 total cpu time spent up to now is 252.0 secs Computing kpt #: 183 total cpu time spent up to now is 253.2 secs Computing kpt #: 184 total cpu time spent up to now is 254.4 secs Computing kpt #: 185 total cpu time spent up to now is 255.6 secs Computing kpt #: 186 total cpu time spent up to now is 256.8 secs Computing kpt #: 187 total cpu time spent up to now is 258.0 secs Computing kpt #: 188 total cpu time spent up to now is 259.2 secs Computing kpt #: 189 total cpu time spent up to now is 260.4 secs Computing kpt #: 190 total cpu time spent up to now is 261.6 secs Computing kpt #: 191 total cpu time spent up to now is 262.8 secs Computing kpt #: 192 total cpu time spent up to now is 264.0 secs Computing kpt #: 193 total cpu time spent up to now is 265.2 secs Computing kpt #: 194 total cpu time spent up to now is 266.4 secs Computing kpt #: 195 total cpu time spent up to now is 267.5 secs Computing kpt #: 196 total cpu time spent up to now is 268.7 secs Computing kpt #: 197 total cpu time spent up to now is 269.9 secs Computing kpt #: 198 total cpu time spent up to now is 271.1 secs Computing kpt #: 199 total cpu time spent up to now is 272.2 secs Computing kpt #: 200 total cpu time spent up to now is 273.4 secs Computing kpt #: 201 total cpu time spent up to now is 274.6 secs Computing kpt #: 202 total cpu time spent up to now is 275.8 secs Computing kpt #: 203 total cpu time spent up to now is 277.0 secs Computing kpt #: 204 total cpu time spent up to now is 278.1 secs Computing kpt #: 205 total cpu time spent up to now is 279.3 secs Computing kpt #: 206 total cpu time spent up to now is 280.5 secs Computing kpt #: 207 total cpu time spent up to now is 281.7 secs Computing kpt #: 208 total cpu time spent up to now is 282.9 secs Computing kpt #: 209 total cpu time spent up to now is 284.1 secs Computing kpt #: 210 total cpu time spent up to now is 285.3 secs Computing kpt #: 211 total cpu time spent up to now is 286.5 secs Computing kpt #: 212 total cpu time spent up to now is 287.6 secs Computing kpt #: 213 total cpu time spent up to now is 288.8 secs Computing kpt #: 214 total cpu time spent up to now is 290.0 secs Computing kpt #: 215 total cpu time spent up to now is 291.2 secs Computing kpt #: 216 total cpu time spent up to now is 292.5 secs Computing kpt #: 217 total cpu time spent up to now is 293.7 secs Computing kpt #: 218 total cpu time spent up to now is 294.9 secs Computing kpt #: 219 total cpu time spent up to now is 296.3 secs Computing kpt #: 220 total cpu time spent up to now is 297.7 secs Computing kpt #: 221 total cpu time spent up to now is 299.0 secs Computing kpt #: 222 total cpu time spent up to now is 300.2 secs Computing kpt #: 223 total cpu time spent up to now is 301.8 secs Computing kpt #: 224 total cpu time spent up to now is 303.3 secs Computing kpt #: 225 total cpu time spent up to now is 304.7 secs Computing kpt #: 226 total cpu time spent up to now is 305.9 secs Computing kpt #: 227 total cpu time spent up to now is 307.3 secs Computing kpt #: 228 total cpu time spent up to now is 308.8 secs Computing kpt #: 229 total cpu time spent up to now is 310.3 secs Computing kpt #: 230 total cpu time spent up to now is 311.7 secs Computing kpt #: 231 total cpu time spent up to now is 313.2 secs Computing kpt #: 232 total cpu time spent up to now is 314.4 secs Computing kpt #: 233 total cpu time spent up to now is 315.6 secs Computing kpt #: 234 total cpu time spent up to now is 317.0 secs Computing kpt #: 235 total cpu time spent up to now is 318.3 secs Computing kpt #: 236 total cpu time spent up to now is 319.5 secs Computing kpt #: 237 total cpu time spent up to now is 320.7 secs Computing kpt #: 238 total cpu time spent up to now is 322.1 secs Computing kpt #: 239 total cpu time spent up to now is 323.3 secs Computing kpt #: 240 total cpu time spent up to now is 324.5 secs Computing kpt #: 241 total cpu time spent up to now is 325.7 secs Computing kpt #: 242 total cpu time spent up to now is 326.8 secs Computing kpt #: 243 total cpu time spent up to now is 328.0 secs Computing kpt #: 244 total cpu time spent up to now is 329.2 secs Computing kpt #: 245 total cpu time spent up to now is 330.6 secs Computing kpt #: 246 total cpu time spent up to now is 332.0 secs Computing kpt #: 247 total cpu time spent up to now is 333.4 secs Computing kpt #: 248 total cpu time spent up to now is 334.5 secs Computing kpt #: 249 total cpu time spent up to now is 335.7 secs Computing kpt #: 250 total cpu time spent up to now is 337.1 secs Computing kpt #: 251 total cpu time spent up to now is 338.5 secs Computing kpt #: 252 total cpu time spent up to now is 339.9 secs Computing kpt #: 253 total cpu time spent up to now is 341.3 secs Computing kpt #: 254 total cpu time spent up to now is 342.7 secs Computing kpt #: 255 total cpu time spent up to now is 344.1 secs Computing kpt #: 256 total cpu time spent up to now is 345.6 secs Computing kpt #: 257 total cpu time spent up to now is 347.0 secs Computing kpt #: 258 total cpu time spent up to now is 348.4 secs Computing kpt #: 259 total cpu time spent up to now is 349.8 secs Computing kpt #: 260 total cpu time spent up to now is 351.3 secs Computing kpt #: 261 total cpu time spent up to now is 352.7 secs Computing kpt #: 262 total cpu time spent up to now is 354.1 secs Computing kpt #: 263 total cpu time spent up to now is 355.6 secs Computing kpt #: 264 total cpu time spent up to now is 357.0 secs Computing kpt #: 265 total cpu time spent up to now is 358.4 secs Computing kpt #: 266 total cpu time spent up to now is 359.8 secs Computing kpt #: 267 total cpu time spent up to now is 361.0 secs Computing kpt #: 268 total cpu time spent up to now is 362.4 secs Computing kpt #: 269 total cpu time spent up to now is 363.6 secs Computing kpt #: 270 total cpu time spent up to now is 364.8 secs Computing kpt #: 271 total cpu time spent up to now is 366.0 secs Computing kpt #: 272 total cpu time spent up to now is 367.2 secs Computing kpt #: 273 total cpu time spent up to now is 368.5 secs Computing kpt #: 274 total cpu time spent up to now is 369.7 secs Computing kpt #: 275 total cpu time spent up to now is 370.9 secs Computing kpt #: 276 total cpu time spent up to now is 372.2 secs Computing kpt #: 277 total cpu time spent up to now is 373.4 secs Computing kpt #: 278 total cpu time spent up to now is 374.6 secs Computing kpt #: 279 total cpu time spent up to now is 375.9 secs Computing kpt #: 280 total cpu time spent up to now is 377.1 secs Computing kpt #: 281 total cpu time spent up to now is 378.4 secs Computing kpt #: 282 total cpu time spent up to now is 379.6 secs Computing kpt #: 283 total cpu time spent up to now is 380.9 secs Computing kpt #: 284 total cpu time spent up to now is 382.1 secs Computing kpt #: 285 total cpu time spent up to now is 383.4 secs Computing kpt #: 286 total cpu time spent up to now is 384.6 secs Computing kpt #: 287 total cpu time spent up to now is 385.9 secs Computing kpt #: 288 total cpu time spent up to now is 387.1 secs Computing kpt #: 289 total cpu time spent up to now is 388.4 secs Computing kpt #: 290 total cpu time spent up to now is 389.6 secs Computing kpt #: 291 total cpu time spent up to now is 390.9 secs Computing kpt #: 292 total cpu time spent up to now is 392.1 secs Computing kpt #: 293 total cpu time spent up to now is 393.4 secs Computing kpt #: 294 total cpu time spent up to now is 394.6 secs Computing kpt #: 295 total cpu time spent up to now is 395.9 secs Computing kpt #: 296 total cpu time spent up to now is 397.1 secs Computing kpt #: 297 total cpu time spent up to now is 398.4 secs Computing kpt #: 298 total cpu time spent up to now is 399.6 secs Computing kpt #: 299 total cpu time spent up to now is 400.8 secs Computing kpt #: 300 total cpu time spent up to now is 402.0 secs Computing kpt #: 301 total cpu time spent up to now is 403.2 secs Computing kpt #: 302 total cpu time spent up to now is 404.5 secs Computing kpt #: 303 total cpu time spent up to now is 405.6 secs Computing kpt #: 304 total cpu time spent up to now is 406.9 secs Computing kpt #: 305 total cpu time spent up to now is 408.6 secs Computing kpt #: 306 total cpu time spent up to now is 411.5 secs Computing kpt #: 307 total cpu time spent up to now is 413.1 secs Computing kpt #: 308 total cpu time spent up to now is 414.3 secs Computing kpt #: 309 total cpu time spent up to now is 415.5 secs Computing kpt #: 310 total cpu time spent up to now is 416.7 secs Computing kpt #: 311 total cpu time spent up to now is 417.9 secs Computing kpt #: 312 total cpu time spent up to now is 419.1 secs Computing kpt #: 313 total cpu time spent up to now is 420.3 secs Computing kpt #: 314 total cpu time spent up to now is 421.5 secs Computing kpt #: 315 total cpu time spent up to now is 422.7 secs Computing kpt #: 316 total cpu time spent up to now is 423.9 secs Computing kpt #: 317 total cpu time spent up to now is 425.0 secs Computing kpt #: 318 total cpu time spent up to now is 426.2 secs Computing kpt #: 319 total cpu time spent up to now is 427.4 secs Computing kpt #: 320 total cpu time spent up to now is 428.5 secs Computing kpt #: 321 total cpu time spent up to now is 429.7 secs Computing kpt #: 322 total cpu time spent up to now is 430.9 secs Computing kpt #: 323 total cpu time spent up to now is 432.0 secs Computing kpt #: 324 total cpu time spent up to now is 433.2 secs Computing kpt #: 325 total cpu time spent up to now is 434.4 secs Computing kpt #: 326 total cpu time spent up to now is 435.6 secs Computing kpt #: 327 total cpu time spent up to now is 436.8 secs Computing kpt #: 328 total cpu time spent up to now is 437.9 secs Computing kpt #: 329 total cpu time spent up to now is 439.1 secs Computing kpt #: 330 total cpu time spent up to now is 440.3 secs Computing kpt #: 331 total cpu time spent up to now is 441.5 secs Computing kpt #: 332 total cpu time spent up to now is 442.6 secs Computing kpt #: 333 total cpu time spent up to now is 443.9 secs Computing kpt #: 334 total cpu time spent up to now is 445.1 secs Computing kpt #: 335 total cpu time spent up to now is 446.2 secs Computing kpt #: 336 total cpu time spent up to now is 447.4 secs Computing kpt #: 337 total cpu time spent up to now is 448.6 secs Computing kpt #: 338 total cpu time spent up to now is 449.7 secs Computing kpt #: 339 total cpu time spent up to now is 450.9 secs Computing kpt #: 340 total cpu time spent up to now is 452.1 secs Computing kpt #: 341 total cpu time spent up to now is 453.3 secs Computing kpt #: 342 total cpu time spent up to now is 454.5 secs Computing kpt #: 343 total cpu time spent up to now is 455.7 secs Computing kpt #: 344 total cpu time spent up to now is 456.9 secs Computing kpt #: 345 total cpu time spent up to now is 458.1 secs Computing kpt #: 346 total cpu time spent up to now is 459.3 secs Computing kpt #: 347 total cpu time spent up to now is 460.4 secs Computing kpt #: 348 total cpu time spent up to now is 461.7 secs Computing kpt #: 349 total cpu time spent up to now is 462.8 secs Computing kpt #: 350 total cpu time spent up to now is 464.0 secs Computing kpt #: 351 total cpu time spent up to now is 466.0 secs Computing kpt #: 352 total cpu time spent up to now is 467.2 secs Computing kpt #: 353 total cpu time spent up to now is 468.4 secs Computing kpt #: 354 total cpu time spent up to now is 469.5 secs Computing kpt #: 355 total cpu time spent up to now is 470.7 secs Computing kpt #: 356 total cpu time spent up to now is 471.8 secs Computing kpt #: 357 total cpu time spent up to now is 473.0 secs Computing kpt #: 358 total cpu time spent up to now is 474.1 secs Computing kpt #: 359 total cpu time spent up to now is 475.3 secs Computing kpt #: 360 total cpu time spent up to now is 476.4 secs Computing kpt #: 361 total cpu time spent up to now is 477.5 secs Computing kpt #: 362 total cpu time spent up to now is 478.6 secs Computing kpt #: 363 total cpu time spent up to now is 479.7 secs Computing kpt #: 364 total cpu time spent up to now is 480.9 secs Computing kpt #: 365 total cpu time spent up to now is 482.0 secs Computing kpt #: 366 total cpu time spent up to now is 483.2 secs Computing kpt #: 367 total cpu time spent up to now is 484.3 secs Computing kpt #: 368 total cpu time spent up to now is 485.5 secs Computing kpt #: 369 total cpu time spent up to now is 486.6 secs Computing kpt #: 370 total cpu time spent up to now is 487.8 secs Computing kpt #: 371 total cpu time spent up to now is 488.9 secs Computing kpt #: 372 total cpu time spent up to now is 490.1 secs Computing kpt #: 373 total cpu time spent up to now is 491.3 secs Computing kpt #: 374 total cpu time spent up to now is 492.4 secs Computing kpt #: 375 total cpu time spent up to now is 493.5 secs Computing kpt #: 376 total cpu time spent up to now is 494.7 secs Computing kpt #: 377 total cpu time spent up to now is 495.9 secs Computing kpt #: 378 total cpu time spent up to now is 497.0 secs Computing kpt #: 379 total cpu time spent up to now is 498.2 secs Computing kpt #: 380 total cpu time spent up to now is 499.3 secs Computing kpt #: 381 total cpu time spent up to now is 500.5 secs Computing kpt #: 382 total cpu time spent up to now is 501.7 secs Computing kpt #: 383 total cpu time spent up to now is 502.9 secs Computing kpt #: 384 total cpu time spent up to now is 504.1 secs Computing kpt #: 385 total cpu time spent up to now is 505.2 secs Computing kpt #: 386 total cpu time spent up to now is 506.4 secs Computing kpt #: 387 total cpu time spent up to now is 507.6 secs Computing kpt #: 388 total cpu time spent up to now is 508.8 secs Computing kpt #: 389 total cpu time spent up to now is 510.0 secs Computing kpt #: 390 total cpu time spent up to now is 511.2 secs Computing kpt #: 391 total cpu time spent up to now is 512.4 secs Computing kpt #: 392 total cpu time spent up to now is 513.6 secs Computing kpt #: 393 total cpu time spent up to now is 514.7 secs Computing kpt #: 394 total cpu time spent up to now is 515.9 secs Computing kpt #: 395 total cpu time spent up to now is 517.1 secs Computing kpt #: 396 total cpu time spent up to now is 518.3 secs Computing kpt #: 397 total cpu time spent up to now is 519.5 secs Computing kpt #: 398 total cpu time spent up to now is 520.8 secs Computing kpt #: 399 total cpu time spent up to now is 522.0 secs Computing kpt #: 400 total cpu time spent up to now is 523.2 secs Computing kpt #: 401 total cpu time spent up to now is 524.6 secs Computing kpt #: 402 total cpu time spent up to now is 525.8 secs Computing kpt #: 403 total cpu time spent up to now is 527.2 secs Computing kpt #: 404 total cpu time spent up to now is 528.6 secs Computing kpt #: 405 total cpu time spent up to now is 530.0 secs Computing kpt #: 406 total cpu time spent up to now is 531.4 secs Computing kpt #: 407 total cpu time spent up to now is 532.7 secs Computing kpt #: 408 total cpu time spent up to now is 534.4 secs Computing kpt #: 409 total cpu time spent up to now is 536.1 secs Computing kpt #: 410 total cpu time spent up to now is 537.9 secs Computing kpt #: 411 total cpu time spent up to now is 539.7 secs Computing kpt #: 412 total cpu time spent up to now is 540.9 secs Computing kpt #: 413 total cpu time spent up to now is 542.1 secs Computing kpt #: 414 total cpu time spent up to now is 543.3 secs Computing kpt #: 415 total cpu time spent up to now is 544.6 secs Computing kpt #: 416 total cpu time spent up to now is 545.8 secs Computing kpt #: 417 total cpu time spent up to now is 547.0 secs Computing kpt #: 418 total cpu time spent up to now is 548.3 secs Computing kpt #: 419 total cpu time spent up to now is 549.5 secs Computing kpt #: 420 total cpu time spent up to now is 550.7 secs Computing kpt #: 421 total cpu time spent up to now is 552.0 secs Computing kpt #: 422 total cpu time spent up to now is 553.2 secs Computing kpt #: 423 total cpu time spent up to now is 554.7 secs Computing kpt #: 424 total cpu time spent up to now is 556.0 secs Computing kpt #: 425 total cpu time spent up to now is 557.2 secs Computing kpt #: 426 total cpu time spent up to now is 558.5 secs Computing kpt #: 427 total cpu time spent up to now is 559.7 secs Computing kpt #: 428 total cpu time spent up to now is 560.9 secs ethr = 2.08E-11, avg # of iterations = 36.9 total cpu time spent up to now is 561.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5035 PWs) bands (ev): -11.4909 -11.4909 -11.2566 -11.2566 -10.8438 -10.8438 -10.5500 -10.5500 -1.6145 -1.6145 -1.0458 -1.0458 -1.0188 -1.0188 -0.9447 -0.9447 0.7173 0.7173 0.8111 0.8111 1.1072 1.1072 1.7364 1.7364 1.8383 1.8383 1.9590 1.9590 2.1435 2.1435 2.2437 2.2437 2.2741 2.2741 2.3400 2.3400 2.8880 2.8880 2.9093 2.9093 3.2641 3.2641 3.3690 3.3690 4.0655 4.0655 4.2477 4.2477 5.6069 5.6069 5.9064 5.9064 8.7581 8.7581 10.0803 10.0803 10.3132 10.3132 k = 0.0106-0.0000-0.0000 ( 5041 PWs) bands (ev): -11.4902 -11.4902 -11.2560 -11.2560 -10.8437 -10.8437 -10.5501 -10.5501 -1.6131 -1.6131 -1.0453 -1.0453 -1.0186 -1.0186 -0.9453 -0.9453 0.7182 0.7182 0.8120 0.8120 1.1092 1.1092 1.7223 1.7223 1.8353 1.8353 1.9356 1.9356 2.1615 2.1615 2.2428 2.2428 2.2873 2.2873 2.3384 2.3384 2.8899 2.8899 2.9116 2.9116 3.2646 3.2646 3.3693 3.3693 4.0647 4.0647 4.2467 4.2467 5.6050 5.6050 5.9022 5.9022 8.7622 8.7622 10.0829 10.0829 10.3146 10.3146 k = 0.0213-0.0000-0.0000 ( 5021 PWs) bands (ev): -11.4881 -11.4881 -11.2542 -11.2542 -10.8434 -10.8434 -10.5503 -10.5503 -1.6088 -1.6088 -1.0440 -1.0440 -1.0179 -1.0179 -0.9467 -0.9467 0.7207 0.7207 0.8145 0.8145 1.1152 1.1152 1.6821 1.6821 1.8280 1.8280 1.8823 1.8823 2.1942 2.1942 2.2452 2.2452 2.3224 2.3224 2.3346 2.3346 2.8954 2.8954 2.9184 2.9184 3.2663 3.2663 3.3702 3.3702 4.0623 4.0623 4.2438 4.2438 5.5995 5.5995 5.8900 5.8900 8.7745 8.7745 10.0907 10.0907 10.3186 10.3186 k = 0.0319-0.0000-0.0000 ( 5021 PWs) bands (ev): -11.4847 -11.4847 -11.2511 -11.2511 -10.8430 -10.8430 -10.5508 -10.5508 -1.6017 -1.6017 -1.0420 -1.0420 -1.0172 -1.0172 -0.9484 -0.9484 0.7249 0.7249 0.8186 0.8186 1.1248 1.1248 1.6217 1.6217 1.8044 1.8044 1.8302 1.8302 2.2051 2.2051 2.2676 2.2676 2.3303 2.3303 2.3725 2.3725 2.9040 2.9040 2.9294 2.9294 3.2689 3.2689 3.3716 3.3716 4.0583 4.0583 4.2389 4.2389 5.5906 5.5906 5.8699 5.8699 8.7949 8.7949 10.1036 10.1036 10.3252 10.3252 k = 0.0426-0.0000-0.0000 ( 5015 PWs) bands (ev): -11.4799 -11.4799 -11.2468 -11.2468 -10.8424 -10.8424 -10.5515 -10.5515 -1.5917 -1.5917 -1.0399 -1.0399 -1.0170 -1.0170 -0.9491 -0.9491 0.7308 0.7308 0.8244 0.8244 1.1377 1.1377 1.5480 1.5480 1.7339 1.7339 1.8166 1.8166 2.1955 2.1955 2.2872 2.2872 2.3434 2.3434 2.4290 2.4290 2.9154 2.9154 2.9441 2.9441 3.2727 3.2727 3.3735 3.3735 4.0527 4.0527 4.2321 4.2321 5.5787 5.5787 5.8422 5.8422 8.8231 8.8231 10.1214 10.1214 10.3341 10.3341 k = 0.0532-0.0000-0.0000 ( 5019 PWs) bands (ev): -11.4737 -11.4737 -11.2414 -11.2414 -10.8416 -10.8416 -10.5523 -10.5523 -1.5790 -1.5790 -1.0380 -1.0380 -1.0183 -1.0183 -0.9472 -0.9472 0.7383 0.7383 0.8317 0.8317 1.1529 1.1529 1.4665 1.4665 1.6537 1.6537 1.8063 1.8063 2.1791 2.1791 2.2807 2.2807 2.3817 2.3817 2.4886 2.4886 2.9290 2.9290 2.9620 2.9620 3.2775 3.2775 3.3760 3.3760 4.0455 4.0455 4.2233 4.2233 5.5642 5.5642 5.8078 5.8078 8.8589 8.8589 10.1441 10.1441 10.3450 10.3450 k = 0.0638-0.0000-0.0000 ( 5019 PWs) bands (ev): -11.4662 -11.4662 -11.2347 -11.2347 -10.8407 -10.8407 -10.5534 -10.5534 -1.5634 -1.5634 -1.0372 -1.0372 -1.0215 -1.0215 -0.9412 -0.9412 0.7475 0.7475 0.8406 0.8406 1.1685 1.1685 1.3815 1.3815 1.5689 1.5689 1.7948 1.7948 2.1590 2.1590 2.2643 2.2643 2.4258 2.4258 2.5486 2.5486 2.9445 2.9445 2.9823 2.9823 3.2836 3.2836 3.3792 3.3792 4.0367 4.0367 4.2126 4.2126 5.5476 5.5476 5.7671 5.7671 8.9020 8.9020 10.1715 10.1715 10.3576 10.3576 k = 0.0745-0.0000-0.0000 ( 5019 PWs) bands (ev): -11.4574 -11.4574 -11.2269 -11.2269 -10.8396 -10.8396 -10.5546 -10.5546 -1.5450 -1.5450 -1.0400 -1.0400 -1.0244 -1.0244 -0.9306 -0.9306 0.7583 0.7583 0.8509 0.8509 1.1765 1.1765 1.3025 1.3025 1.4805 1.4805 1.7818 1.7818 2.1365 2.1365 2.2437 2.2437 2.4694 2.4694 2.6077 2.6077 2.9612 2.9612 3.0042 3.0042 3.2907 3.2907 3.3830 3.3830 4.0263 4.0263 4.2000 4.2000 5.5296 5.5296 5.7211 5.7211 8.9519 8.9519 10.2033 10.2033 10.3715 10.3715 k = 0.0851-0.0000-0.0000 ( 5023 PWs) bands (ev): -11.4473 -11.4473 -11.2180 -11.2180 -10.8383 -10.8383 -10.5560 -10.5560 -1.5239 -1.5239 -1.0483 -1.0483 -1.0242 -1.0242 -0.9159 -0.9159 0.7705 0.7705 0.8624 0.8624 1.1443 1.1443 1.2626 1.2626 1.3894 1.3894 1.7672 1.7672 2.1122 2.1122 2.2198 2.2198 2.5113 2.5113 2.6649 2.6649 2.9790 2.9790 3.0272 3.0272 3.2992 3.2992 3.3875 3.3875 4.0143 4.0143 4.1854 4.1854 5.5110 5.5110 5.6706 5.6706 9.0082 9.0082 10.2393 10.2393 10.3861 10.3861 k = 0.0957-0.0000-0.0000 ( 5015 PWs) bands (ev): -11.4359 -11.4359 -11.2080 -11.2080 -10.8369 -10.8369 -10.5576 -10.5576 -1.5001 -1.5001 -1.0601 -1.0601 -1.0219 -1.0219 -0.8974 -0.8974 0.7841 0.7841 0.8742 0.8742 1.0650 1.0650 1.2667 1.2667 1.2994 1.2994 1.7510 1.7510 2.0868 2.0868 2.1931 2.1931 2.5511 2.5511 2.7196 2.7196 2.9974 2.9974 3.0505 3.0505 3.3089 3.3089 3.3928 3.3928 4.0008 4.0008 4.1690 4.1690 5.4924 5.4924 5.6166 5.6166 9.0705 9.0705 10.2795 10.2795 10.4009 10.4009 k = 0.1064-0.0000-0.0000 ( 5015 PWs) bands (ev): -11.4233 -11.4233 -11.1969 -11.1969 -10.8354 -10.8354 -10.5594 -10.5594 -1.4736 -1.4736 -1.0736 -1.0736 -1.0188 -1.0188 -0.8759 -0.8759 0.7986 0.7986 0.8814 0.8814 0.9782 0.9782 1.1966 1.1966 1.2944 1.2944 1.7332 1.7332 2.0608 2.0608 2.1634 2.1634 2.5887 2.5887 2.7715 2.7715 3.0161 3.0161 3.0735 3.0735 3.3200 3.3200 3.3990 3.3990 3.9856 3.9856 4.1506 4.1506 5.4744 5.4744 5.5600 5.5600 9.1381 9.1381 10.3234 10.3234 10.4154 10.4154 k = 0.1170-0.0000-0.0000 ( 5007 PWs) bands (ev): -11.4095 -11.4095 -11.1848 -11.1848 -10.8337 -10.8337 -10.5613 -10.5613 -1.4444 -1.4444 -1.0879 -1.0879 -1.0147 -1.0147 -0.8516 -0.8516 0.8096 0.8096 0.8490 0.8490 0.9328 0.9328 1.1000 1.1000 1.3176 1.3176 1.7140 1.7140 2.0347 2.0347 2.1307 2.1307 2.6242 2.6242 2.8203 2.8203 3.0347 3.0347 3.0958 3.0958 3.3324 3.3324 3.4063 3.4063 3.9689 3.9689 4.1304 4.1304 5.4579 5.4579 5.5019 5.5019 9.2107 9.2107 10.3711 10.3711 10.4291 10.4291 k = 0.1277-0.0000-0.0000 ( 4995 PWs) bands (ev): -11.3945 -11.3945 -11.1718 -11.1718 -10.8318 -10.8318 -10.5635 -10.5635 -1.4127 -1.4127 -1.1026 -1.1026 -1.0099 -1.0099 -0.8249 -0.8249 0.7481 0.7481 0.8350 0.8350 0.9401 0.9401 1.0039 1.0039 1.3416 1.3416 1.6936 1.6936 2.0087 2.0087 2.0949 2.0949 2.6577 2.6577 2.8659 2.8659 3.0530 3.0530 3.1167 3.1167 3.3462 3.3462 3.4149 3.4149 3.9505 3.9505 4.1084 4.1084 5.4429 5.4429 5.4437 5.4437 9.2875 9.2875 10.4217 10.4217 10.4418 10.4418 k = 0.1383-0.0000-0.0000 ( 4997 PWs) bands (ev): -11.3785 -11.3785 -11.1578 -11.1578 -10.8298 -10.8298 -10.5658 -10.5658 -1.3785 -1.3785 -1.1172 -1.1172 -1.0041 -1.0041 -0.7959 -0.7959 0.6497 0.6497 0.8366 0.8366 0.9174 0.9174 0.9601 0.9601 1.3645 1.3645 1.6720 1.6720 1.9832 1.9832 2.0559 2.0559 2.6892 2.6892 2.9080 2.9080 3.0709 3.0709 3.1359 3.1359 3.3613 3.3613 3.4249 3.4249 3.9306 3.9306 4.0846 4.0846 5.3850 5.3850 5.4314 5.4314 9.3681 9.3681 10.4500 10.4500 10.4783 10.4783 k = 0.1489-0.0000-0.0000 ( 4997 PWs) bands (ev): -11.3613 -11.3613 -11.1430 -11.1430 -10.8277 -10.8277 -10.5683 -10.5683 -1.3419 -1.3419 -1.1313 -1.1313 -0.9973 -0.9973 -0.7651 -0.7651 0.5484 0.5484 0.7748 0.7748 0.8989 0.8989 0.9802 0.9802 1.3852 1.3852 1.6494 1.6494 1.9582 1.9582 2.0136 2.0136 2.7189 2.7189 2.9467 2.9467 3.0879 3.0879 3.1529 3.1529 3.3776 3.3776 3.4366 3.4366 3.9092 3.9092 4.0590 4.0590 5.3282 5.3282 5.4224 5.4224 9.4519 9.4519 10.4581 10.4581 10.5359 10.5359 k = 0.1596-0.0000-0.0000 ( 5001 PWs) bands (ev): -11.3432 -11.3432 -11.1274 -11.1274 -10.8254 -10.8254 -10.5709 -10.5709 -1.3030 -1.3030 -1.1446 -1.1446 -0.9894 -0.9894 -0.7325 -0.7325 0.4469 0.4469 0.6779 0.6779 0.9159 0.9159 1.0032 1.0032 1.4029 1.4029 1.6260 1.6260 1.9331 1.9331 1.9689 1.9689 2.7469 2.7469 2.9819 2.9819 3.1041 3.1041 3.1676 3.1676 3.3950 3.3950 3.4502 3.4502 3.8862 3.8862 4.0318 4.0318 5.2738 5.2738 5.4167 5.4167 9.5384 9.5384 10.4629 10.4629 10.5971 10.5971 k = 0.1702-0.0000-0.0000 ( 5002 PWs) bands (ev): -11.3241 -11.3241 -11.1110 -11.1110 -10.8230 -10.8230 -10.5737 -10.5737 -1.2620 -1.2620 -1.1567 -1.1567 -0.9803 -0.9803 -0.6987 -0.6987 0.3461 0.3461 0.5759 0.5759 0.9392 0.9392 1.0279 1.0279 1.4169 1.4169 1.6020 1.6020 1.9029 1.9029 1.9267 1.9267 2.7731 2.7731 3.0136 3.0136 3.1192 3.1192 3.1798 3.1798 3.4133 3.4133 3.4658 3.4658 3.8617 3.8617 4.0029 4.0029 5.2227 5.2227 5.4147 5.4147 9.6270 9.6270 10.4644 10.4644 10.6615 10.6615 k = 0.1809-0.0000-0.0000 ( 5004 PWs) bands (ev): -11.3042 -11.3042 -11.0940 -11.0940 -10.8205 -10.8205 -10.5766 -10.5766 -1.2196 -1.2196 -1.1668 -1.1668 -0.9699 -0.9699 -0.6642 -0.6642 0.2472 0.2472 0.4726 0.4726 0.9652 0.9652 1.0542 1.0542 1.4267 1.4267 1.5775 1.5775 1.8564 1.8564 1.8981 1.8981 2.7977 2.7977 3.0416 3.0416 3.1333 3.1333 3.1896 3.1896 3.4324 3.4324 3.4833 3.4833 3.8358 3.8358 3.9726 3.9726 5.1757 5.1757 5.4164 5.4164 9.7172 9.7172 10.4626 10.4626 10.7290 10.7290 k = 0.1915-0.0000-0.0000 ( 5000 PWs) bands (ev): -11.2834 -11.2834 -11.0764 -11.0764 -10.8179 -10.8179 -10.5798 -10.5798 -1.1865 -1.1865 -1.1641 -1.1641 -0.9579 -0.9579 -0.6298 -0.6298 0.1510 0.1510 0.3690 0.3690 0.9931 0.9931 1.0821 1.0821 1.4320 1.4320 1.5527 1.5527 1.8004 1.8004 1.8759 1.8759 2.8206 2.8206 3.0658 3.0658 3.1463 3.1463 3.1970 3.1970 3.4522 3.4522 3.5026 3.5026 3.8085 3.8085 3.9409 3.9409 5.1338 5.1338 5.4219 5.4219 9.8084 9.8084 10.4572 10.4572 10.7995 10.7995 k = 0.2021-0.0000-0.0000 ( 5008 PWs) bands (ev): -11.2618 -11.2618 -11.0583 -11.0583 -10.8151 -10.8151 -10.5830 -10.5830 -1.1889 -1.1889 -1.1227 -1.1227 -0.9443 -0.9443 -0.5968 -0.5968 0.0593 0.0593 0.2659 0.2659 1.0227 1.0227 1.1112 1.1112 1.4330 1.4330 1.5277 1.5277 1.7398 1.7398 1.8548 1.8548 2.8419 2.8419 3.0858 3.0858 3.1584 3.1584 3.2023 3.2023 3.4727 3.4727 3.5232 3.5232 3.7799 3.7799 3.9079 3.9079 5.0974 5.0974 5.4312 5.4312 9.9002 9.9002 10.4484 10.4484 10.8729 10.8729 k = 0.2128-0.0000-0.0000 ( 5008 PWs) bands (ev): -11.2396 -11.2396 -11.0397 -11.0397 -10.8123 -10.8123 -10.5864 -10.5864 -1.1945 -1.1945 -1.0747 -1.0747 -0.9288 -0.9288 -0.5678 -0.5678 -0.0255 -0.0255 0.1636 0.1636 1.0537 1.0537 1.1416 1.1416 1.4298 1.4298 1.5027 1.5027 1.6754 1.6754 1.8334 1.8334 2.8615 2.8615 3.1013 3.1013 3.1699 3.1699 3.2058 3.2058 3.4939 3.4939 3.5449 3.5449 3.7501 3.7501 3.8740 3.8740 5.0673 5.0673 5.4441 5.4441 9.9922 9.9922 10.4362 10.4362 10.9492 10.9492 k = 0.2234-0.0000-0.0000 ( 5016 PWs) bands (ev): -11.2168 -11.2168 -11.0207 -11.0207 -10.8093 -10.8093 -10.5899 -10.5899 -1.1988 -1.1988 -1.0253 -1.0253 -0.9111 -0.9111 -0.5472 -0.5472 -0.0988 -0.0988 0.0625 0.0625 1.0861 1.0861 1.1730 1.1730 1.4233 1.4233 1.4778 1.4778 1.6079 1.6079 1.8105 1.8105 2.8792 2.8792 3.1120 3.1120 3.1811 3.1811 3.2078 3.2078 3.5157 3.5157 3.5671 3.5671 3.7194 3.7194 3.8393 3.8393 5.0439 5.0439 5.4603 5.4603 10.0837 10.0837 10.4208 10.4208 11.0283 11.0283 k = 0.2340-0.0000-0.0000 ( 5022 PWs) bands (ev): -11.1934 -11.1934 -11.0015 -11.0015 -10.8063 -10.8063 -10.5936 -10.5936 -1.2012 -1.2012 -0.9760 -0.9760 -0.8902 -0.8902 -0.5423 -0.5423 -0.1531 -0.1531 -0.0367 -0.0367 1.1196 1.1196 1.2051 1.2051 1.4142 1.4142 1.4532 1.4532 1.5375 1.5375 1.7852 1.7852 2.8950 2.8950 3.1174 3.1174 3.1917 3.1917 3.2090 3.2090 3.5376 3.5376 3.5891 3.5891 3.6884 3.6884 3.8046 3.8046 5.0274 5.0274 5.4797 5.4797 10.1743 10.1743 10.4027 10.4027 11.1101 11.1101 k = 0.2447-0.0000-0.0000 ( 5020 PWs) bands (ev): -11.1696 -11.1696 -10.9821 -10.9821 -10.8031 -10.8031 -10.5974 -10.5974 -1.2015 -1.2015 -0.9289 -0.9289 -0.8643 -0.8643 -0.5610 -0.5610 -0.1803 -0.1803 -0.1335 -0.1335 1.1538 1.1538 1.2370 1.2370 1.4037 1.4037 1.4287 1.4287 1.4654 1.4654 1.7567 1.7567 2.9088 2.9088 3.1180 3.1180 3.2000 3.2000 3.2110 3.2110 3.5582 3.5582 3.6096 3.6096 3.6589 3.6589 3.7708 3.7708 5.0179 5.0179 5.5019 5.5019 10.2635 10.2635 10.3821 10.3821 11.1946 11.1946 k = 0.2553-0.0000-0.0000 ( 5024 PWs) bands (ev): -11.1454 -11.1454 -10.9627 -10.9627 -10.7999 -10.7999 -10.6013 -10.6013 -1.1995 -1.1995 -0.8882 -0.8882 -0.8303 -0.8303 -0.6045 -0.6045 -0.2269 -0.2269 -0.1794 -0.1794 1.1877 1.1877 1.2671 1.2671 1.3860 1.3860 1.3971 1.3971 1.4084 1.4084 1.7243 1.7243 2.9202 2.9202 3.1140 3.1140 3.2022 3.2022 3.2174 3.2174 3.5723 3.5723 3.6196 3.6196 3.6426 3.6426 3.7406 3.7406 5.0155 5.0155 5.5265 5.5265 10.3491 10.3491 10.3609 10.3609 11.2816 11.2816 k = 0.2660-0.0000-0.0000 ( 5022 PWs) bands (ev): -11.1210 -11.1210 -10.9432 -10.9432 -10.7965 -10.7965 -10.6053 -10.6053 -1.1953 -1.1953 -0.8551 -0.8551 -0.7886 -0.7886 -0.6651 -0.6651 -0.3150 -0.3150 -0.1578 -0.1578 1.2165 1.2165 1.2908 1.2908 1.3187 1.3187 1.3850 1.3850 1.3922 1.3922 1.6876 1.6876 2.9291 2.9291 3.1059 3.1059 3.2003 3.2003 3.2257 3.2257 3.5630 3.5630 3.6188 3.6188 3.6497 3.6497 3.7214 3.7214 5.0200 5.0200 5.5532 5.5532 10.3347 10.3347 10.4358 10.4358 11.3712 11.3712 k = 0.2766-0.0000-0.0000 ( 5008 PWs) bands (ev): -11.0964 -11.0964 -10.9239 -10.9239 -10.7931 -10.7931 -10.6094 -10.6094 -1.1886 -1.1886 -0.8265 -0.8265 -0.7464 -0.7464 -0.7345 -0.7345 -0.3937 -0.3937 -0.1238 -0.1238 1.2042 1.2042 1.2862 1.2862 1.3008 1.3008 1.3663 1.3663 1.4028 1.4028 1.6466 1.6466 2.9354 2.9354 3.0942 3.0942 3.1964 3.1964 3.2329 3.2329 3.5344 3.5344 3.6135 3.6135 3.6609 3.6609 3.7228 3.7228 5.0311 5.0311 5.5815 5.5815 10.3093 10.3093 10.5170 10.5170 11.4632 11.4632 k = 0.2872-0.0000-0.0000 ( 5012 PWs) bands (ev): -11.0717 -11.0717 -10.9048 -10.9048 -10.7896 -10.7896 -10.6137 -10.6137 -1.1795 -1.1795 -0.8119 -0.8119 -0.7959 -0.7959 -0.7156 -0.7156 -0.4530 -0.4530 -0.0826 -0.0826 1.1351 1.1351 1.2960 1.2960 1.2993 1.2993 1.3588 1.3588 1.4288 1.4288 1.6013 1.6013 2.9388 2.9388 3.0792 3.0792 3.1905 3.1905 3.2380 3.2380 3.5013 3.5013 3.5912 3.5912 3.6806 3.6806 3.7389 3.7389 5.0482 5.0482 5.6108 5.6108 10.2832 10.2832 10.5938 10.5938 11.5573 11.5573 k = 0.2979-0.0000-0.0000 ( 5012 PWs) bands (ev): -11.0470 -11.0470 -10.8860 -10.8860 -10.7860 -10.7860 -10.6180 -10.6180 -1.1678 -1.1678 -0.8828 -0.8828 -0.7792 -0.7792 -0.7105 -0.7105 -0.4743 -0.4743 -0.0374 -0.0374 1.0553 1.0553 1.2833 1.2833 1.2969 1.2969 1.3777 1.3777 1.4631 1.4631 1.5525 1.5525 2.9391 2.9391 3.0613 3.0613 3.1820 3.1820 3.2399 3.2399 3.4681 3.4681 3.5635 3.5635 3.7040 3.7040 3.7603 3.7603 5.0710 5.0710 5.6410 5.6410 10.2569 10.2569 10.6647 10.6647 11.6525 11.6525 k = 0.3085-0.0000-0.0000 ( 5018 PWs) bands (ev): -11.0225 -11.0225 -10.8676 -10.8676 -10.7824 -10.7824 -10.6224 -10.6224 -1.1537 -1.1537 -0.9555 -0.9555 -0.7932 -0.7932 -0.7088 -0.7088 -0.4526 -0.4526 0.0102 0.0102 0.9727 0.9727 1.2673 1.2673 1.2814 1.2814 1.4110 1.4110 1.4909 1.4909 1.5128 1.5128 2.9363 2.9363 3.0409 3.0409 3.1703 3.1703 3.2370 3.2370 3.4369 3.4369 3.5363 3.5363 3.7285 3.7285 3.7834 3.7834 5.0990 5.0990 5.6713 5.6713 10.2308 10.2308 10.7274 10.7274 11.7134 11.7134 k = 0.3191-0.0000-0.0000 ( 5022 PWs) bands (ev): -10.9981 -10.9981 -10.8498 -10.8498 -10.7787 -10.7787 -10.6268 -10.6268 -1.1373 -1.1373 -1.0262 -1.0262 -0.8481 -0.8481 -0.6843 -0.6843 -0.4069 -0.4069 0.0590 0.0590 0.8890 0.8890 1.2499 1.2499 1.2628 1.2628 1.4219 1.4219 1.4719 1.4719 1.5468 1.5468 2.9303 2.9303 3.0182 3.0182 3.1546 3.1546 3.2271 3.2271 3.4104 3.4104 3.5120 3.5120 3.7533 3.7533 3.8070 3.8070 5.1314 5.1314 5.7015 5.7015 10.2055 10.2055 10.7790 10.7790 11.6475 11.6475 k = 0.3298-0.0000-0.0000 ( 5022 PWs) bands (ev): -10.9742 -10.9742 -10.8326 -10.8326 -10.7748 -10.7748 -10.6314 -10.6314 -1.1214 -1.1214 -1.0910 -1.0910 -0.9156 -0.9156 -0.6513 -0.6513 -0.3509 -0.3509 0.1083 0.1083 0.8047 0.8047 1.2316 1.2316 1.2435 1.2435 1.3716 1.3716 1.5068 1.5068 1.5898 1.5898 2.9212 2.9212 2.9937 2.9937 3.1341 3.1341 3.2081 3.2081 3.3910 3.3910 3.4918 3.4918 3.7780 3.7780 3.8304 3.8304 5.1679 5.1679 5.7310 5.7310 10.1813 10.1813 10.8152 10.8152 11.5899 11.5899 k = 0.3404-0.0000-0.0000 ( 5024 PWs) bands (ev): -10.9506 -10.9506 -10.8161 -10.8161 -10.7709 -10.7709 -10.6359 -10.6359 -1.1630 -1.1630 -1.0927 -1.0927 -0.9853 -0.9853 -0.6146 -0.6146 -0.2904 -0.2904 0.1573 0.1573 0.7202 0.7202 1.2115 1.2115 1.2241 1.2241 1.3125 1.3125 1.5512 1.5512 1.6346 1.6346 2.9091 2.9091 2.9676 2.9676 3.1086 3.1086 3.1797 3.1797 3.3793 3.3793 3.4761 3.4761 3.8022 3.8022 3.8533 3.8533 5.2078 5.2078 5.7595 5.7595 10.1586 10.1586 10.8318 10.8318 11.5537 11.5537 k = 0.3511-0.0000-0.0000 ( 5016 PWs) bands (ev): -10.9276 -10.9276 -10.8006 -10.8006 -10.7669 -10.7669 -10.6406 -10.6406 -1.2240 -1.2240 -1.0726 -1.0726 -1.0506 -1.0506 -0.5753 -0.5753 -0.2277 -0.2277 0.2055 0.2055 0.6358 0.6358 1.1847 1.1847 1.2055 1.2055 1.2569 1.2569 1.5979 1.5979 1.6807 1.6807 2.8942 2.8942 2.9405 2.9405 3.0780 3.0780 3.1434 3.1434 3.3742 3.3742 3.4646 3.4646 3.8259 3.8259 3.8755 3.8755 5.2504 5.2504 5.7864 5.7864 10.1378 10.1378 10.8264 10.8264 11.5421 11.5421 k = 0.3617-0.0000-0.0000 ( 5014 PWs) bands (ev): -10.9052 -10.9052 -10.7861 -10.7861 -10.7628 -10.7628 -10.6453 -10.6453 -1.2819 -1.2819 -1.1234 -1.1234 -1.0392 -1.0392 -0.5335 -0.5335 -0.1639 -0.1639 0.2523 0.2523 0.5518 0.5518 1.1399 1.1399 1.1884 1.1884 1.2166 1.2166 1.6460 1.6460 1.7279 1.7279 2.8765 2.8765 2.9129 2.9129 3.0428 3.0428 3.1015 3.1015 3.3735 3.3735 3.4568 3.4568 3.8487 3.8487 3.8966 3.8966 5.2951 5.2951 5.8115 5.8115 10.1192 10.1192 10.8005 10.8005 11.5538 11.5538 k = 0.3723-0.0000-0.0000 ( 5014 PWs) bands (ev): -10.8836 -10.8836 -10.7728 -10.7728 -10.7584 -10.7584 -10.6500 -10.6500 -1.3359 -1.3359 -1.1869 -1.1869 -1.0092 -1.0092 -0.4895 -0.4895 -0.0999 -0.0999 0.2971 0.2971 0.4686 0.4686 1.0779 1.0779 1.1729 1.1729 1.1918 1.1918 1.6953 1.6953 1.7760 1.7760 2.8560 2.8560 2.8855 2.8855 3.0036 3.0036 3.0561 3.0561 3.3758 3.3758 3.4519 3.4519 3.8707 3.8707 3.9166 3.9166 5.3413 5.3413 5.8343 5.8343 10.1031 10.1031 10.7591 10.7591 11.5842 11.5842 k = 0.3830-0.0000-0.0000 ( 5018 PWs) bands (ev): -10.8629 -10.8629 -10.7613 -10.7613 -10.7532 -10.7532 -10.6547 -10.6547 -1.3858 -1.3858 -1.2472 -1.2472 -0.9761 -0.9761 -0.4433 -0.4433 -0.0363 -0.0363 0.3381 0.3381 0.3875 0.3875 1.0086 1.0086 1.1587 1.1587 1.1736 1.1736 1.7455 1.7455 1.8248 1.8248 2.8329 2.8329 2.8590 2.8590 2.9611 2.9611 3.0084 3.0084 3.3798 3.3798 3.4489 3.4489 3.8916 3.8916 3.9351 3.9351 5.3886 5.3886 5.8544 5.8544 10.0897 10.0897 10.7078 10.7078 11.6277 11.6277 k = 0.3936-0.0000-0.0000 ( 5008 PWs) bands (ev): -10.8431 -10.8431 -10.7533 -10.7533 -10.7458 -10.7458 -10.6595 -10.6595 -1.4313 -1.4313 -1.3038 -1.3038 -0.9400 -0.9400 -0.3950 -0.3950 0.0263 0.0263 0.3029 0.3029 0.3808 0.3808 0.9364 0.9364 1.1457 1.1457 1.1582 1.1582 1.7966 1.7966 1.8744 1.8744 2.8079 2.8079 2.8334 2.8334 2.9157 2.9157 2.9597 2.9597 3.3850 3.3850 3.4474 3.4474 3.9113 3.9113 3.9523 3.9523 5.4362 5.4362 5.8715 5.8715 10.0793 10.0793 10.6513 10.6513 11.6798 11.6798 k = 0.4043-0.0000-0.0000 ( 5012 PWs) bands (ev): -10.8243 -10.8243 -10.7480 -10.7480 -10.7369 -10.7369 -10.6643 -10.6643 -1.4723 -1.4723 -1.3563 -1.3563 -0.9012 -0.9012 -0.3446 -0.3446 0.0871 0.0871 0.2239 0.2239 0.4159 0.4159 0.8627 0.8627 1.1338 1.1338 1.1446 1.1446 1.8485 1.8485 1.9244 1.9244 2.7818 2.7818 2.8081 2.8081 2.8680 2.8680 2.9108 2.9108 3.3908 3.3908 3.4466 3.4466 3.9298 3.9298 3.9678 3.9678 5.4838 5.4838 5.8853 5.8853 10.0721 10.0721 10.5929 10.5929 11.7376 11.7376 k = 0.4149-0.0000-0.0000 ( 5022 PWs) bands (ev): -10.8067 -10.8067 -10.7434 -10.7434 -10.7286 -10.7286 -10.6691 -10.6691 -1.5085 -1.5085 -1.4046 -1.4046 -0.8597 -0.8597 -0.2925 -0.2925 0.1338 0.1338 0.1582 0.1582 0.4472 0.4472 0.7883 0.7883 1.1231 1.1231 1.1325 1.1325 1.9009 1.9009 1.9749 1.9749 2.7559 2.7559 2.7821 2.7821 2.8190 2.8190 2.8626 2.8626 3.3969 3.3969 3.4464 3.4464 3.9469 3.9469 3.9816 3.9816 5.5307 5.5307 5.8956 5.8956 10.0682 10.0682 10.5347 10.5347 11.7990 11.7990 k = 0.4255-0.0000-0.0000 ( 5036 PWs) bands (ev): -10.7904 -10.7904 -10.7389 -10.7389 -10.7216 -10.7216 -10.6739 -10.6739 -1.5400 -1.5400 -1.4484 -1.4484 -0.8155 -0.8155 -0.2389 -0.2389 0.0668 0.0668 0.2058 0.2058 0.4738 0.4738 0.7136 0.7136 1.1136 1.1136 1.1218 1.1218 1.9539 1.9539 2.0256 2.0256 2.7303 2.7303 2.7516 2.7516 2.7723 2.7723 2.8170 2.8170 3.4030 3.4030 3.4463 3.4463 3.9625 3.9625 3.9937 3.9937 5.5765 5.5765 5.9020 5.9020 10.0679 10.0679 10.4780 10.4780 11.8627 11.8627 k = 0.4362-0.0000-0.0000 ( 5032 PWs) bands (ev): -10.7753 -10.7753 -10.7345 -10.7345 -10.7161 -10.7161 -10.6787 -10.6787 -1.5666 -1.5666 -1.4875 -1.4875 -0.7686 -0.7686 -0.1855 -0.1855 -0.0054 -0.0054 0.2593 0.2593 0.4949 0.4949 0.6393 0.6393 1.1054 1.1054 1.1124 1.1124 2.0072 2.0072 2.0763 2.0763 2.7036 2.7036 2.7077 2.7077 2.7370 2.7370 2.7771 2.7771 3.4091 3.4091 3.4461 3.4461 3.9766 3.9766 4.0039 4.0039 5.6207 5.6207 5.9044 5.9044 10.0713 10.0713 10.4239 10.4239 11.9281 11.9281 k = 0.4468-0.0000-0.0000 ( 5026 PWs) bands (ev): -10.7617 -10.7617 -10.7300 -10.7300 -10.7120 -10.7120 -10.6835 -10.6835 -1.5882 -1.5882 -1.5219 -1.5219 -0.7190 -0.7190 -0.1441 -0.1441 -0.0623 -0.0623 0.3097 0.3097 0.5092 0.5092 0.5663 0.5663 1.0985 1.0985 1.1044 1.1044 2.0607 2.0607 2.1266 2.1266 2.6563 2.6563 2.6711 2.6711 2.7106 2.7106 2.7460 2.7460 3.4149 3.4149 3.4457 3.4457 3.9890 3.9890 4.0122 4.0122 5.6630 5.6630 5.9027 5.9027 10.0785 10.0785 10.3728 10.3728 11.9945 11.9945 k = 0.4574-0.0000-0.0000 ( 5030 PWs) bands (ev): -10.7495 -10.7495 -10.7255 -10.7255 -10.7096 -10.7096 -10.6883 -10.6883 -1.6047 -1.6047 -1.5514 -1.5514 -0.6669 -0.6669 -0.1735 -0.1735 -0.0446 -0.0446 0.3560 0.3560 0.4875 0.4875 0.5236 0.5236 1.0929 1.0929 1.0976 1.0976 2.1139 2.1139 2.1759 2.1759 2.6044 2.6044 2.6300 2.6300 2.6919 2.6919 2.7224 2.7224 3.4203 3.4203 3.4449 3.4449 3.9998 3.9998 4.0186 4.0186 5.7028 5.7028 5.8967 5.8967 10.0896 10.0896 10.3253 10.3253 12.0617 12.0617 k = 0.4681-0.0000-0.0000 ( 5030 PWs) bands (ev): -10.7388 -10.7388 -10.7210 -10.7210 -10.7088 -10.7088 -10.6930 -10.6930 -1.6161 -1.6161 -1.5760 -1.5760 -0.6123 -0.6123 -0.2378 -0.2378 0.0118 0.0118 0.3975 0.3975 0.4173 0.4173 0.5239 0.5239 1.0887 1.0887 1.0923 1.0923 2.1662 2.1662 2.2228 2.2228 2.5542 2.5542 2.5852 2.5852 2.6797 2.6797 2.7039 2.7039 3.4253 3.4253 3.4438 3.4438 4.0088 4.0088 4.0231 4.0231 5.7397 5.7397 5.8866 5.8866 10.1047 10.1047 10.2816 10.2816 12.1295 12.1295 k = 0.4787-0.0000-0.0000 ( 5032 PWs) bands (ev): -10.7297 -10.7297 -10.7164 -10.7164 -10.7096 -10.7096 -10.6977 -10.6977 -1.6223 -1.6223 -1.5955 -1.5955 -0.5552 -0.5552 -0.3045 -0.3045 0.0742 0.0742 0.3457 0.3457 0.4344 0.4344 0.5192 0.5192 1.0858 1.0858 1.0882 1.0882 2.2162 2.2162 2.2642 2.2642 2.5093 2.5093 2.5406 2.5406 2.6726 2.6726 2.6895 2.6895 3.4297 3.4297 3.4421 3.4421 4.0159 4.0159 4.0255 4.0255 5.7736 5.7736 5.8721 5.8721 10.1238 10.1238 10.2418 10.2418 12.1978 12.1978 k = 0.4894-0.0000-0.0000 ( 5032 PWs) bands (ev): -10.7222 -10.7222 -10.7125 -10.7125 -10.7114 -10.7114 -10.7024 -10.7024 -1.6234 -1.6234 -1.6100 -1.6100 -0.4957 -0.4957 -0.3702 -0.3702 0.1395 0.1395 0.2755 0.2755 0.4652 0.4652 0.5078 0.5078 1.0844 1.0844 1.0856 1.0856 2.2606 2.2606 2.2915 2.2915 2.4781 2.4781 2.5009 2.5009 2.6703 2.6703 2.6790 2.6790 3.4337 3.4337 3.4398 3.4398 4.0212 4.0212 4.0260 4.0260 5.8039 5.8039 5.8534 5.8534 10.1471 10.1471 10.2061 10.2061 12.2665 12.2665 k = 0.5000-0.0000-0.0000 ( 5034 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6193 -1.6193 -1.6192 -1.6192 -0.4340 -0.4340 -0.4340 -0.4340 0.2067 0.2067 0.2067 0.2067 0.4897 0.4897 0.4898 0.4898 1.0842 1.0842 1.0843 1.0843 2.2905 2.2905 2.2905 2.2905 2.4751 2.4751 2.4752 2.4752 2.6725 2.6725 2.6726 2.6726 3.4370 3.4370 3.4371 3.4371 4.0246 4.0246 4.0246 4.0246 5.8306 5.8306 5.8307 5.8307 10.1745 10.1745 10.1746 10.1746 12.3356 12.3356 k = 0.5000-0.0000-0.0000 ( 5034 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6193 -1.6193 -1.6192 -1.6192 -0.4340 -0.4340 -0.4340 -0.4340 0.2067 0.2067 0.2067 0.2067 0.4897 0.4897 0.4898 0.4898 1.0842 1.0842 1.0843 1.0843 2.2905 2.2905 2.2905 2.2905 2.4751 2.4751 2.4752 2.4752 2.6725 2.6725 2.6726 2.6726 3.4370 3.4370 3.4371 3.4371 4.0246 4.0246 4.0246 4.0246 5.8306 5.8306 5.8307 5.8307 10.1745 10.1745 10.1746 10.1746 12.3356 12.3356 k = 0.5000 0.0104-0.0000 ( 5034 PWs) bands (ev): -10.7166 -10.7166 -10.7165 -10.7165 -10.7067 -10.7067 -10.7066 -10.7066 -1.6190 -1.6190 -1.6190 -1.6190 -0.4339 -0.4339 -0.4338 -0.4338 0.2064 0.2064 0.2065 0.2065 0.4897 0.4897 0.4898 0.4898 1.0823 1.0823 1.0826 1.0826 2.2902 2.2902 2.2903 2.2903 2.4755 2.4755 2.4757 2.4757 2.6724 2.6724 2.6726 2.6726 3.4372 3.4372 3.4379 3.4379 4.0243 4.0243 4.0247 4.0247 5.8303 5.8303 5.8308 5.8308 10.1748 10.1748 10.1749 10.1749 12.3339 12.3339 k = 0.5000 0.0209-0.0000 ( 5030 PWs) bands (ev): -10.7172 -10.7172 -10.7170 -10.7170 -10.7054 -10.7054 -10.7052 -10.7052 -1.6182 -1.6182 -1.6181 -1.6181 -0.4334 -0.4334 -0.4332 -0.4332 0.2057 0.2057 0.2059 0.2059 0.4896 0.4896 0.4897 0.4897 1.0769 1.0769 1.0774 1.0774 2.2893 2.2893 2.2896 2.2896 2.4769 2.4769 2.4772 2.4772 2.6722 2.6722 2.6726 2.6726 3.4382 3.4382 3.4397 3.4397 4.0238 4.0238 4.0247 4.0247 5.8297 5.8297 5.8306 5.8306 10.1757 10.1757 10.1757 10.1757 12.3318 12.3318 k = 0.5000 0.0313-0.0000 ( 5034 PWs) bands (ev): -10.7178 -10.7178 -10.7176 -10.7176 -10.7035 -10.7035 -10.7032 -10.7032 -1.6169 -1.6169 -1.6168 -1.6168 -0.4326 -0.4326 -0.4323 -0.4323 0.2046 0.2046 0.2049 0.2049 0.4895 0.4895 0.4896 0.4896 1.0680 1.0680 1.0688 1.0688 2.2879 2.2879 2.2884 2.2884 2.4791 2.4791 2.4797 2.4797 2.6718 2.6718 2.6725 2.6725 3.4403 3.4403 3.4425 3.4425 4.0231 4.0231 4.0244 4.0244 5.8288 5.8288 5.8303 5.8303 10.1770 10.1770 10.1771 10.1771 12.3288 12.3288 k = 0.5000 0.0418-0.0000 ( 5030 PWs) bands (ev): -10.7184 -10.7184 -10.7182 -10.7182 -10.7011 -10.7011 -10.7008 -10.7008 -1.6151 -1.6151 -1.6150 -1.6150 -0.4314 -0.4314 -0.4310 -0.4310 0.2030 0.2030 0.2034 0.2034 0.4893 0.4893 0.4895 0.4895 1.0558 1.0558 1.0568 1.0568 2.2858 2.2858 2.2865 2.2865 2.4823 2.4823 2.4830 2.4830 2.6714 2.6714 2.6723 2.6723 3.4433 3.4433 3.4462 3.4462 4.0223 4.0223 4.0241 4.0241 5.8277 5.8277 5.8296 5.8296 10.1786 10.1786 10.1788 10.1788 12.3240 12.3240 k = 0.5000 0.0522-0.0000 ( 5034 PWs) bands (ev): -10.7188 -10.7188 -10.7186 -10.7186 -10.6983 -10.6983 -10.6980 -10.6980 -1.6128 -1.6128 -1.6126 -1.6126 -0.4298 -0.4298 -0.4294 -0.4294 0.2010 0.2010 0.2015 0.2015 0.4890 0.4890 0.4892 0.4892 1.0404 1.0404 1.0416 1.0416 2.2832 2.2832 2.2840 2.2840 2.4863 2.4863 2.4872 2.4872 2.6709 2.6709 2.6721 2.6721 3.4474 3.4474 3.4510 3.4510 4.0214 4.0214 4.0236 4.0236 5.8264 5.8264 5.8288 5.8288 10.1804 10.1804 10.1806 10.1806 12.3162 12.3162 k = 0.5000 0.0626-0.0000 ( 5034 PWs) bands (ev): -10.7190 -10.7190 -10.7188 -10.7188 -10.6952 -10.6952 -10.6949 -10.6949 -1.6099 -1.6099 -1.6097 -1.6097 -0.4280 -0.4280 -0.4275 -0.4275 0.1986 0.1986 0.1992 0.1992 0.4887 0.4887 0.4889 0.4889 1.0220 1.0220 1.0234 1.0234 2.2798 2.2798 2.2807 2.2807 2.4911 2.4911 2.4921 2.4921 2.6704 2.6704 2.6717 2.6717 3.4525 3.4525 3.4567 3.4567 4.0203 4.0203 4.0230 4.0230 5.8248 5.8248 5.8277 5.8277 10.1822 10.1822 10.1824 10.1824 12.3032 12.3032 k = 0.5000 0.0731-0.0000 ( 5034 PWs) bands (ev): -10.7190 -10.7190 -10.7188 -10.7188 -10.6919 -10.6919 -10.6916 -10.6916 -1.6066 -1.6066 -1.6064 -1.6064 -0.4257 -0.4257 -0.4252 -0.4252 0.1958 0.1958 0.1965 0.1965 0.4882 0.4882 0.4884 0.4884 1.0008 1.0008 1.0024 1.0024 2.2756 2.2756 2.2768 2.2768 2.4967 2.4967 2.4979 2.4979 2.6697 2.6697 2.6713 2.6713 3.4586 3.4586 3.4635 3.4635 4.0193 4.0193 4.0224 4.0224 5.8231 5.8231 5.8264 5.8264 10.1835 10.1835 10.1838 10.1838 12.2821 12.2821 k = 0.5000 0.0835-0.0000 ( 5030 PWs) bands (ev): -10.7188 -10.7188 -10.7186 -10.7186 -10.6883 -10.6883 -10.6880 -10.6880 -1.6029 -1.6029 -1.6026 -1.6026 -0.4232 -0.4232 -0.4225 -0.4225 0.1926 0.1926 0.1934 0.1934 0.4876 0.4876 0.4878 0.4878 0.9771 0.9771 0.9789 0.9789 2.2707 2.2707 2.2719 2.2719 2.5030 2.5030 2.5043 2.5043 2.6690 2.6690 2.6709 2.6709 3.4658 3.4658 3.4714 3.4714 4.0182 4.0182 4.0218 4.0218 5.8211 5.8211 5.8249 5.8249 10.1842 10.1842 10.1845 10.1845 12.2494 12.2494 k = 0.5000 0.0940-0.0000 ( 5034 PWs) bands (ev): -10.7184 -10.7184 -10.7182 -10.7182 -10.6844 -10.6844 -10.6841 -10.6841 -1.5987 -1.5987 -1.5984 -1.5984 -0.4203 -0.4203 -0.4195 -0.4195 0.1889 0.1889 0.1898 0.1898 0.4868 0.4868 0.4870 0.4870 0.9512 0.9512 0.9532 0.9532 2.2648 2.2648 2.2663 2.2663 2.5100 2.5100 2.5113 2.5113 2.6682 2.6682 2.6704 2.6704 3.4741 3.4741 3.4804 3.4804 4.0172 4.0172 4.0213 4.0213 5.8190 5.8190 5.8232 5.8232 10.1838 10.1838 10.1842 10.1842 12.2022 12.2022 k = 0.5000 0.1044-0.0000 ( 5026 PWs) bands (ev): -10.7177 -10.7177 -10.7175 -10.7175 -10.6804 -10.6804 -10.6801 -10.6801 -1.5941 -1.5941 -1.5938 -1.5938 -0.4170 -0.4170 -0.4162 -0.4162 0.1849 0.1849 0.1859 0.1859 0.4858 0.4858 0.4860 0.4860 0.9233 0.9233 0.9255 0.9255 2.2581 2.2581 2.2597 2.2597 2.5175 2.5175 2.5189 2.5189 2.6673 2.6673 2.6698 2.6698 3.4836 3.4836 3.4905 3.4905 4.0163 4.0163 4.0208 4.0208 5.8167 5.8167 5.8213 5.8213 10.1821 10.1821 10.1825 10.1825 12.1394 12.1394 k = 0.5000 0.1148-0.0000 ( 5006 PWs) bands (ev): -10.7169 -10.7169 -10.7167 -10.7167 -10.6762 -10.6762 -10.6759 -10.6759 -1.5891 -1.5891 -1.5888 -1.5888 -0.4134 -0.4134 -0.4125 -0.4125 0.1805 0.1805 0.1816 0.1816 0.4845 0.4845 0.4846 0.4846 0.8937 0.8937 0.8961 0.8961 2.2505 2.2505 2.2523 2.2523 2.5254 2.5254 2.5269 2.5269 2.6665 2.6665 2.6692 2.6692 3.4943 3.4943 3.5019 3.5019 4.0155 4.0155 4.0205 4.0205 5.8143 5.8143 5.8193 5.8193 10.1787 10.1787 10.1792 10.1792 12.0628 12.0628 k = 0.5000 0.1253-0.0000 ( 5004 PWs) bands (ev): -10.7158 -10.7158 -10.7156 -10.7156 -10.6717 -10.6717 -10.6715 -10.6715 -1.5838 -1.5838 -1.5834 -1.5834 -0.4094 -0.4094 -0.4084 -0.4084 0.1756 0.1756 0.1769 0.1769 0.4830 0.4830 0.4830 0.4830 0.8628 0.8628 0.8653 0.8653 2.2419 2.2419 2.2439 2.2439 2.5337 2.5337 2.5352 2.5352 2.6656 2.6656 2.6686 2.6686 3.5062 3.5062 3.5143 3.5143 4.0148 4.0148 4.0203 4.0203 5.8118 5.8118 5.8171 5.8171 10.1731 10.1731 10.1737 10.1737 11.9754 11.9754 k = 0.5000 0.1357-0.0000 ( 5012 PWs) bands (ev): -10.7146 -10.7146 -10.7144 -10.7144 -10.6672 -10.6672 -10.6669 -10.6669 -1.5782 -1.5782 -1.5778 -1.5778 -0.4051 -0.4051 -0.4041 -0.4041 0.1704 0.1704 0.1718 0.1718 0.4810 0.4810 0.4810 0.4810 0.8307 0.8307 0.8334 0.8334 2.2325 2.2325 2.2347 2.2347 2.5422 2.5422 2.5437 2.5437 2.6646 2.6646 2.6679 2.6679 3.5192 3.5192 3.5280 3.5280 4.0142 4.0142 4.0203 4.0203 5.8091 5.8091 5.8148 5.8148 10.1651 10.1651 10.1657 10.1657 11.8805 11.8805 k = 0.5000 0.1462-0.0000 ( 5016 PWs) bands (ev): -10.7131 -10.7131 -10.7130 -10.7130 -10.6625 -10.6625 -10.6622 -10.6622 -1.5724 -1.5724 -1.5719 -1.5719 -0.4005 -0.4005 -0.3994 -0.3994 0.1648 0.1648 0.1663 0.1663 0.4784 0.4784 0.4786 0.4786 0.7980 0.7980 0.8008 0.8008 2.2222 2.2222 2.2247 2.2247 2.5508 2.5508 2.5523 2.5523 2.6637 2.6637 2.6672 2.6672 3.5334 3.5334 3.5429 3.5429 4.0139 4.0139 4.0206 4.0206 5.8063 5.8063 5.8124 5.8124 10.1543 10.1543 10.1548 10.1548 11.7811 11.7811 k = 0.5000 0.1566-0.0000 ( 5000 PWs) bands (ev): -10.7115 -10.7115 -10.7114 -10.7114 -10.6577 -10.6577 -10.6574 -10.6574 -1.5662 -1.5662 -1.5657 -1.5657 -0.3955 -0.3955 -0.3943 -0.3943 0.1588 0.1588 0.1604 0.1604 0.4753 0.4753 0.4757 0.4757 0.7648 0.7648 0.7679 0.7679 2.2112 2.2112 2.2140 2.2140 2.5595 2.5595 2.5610 2.5610 2.6629 2.6629 2.6665 2.6665 3.5489 3.5489 3.5590 3.5590 4.0138 4.0138 4.0211 4.0211 5.8035 5.8035 5.8099 5.8099 10.1403 10.1403 10.1408 10.1408 11.6793 11.6793 k = 0.5000 0.1670-0.0000 ( 4996 PWs) bands (ev): -10.7098 -10.7098 -10.7096 -10.7096 -10.6527 -10.6527 -10.6525 -10.6525 -1.5599 -1.5599 -1.5594 -1.5594 -0.3902 -0.3902 -0.3889 -0.3889 0.1523 0.1523 0.1541 0.1541 0.4715 0.4715 0.4720 0.4720 0.7316 0.7316 0.7349 0.7349 2.1996 2.1996 2.2026 2.2026 2.5680 2.5680 2.5696 2.5696 2.6622 2.6622 2.6659 2.6659 3.5655 3.5655 3.5763 3.5763 4.0139 4.0139 4.0219 4.0219 5.8007 5.8007 5.8074 5.8074 10.1228 10.1228 10.1231 10.1231 11.5772 11.5772 k = 0.5000 0.1775-0.0000 ( 4992 PWs) bands (ev): -10.7079 -10.7079 -10.7078 -10.7078 -10.6478 -10.6478 -10.6475 -10.6475 -1.5535 -1.5535 -1.5529 -1.5529 -0.3846 -0.3846 -0.3832 -0.3832 0.1455 0.1455 0.1474 0.1474 0.4667 0.4667 0.4675 0.4675 0.6988 0.6988 0.7024 0.7024 2.1873 2.1873 2.1906 2.1906 2.5762 2.5762 2.5780 2.5780 2.6617 2.6617 2.6654 2.6654 3.5833 3.5833 3.5948 3.5948 4.0142 4.0142 4.0230 4.0230 5.7978 5.7978 5.8048 5.8048 10.1014 10.1014 10.1016 10.1016 11.4761 11.4761 k = 0.5000 0.1879-0.0000 ( 4984 PWs) bands (ev): -10.7059 -10.7059 -10.7058 -10.7058 -10.6427 -10.6427 -10.6424 -10.6424 -1.5469 -1.5469 -1.5462 -1.5462 -0.3787 -0.3787 -0.3772 -0.3772 0.1383 0.1383 0.1403 0.1403 0.4608 0.4608 0.4619 0.4619 0.6669 0.6669 0.6707 0.6707 2.1746 2.1746 2.1782 2.1782 2.5839 2.5839 2.5861 2.5861 2.6614 2.6614 2.6649 2.6649 3.6021 3.6021 3.6144 3.6144 4.0148 4.0148 4.0245 4.0245 5.7949 5.7949 5.8021 5.8021 10.0758 10.0758 10.0759 10.0759 11.3774 11.3774 k = 0.5000 0.1984-0.0000 ( 4984 PWs) bands (ev): -10.7038 -10.7038 -10.7037 -10.7037 -10.6376 -10.6376 -10.6373 -10.6373 -1.5402 -1.5402 -1.5395 -1.5395 -0.3725 -0.3725 -0.3709 -0.3709 0.1307 0.1307 0.1329 0.1329 0.4533 0.4533 0.4547 0.4547 0.6364 0.6364 0.6405 0.6405 2.1615 2.1615 2.1655 2.1655 2.5911 2.5911 2.5937 2.5937 2.6615 2.6615 2.6647 2.6647 3.6219 3.6219 3.6351 3.6351 4.0157 4.0157 4.0264 4.0264 5.7920 5.7920 5.7994 5.7994 10.0455 10.0455 10.0461 10.0461 11.2821 11.2821 k = 0.5000 0.2088-0.0000 ( 4994 PWs) bands (ev): -10.7017 -10.7017 -10.7015 -10.7015 -10.6325 -10.6325 -10.6323 -10.6323 -1.5336 -1.5336 -1.5328 -1.5328 -0.3659 -0.3659 -0.3643 -0.3643 0.1228 0.1228 0.1250 0.1250 0.4439 0.4439 0.4456 0.4456 0.6080 0.6080 0.6124 0.6124 2.1483 2.1483 2.1525 2.1525 2.5973 2.5973 2.6007 2.6007 2.6621 2.6621 2.6646 2.6646 3.6425 3.6425 3.6567 3.6567 4.0169 4.0169 4.0286 4.0286 5.7892 5.7892 5.7968 5.7968 10.0105 10.0105 10.0116 10.0116 11.1911 11.1911 k = 0.5000 0.2192-0.0000 ( 4990 PWs) bands (ev): -10.6994 -10.6994 -10.6993 -10.6993 -10.6275 -10.6275 -10.6272 -10.6272 -1.5269 -1.5269 -1.5261 -1.5261 -0.3591 -0.3591 -0.3574 -0.3574 0.1144 0.1144 0.1168 0.1168 0.4321 0.4321 0.4341 0.4341 0.5825 0.5825 0.5871 0.5871 2.1349 2.1349 2.1394 2.1394 2.6027 2.6027 2.6070 2.6070 2.6633 2.6633 2.6649 2.6649 3.6639 3.6639 3.6792 3.6792 4.0184 4.0184 4.0314 4.0314 5.7864 5.7864 5.7941 5.7941 9.9708 9.9708 9.9726 9.9726 11.1051 11.1051 k = 0.5000 0.2297-0.0000 ( 4992 PWs) bands (ev): -10.6971 -10.6971 -10.6970 -10.6970 -10.6224 -10.6224 -10.6222 -10.6222 -1.5202 -1.5202 -1.5194 -1.5194 -0.3521 -0.3521 -0.3503 -0.3503 0.1056 0.1056 0.1082 0.1082 0.4174 0.4174 0.4195 0.4195 0.5604 0.5604 0.5652 0.5652 2.1215 2.1215 2.1264 2.1264 2.6069 2.6069 2.6125 2.6125 2.6652 2.6652 2.6657 2.6657 3.6858 3.6858 3.7024 3.7024 4.0202 4.0202 4.0346 4.0346 5.7837 5.7837 5.7915 5.7915 9.9263 9.9263 9.9289 9.9289 11.0246 11.0246 k = 0.5000 0.2401-0.0000 ( 4996 PWs) bands (ev): -10.6948 -10.6948 -10.6947 -10.6947 -10.6175 -10.6175 -10.6172 -10.6172 -1.5137 -1.5137 -1.5128 -1.5128 -0.3448 -0.3448 -0.3430 -0.3430 0.0965 0.0965 0.0993 0.0993 0.3998 0.3998 0.4019 0.4019 0.5422 0.5422 0.5469 0.5469 2.1083 2.1083 2.1135 2.1135 2.6100 2.6100 2.6169 2.6169 2.6669 2.6669 2.6679 2.6679 3.7080 3.7080 3.7260 3.7260 4.0225 4.0225 4.0385 4.0385 5.7810 5.7810 5.7889 5.7889 9.8773 9.8773 9.8809 9.8809 10.9502 10.9502 k = 0.5000 0.2506-0.0000 ( 5004 PWs) bands (ev): -10.6925 -10.6925 -10.6924 -10.6924 -10.6126 -10.6126 -10.6123 -10.6123 -1.5073 -1.5073 -1.5063 -1.5063 -0.3373 -0.3373 -0.3354 -0.3354 0.0872 0.0872 0.0900 0.0900 0.3796 0.3796 0.3816 0.3816 0.5275 0.5275 0.5320 0.5320 2.0953 2.0953 2.1009 2.1009 2.6120 2.6120 2.6204 2.6204 2.6687 2.6687 2.6711 2.6711 3.7302 3.7302 3.7498 3.7498 4.0252 4.0252 4.0431 4.0431 5.7785 5.7785 5.7864 5.7864 9.8241 9.8241 9.8288 9.8288 10.8818 10.8818 k = 0.5000 0.2610-0.0000 ( 5000 PWs) bands (ev): -10.6901 -10.6901 -10.6900 -10.6900 -10.6078 -10.6078 -10.6075 -10.6075 -1.5010 -1.5010 -1.5000 -1.5000 -0.3296 -0.3296 -0.3277 -0.3277 0.0775 0.0775 0.0805 0.0805 0.3577 0.3577 0.3594 0.3594 0.5158 0.5158 0.5200 0.5200 2.0827 2.0827 2.0886 2.0886 2.6131 2.6131 2.6229 2.6229 2.6711 2.6711 2.6748 2.6748 3.7522 3.7522 3.7737 3.7737 4.0286 4.0286 4.0486 4.0486 5.7761 5.7761 5.7840 5.7840 9.7674 9.7674 9.7732 9.7732 10.8195 10.8195 k = 0.5000 0.2714-0.0000 ( 5018 PWs) bands (ev): -10.6878 -10.6878 -10.6877 -10.6877 -10.6031 -10.6031 -10.6029 -10.6029 -1.4950 -1.4950 -1.4939 -1.4939 -0.3218 -0.3218 -0.3199 -0.3199 0.0677 0.0677 0.0708 0.0708 0.3347 0.3347 0.3361 0.3361 0.5063 0.5063 0.5102 0.5102 2.0704 2.0704 2.0767 2.0767 2.6134 2.6134 2.6244 2.6244 2.6738 2.6738 2.6788 2.6788 3.7735 3.7735 3.7971 3.7971 4.0326 4.0326 4.0550 4.0550 5.7738 5.7738 5.7817 5.7817 9.7078 9.7078 9.7148 9.7148 10.7632 10.7632 k = 0.5000 0.2819-0.0000 ( 5022 PWs) bands (ev): -10.6855 -10.6855 -10.6855 -10.6855 -10.5986 -10.5986 -10.5984 -10.5984 -1.4891 -1.4891 -1.4880 -1.4880 -0.3139 -0.3139 -0.3120 -0.3120 0.0577 0.0577 0.0611 0.0611 0.3113 0.3113 0.3125 0.3125 0.4985 0.4985 0.5020 0.5020 2.0587 2.0587 2.0653 2.0653 2.6132 2.6132 2.6252 2.6252 2.6769 2.6769 2.6829 2.6829 3.7941 3.7941 3.8198 3.8198 4.0376 4.0376 4.0624 4.0624 5.7717 5.7717 5.7796 5.7796 9.6463 9.6463 9.6544 9.6544 10.7123 10.7123 k = 0.5000 0.2923-0.0000 ( 5026 PWs) bands (ev): -10.6833 -10.6833 -10.6833 -10.6833 -10.5943 -10.5943 -10.5940 -10.5940 -1.4836 -1.4836 -1.4824 -1.4824 -0.3060 -0.3060 -0.3041 -0.3041 0.0478 0.0478 0.0513 0.0513 0.2881 0.2881 0.2890 0.2890 0.4919 0.4919 0.4950 0.4950 2.0476 2.0476 2.0545 2.0545 2.6125 2.6125 2.6255 2.6255 2.6800 2.6800 2.6869 2.6869 3.8133 3.8133 3.8414 3.8414 4.0436 4.0436 4.0710 4.0710 5.7698 5.7698 5.7775 5.7775 9.5838 9.5838 9.5930 9.5930 10.6667 10.6667 k = 0.5000 0.3028-0.0000 ( 5022 PWs) bands (ev): -10.6812 -10.6812 -10.6811 -10.6811 -10.5902 -10.5902 -10.5899 -10.5899 -1.4783 -1.4783 -1.4771 -1.4771 -0.2981 -0.2981 -0.2962 -0.2962 0.0380 0.0380 0.0417 0.0417 0.2655 0.2655 0.2661 0.2661 0.4861 0.4861 0.4890 0.4890 2.0372 2.0372 2.0444 2.0444 2.6116 2.6116 2.6253 2.6253 2.6832 2.6832 2.6909 2.6909 3.8311 3.8311 3.8614 3.8614 4.0509 4.0509 4.0809 4.0809 5.7681 5.7681 5.7757 5.7757 9.5211 9.5211 9.5313 9.5313 10.6258 10.6258 k = 0.5000 0.3132-0.0000 ( 5026 PWs) bands (ev): -10.6791 -10.6791 -10.6791 -10.6791 -10.5862 -10.5862 -10.5860 -10.5860 -1.4733 -1.4733 -1.4720 -1.4720 -0.2903 -0.2903 -0.2885 -0.2885 0.0286 0.0286 0.0325 0.0325 0.2436 0.2436 0.2440 0.2440 0.4810 0.4810 0.4836 0.4836 2.0274 2.0274 2.0349 2.0349 2.6105 2.6105 2.6249 2.6249 2.6862 2.6862 2.6946 2.6946 3.8471 3.8471 3.8794 3.8794 4.0596 4.0596 4.0919 4.0919 5.7665 5.7665 5.7740 5.7740 9.4592 9.4592 9.4704 9.4704 10.5892 10.5892 k = 0.5000 0.3236-0.0000 ( 5022 PWs) bands (ev): -10.6771 -10.6771 -10.6771 -10.6771 -10.5825 -10.5825 -10.5823 -10.5823 -1.4686 -1.4686 -1.4673 -1.4673 -0.2827 -0.2827 -0.2810 -0.2810 0.0196 0.0196 0.0237 0.0237 0.2227 0.2227 0.2229 0.2229 0.4765 0.4765 0.4789 0.4789 2.0183 2.0183 2.0261 2.0261 2.6093 2.6093 2.6242 2.6242 2.6891 2.6891 2.6981 2.6981 3.8612 3.8612 3.8951 3.8951 4.0698 4.0698 4.1040 4.1040 5.7652 5.7652 5.7724 5.7724 9.3991 9.3991 9.4112 9.4112 10.5566 10.5566 k = 0.5000 0.3341-0.0000 ( 5016 PWs) bands (ev): -10.6753 -10.6753 -10.6753 -10.6753 -10.5791 -10.5791 -10.5788 -10.5788 -1.4643 -1.4643 -1.4630 -1.4630 -0.2754 -0.2754 -0.2738 -0.2738 0.0112 0.0112 0.0156 0.0156 0.2028 0.2028 0.2029 0.2029 0.4725 0.4725 0.4746 0.4746 2.0100 2.0100 2.0181 2.0181 2.6081 2.6081 2.6234 2.6234 2.6919 2.6919 2.7014 2.7014 3.8734 3.8734 3.9085 3.9085 4.0812 4.0812 4.1170 4.1170 5.7640 5.7640 5.7711 5.7711 9.3414 9.3414 9.3543 9.3543 10.5277 10.5277 k = 0.5000 0.3445-0.0000 ( 5024 PWs) bands (ev): -10.6736 -10.6736 -10.6736 -10.6736 -10.5759 -10.5759 -10.5757 -10.5757 -1.4604 -1.4604 -1.4590 -1.4590 -0.2685 -0.2685 -0.2670 -0.2670 0.0037 0.0037 0.0083 0.0083 0.1840 0.1840 0.1841 0.1841 0.4689 0.4689 0.4708 0.4708 2.0025 2.0025 2.0108 2.0108 2.6068 2.6068 2.6226 2.6226 2.6943 2.6943 2.7043 2.7043 3.8837 3.8837 3.9194 3.9194 4.0936 4.0936 4.1304 4.1304 5.7629 5.7629 5.7699 5.7699 9.2870 9.2870 9.3005 9.3005 10.5021 10.5021 k = 0.5000 0.3550-0.0000 ( 5024 PWs) bands (ev): -10.6721 -10.6721 -10.6720 -10.6720 -10.5731 -10.5731 -10.5728 -10.5728 -1.4568 -1.4568 -1.4554 -1.4554 -0.2621 -0.2621 -0.2608 -0.2608 -0.0029 -0.0029 0.0021 0.0021 0.1664 0.1664 0.1666 0.1666 0.4657 0.4657 0.4674 0.4674 1.9957 1.9957 2.0043 2.0043 2.6056 2.6056 2.6217 2.6217 2.6965 2.6965 2.7069 2.7069 3.8923 3.8923 3.9282 3.9282 4.1066 4.1066 4.1439 4.1439 5.7621 5.7621 5.7688 5.7688 9.2365 9.2365 9.2506 9.2506 10.4796 10.4796 k = 0.5000 0.3654-0.0000 ( 5020 PWs) bands (ev): -10.6706 -10.6706 -10.6706 -10.6706 -10.5705 -10.5705 -10.5702 -10.5702 -1.4537 -1.4537 -1.4522 -1.4522 -0.2562 -0.2562 -0.2551 -0.2551 -0.0083 -0.0083 -0.0029 -0.0029 0.1501 0.1501 0.1504 0.1504 0.4628 0.4628 0.4644 0.4644 1.9898 1.9898 1.9985 1.9985 2.6044 2.6044 2.6209 2.6209 2.6985 2.6985 2.7092 2.7092 3.8994 3.8994 3.9352 3.9352 4.1195 4.1195 4.1571 4.1571 5.7614 5.7614 5.7680 5.7680 9.1905 9.1905 9.2052 9.2052 10.4601 10.4601 k = 0.5000 0.3758-0.0000 ( 5028 PWs) bands (ev): -10.6694 -10.6694 -10.6694 -10.6694 -10.5682 -10.5682 -10.5680 -10.5680 -1.4509 -1.4509 -1.4495 -1.4495 -0.2511 -0.2511 -0.2501 -0.2501 -0.0125 -0.0125 -0.0068 -0.0068 0.1353 0.1353 0.1355 0.1355 0.4604 0.4604 0.4618 0.4618 1.9846 1.9846 1.9935 1.9935 2.6034 2.6034 2.6201 2.6201 2.7001 2.7001 2.7112 2.7112 3.9051 3.9051 3.9406 3.9406 4.1318 4.1318 4.1694 4.1694 5.7609 5.7609 5.7672 5.7672 9.1495 9.1495 9.1646 9.1646 10.4434 10.4434 k = 0.5000 0.3863-0.0000 ( 5036 PWs) bands (ev): -10.6683 -10.6683 -10.6683 -10.6683 -10.5663 -10.5663 -10.5660 -10.5660 -1.4486 -1.4486 -1.4471 -1.4471 -0.2467 -0.2467 -0.2459 -0.2459 -0.0156 -0.0156 -0.0094 -0.0094 0.1220 0.1220 0.1222 0.1222 0.4583 0.4583 0.4596 0.4596 1.9803 1.9803 1.9893 1.9893 2.6024 2.6024 2.6193 2.6193 2.7015 2.7015 2.7128 2.7128 3.9096 3.9096 3.9448 3.9448 4.1431 4.1431 4.1806 4.1806 5.7605 5.7605 5.7666 5.7666 9.1140 9.1140 9.1295 9.1295 10.4292 10.4292 k = 0.5000 0.3967-0.0000 ( 5032 PWs) bands (ev): -10.6675 -10.6675 -10.6674 -10.6674 -10.5647 -10.5647 -10.5645 -10.5645 -1.4467 -1.4467 -1.4452 -1.4452 -0.2431 -0.2431 -0.2425 -0.2425 -0.0175 -0.0175 -0.0109 -0.0109 0.1105 0.1105 0.1106 0.1106 0.4566 0.4566 0.4578 0.4578 1.9767 1.9767 1.9859 1.9859 2.6016 2.6016 2.6187 2.6187 2.7026 2.7026 2.7142 2.7142 3.9131 3.9131 3.9479 3.9479 4.1529 4.1529 4.1903 4.1903 5.7602 5.7602 5.7662 5.7662 9.0845 9.0845 9.1003 9.1003 10.4174 10.4174 k = 0.5000 0.4072-0.0000 ( 5036 PWs) bands (ev): -10.6668 -10.6668 -10.6667 -10.6667 -10.5634 -10.5634 -10.5632 -10.5632 -1.4452 -1.4452 -1.4436 -1.4436 -0.2403 -0.2403 -0.2399 -0.2399 -0.0185 -0.0185 -0.0115 -0.0115 0.1010 0.1010 0.1011 0.1011 0.4553 0.4553 0.4564 0.4564 1.9739 1.9739 1.9833 1.9833 2.6010 2.6010 2.6182 2.6182 2.7035 2.7035 2.7152 2.7152 3.9157 3.9157 3.9502 3.9502 4.1609 4.1609 4.1982 4.1982 5.7600 5.7600 5.7658 5.7658 9.0611 9.0611 9.0772 9.0772 10.4083 10.4083 k = 0.5000 0.4176-0.0000 ( 5036 PWs) bands (ev): -10.6663 -10.6663 -10.6662 -10.6662 -10.5625 -10.5625 -10.5623 -10.5623 -1.4441 -1.4441 -1.4426 -1.4426 -0.2383 -0.2383 -0.2380 -0.2380 -0.0189 -0.0189 -0.0116 -0.0116 0.0938 0.0938 0.0940 0.0940 0.4544 0.4544 0.4554 0.4554 1.9720 1.9720 1.9814 1.9814 2.6005 2.6005 2.6179 2.6179 2.7041 2.7041 2.7160 2.7160 3.9175 3.9175 3.9517 3.9517 4.1668 4.1668 4.2039 4.2039 5.7598 5.7598 5.7656 5.7656 9.0443 9.0443 9.0605 9.0605 10.4018 10.4018 k = 0.5000 0.4280-0.0000 ( 5028 PWs) bands (ev): -10.6660 -10.6660 -10.6659 -10.6659 -10.5620 -10.5620 -10.5618 -10.5618 -1.4435 -1.4435 -1.4419 -1.4419 -0.2371 -0.2371 -0.2369 -0.2369 -0.0190 -0.0190 -0.0114 -0.0114 0.0892 0.0892 0.0896 0.0896 0.4538 0.4538 0.4548 0.4548 1.9708 1.9708 1.9802 1.9802 2.6003 2.6003 2.6176 2.6176 2.7045 2.7045 2.7164 2.7164 3.9185 3.9185 3.9526 3.9526 4.1704 4.1704 4.2075 4.2075 5.7597 5.7597 5.7655 5.7655 9.0341 9.0341 9.0504 9.0504 10.3979 10.3979 k = 0.5000 0.4385-0.0000 ( 5036 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4432 -1.4432 -1.4417 -1.4417 -0.2367 -0.2367 -0.2365 -0.2365 -0.0190 -0.0190 -0.0113 -0.0113 0.0877 0.0877 0.0881 0.0881 0.4536 0.4536 0.4546 0.4546 1.9704 1.9704 1.9799 1.9799 2.6002 2.6002 2.6176 2.6176 2.7046 2.7046 2.7166 2.7166 3.9188 3.9188 3.9529 3.9529 4.1716 4.1716 4.2087 4.2087 5.7597 5.7597 5.7654 5.7654 9.0307 9.0307 9.0470 9.0470 10.3967 10.3967 k = 0.5000 0.4385-0.0000 ( 5036 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4432 -1.4432 -1.4417 -1.4417 -0.2367 -0.2367 -0.2365 -0.2365 -0.0190 -0.0190 -0.0113 -0.0113 0.0877 0.0877 0.0881 0.0881 0.4536 0.4536 0.4546 0.4546 1.9704 1.9704 1.9799 1.9799 2.6002 2.6002 2.6176 2.6176 2.7046 2.7046 2.7166 2.7166 3.9188 3.9188 3.9529 3.9529 4.1716 4.1716 4.2087 4.2087 5.7597 5.7597 5.7654 5.7654 9.0307 9.0307 9.0470 9.0470 10.3967 10.3967 k = 0.4894 0.4385-0.0000 ( 5028 PWs) bands (ev): -10.6658 -10.6658 -10.6658 -10.6658 -10.5626 -10.5626 -10.5624 -10.5624 -1.4407 -1.4407 -1.4392 -1.4392 -0.2521 -0.2521 -0.2514 -0.2514 -0.0047 -0.0047 0.0016 0.0016 0.0902 0.0902 0.0908 0.0908 0.4512 0.4512 0.4525 0.4525 1.9654 1.9654 1.9744 1.9744 2.6053 2.6053 2.6222 2.6222 2.7069 2.7069 2.7189 2.7189 3.9178 3.9178 3.9519 3.9519 4.1710 4.1710 4.2079 4.2079 5.7578 5.7578 5.7636 5.7636 9.0330 9.0330 9.0493 9.0493 10.3996 10.3996 k = 0.4787 0.4385-0.0000 ( 5040 PWs) bands (ev): -10.6658 -10.6658 -10.6657 -10.6657 -10.5651 -10.5651 -10.5648 -10.5648 -1.4333 -1.4333 -1.4316 -1.4316 -0.2895 -0.2895 -0.2873 -0.2873 0.0255 0.0255 0.0285 0.0285 0.1010 0.1010 0.1026 0.1026 0.4444 0.4444 0.4466 0.4466 1.9506 1.9506 1.9586 1.9586 2.6200 2.6200 2.6355 2.6355 2.7138 2.7138 2.7258 2.7258 3.9144 3.9144 3.9489 3.9489 4.1689 4.1689 4.2058 4.2058 5.7522 5.7522 5.7579 5.7579 9.0402 9.0402 9.0562 9.0562 10.4083 10.4083 k = 0.4681 0.4385-0.0000 ( 5038 PWs) bands (ev): -10.6656 -10.6656 -10.6656 -10.6656 -10.5691 -10.5691 -10.5688 -10.5688 -1.4208 -1.4208 -1.4191 -1.4191 -0.3364 -0.3364 -0.3328 -0.3328 0.0478 0.0478 0.0483 0.0483 0.1302 0.1302 0.1324 0.1324 0.4340 0.4340 0.4378 0.4378 1.9275 1.9275 1.9339 1.9339 2.6428 2.6428 2.6559 2.6559 2.7254 2.7254 2.7375 2.7375 3.9089 3.9089 3.9438 3.9438 4.1657 4.1657 4.2022 4.2022 5.7429 5.7429 5.7487 5.7487 9.0520 9.0520 9.0677 9.0677 10.4227 10.4227 k = 0.4574 0.4385-0.0000 ( 5046 PWs) bands (ev): -10.6654 -10.6654 -10.6654 -10.6654 -10.5747 -10.5747 -10.5744 -10.5744 -1.4034 -1.4034 -1.4016 -1.4016 -0.3864 -0.3864 -0.3817 -0.3817 0.0545 0.0545 0.0570 0.0570 0.1765 0.1765 0.1771 0.1771 0.4219 0.4219 0.4285 0.4285 1.8975 1.8975 1.9020 1.9020 2.6712 2.6712 2.6813 2.6813 2.7420 2.7420 2.7539 2.7539 3.9012 3.9012 3.9367 3.9367 4.1612 4.1612 4.1974 4.1974 5.7302 5.7302 5.7359 5.7359 9.0684 9.0684 9.0836 9.0836 10.4430 10.4430 k = 0.4468 0.4385-0.0000 ( 5058 PWs) bands (ev): -10.6652 -10.6652 -10.6651 -10.6651 -10.5818 -10.5818 -10.5815 -10.5815 -1.3812 -1.3812 -1.3792 -1.3792 -0.4371 -0.4371 -0.4314 -0.4314 0.0548 0.0548 0.0587 0.0587 0.2232 0.2232 0.2260 0.2260 0.4128 0.4128 0.4235 0.4235 1.8622 1.8622 1.8648 1.8648 2.7028 2.7028 2.7091 2.7091 2.7643 2.7643 2.7756 2.7756 3.8913 3.8913 3.9276 3.9276 4.1557 4.1557 4.1914 4.1914 5.7140 5.7140 5.7198 5.7198 9.0893 9.0893 9.1039 9.1039 10.4689 10.4689 k = 0.4362 0.4385-0.0000 ( 5058 PWs) bands (ev): -10.6649 -10.6649 -10.6648 -10.6648 -10.5904 -10.5904 -10.5901 -10.5901 -1.3542 -1.3542 -1.3519 -1.3519 -0.4871 -0.4871 -0.4805 -0.4805 0.0510 0.0510 0.0565 0.0565 0.2575 0.2575 0.2639 0.2639 0.4175 0.4175 0.4326 0.4326 1.8229 1.8229 1.8236 1.8236 2.7351 2.7351 2.7368 2.7368 2.7928 2.7928 2.8030 2.8030 3.8793 3.8793 3.9165 3.9165 4.1493 4.1493 4.1843 4.1843 5.6947 5.6947 5.7006 5.7006 9.1145 9.1145 9.1284 9.1284 10.5004 10.5004 k = 0.4255 0.4385-0.0000 ( 5046 PWs) bands (ev): -10.6646 -10.6646 -10.6645 -10.6645 -10.6004 -10.6004 -10.6001 -10.6001 -1.3225 -1.3225 -1.3199 -1.3199 -0.5357 -0.5357 -0.5283 -0.5283 0.0432 0.0432 0.0506 0.0506 0.2705 0.2705 0.2763 0.2763 0.4493 0.4493 0.4652 0.4652 1.7796 1.7796 1.7808 1.7808 2.7634 2.7634 2.7663 2.7663 2.8271 2.8271 2.8365 2.8365 3.8652 3.8652 3.9036 3.9036 4.1422 4.1422 4.1764 4.1764 5.6727 5.6727 5.6786 5.6786 9.1438 9.1438 9.1569 9.1569 10.5374 10.5374 k = 0.4149 0.4385-0.0000 ( 5048 PWs) bands (ev): -10.6642 -10.6642 -10.6641 -10.6641 -10.6118 -10.6118 -10.6115 -10.6115 -1.2862 -1.2862 -1.2832 -1.2832 -0.5827 -0.5827 -0.5744 -0.5744 0.0303 0.0303 0.0399 0.0399 0.2669 0.2669 0.2691 0.2691 0.5035 0.5035 0.5173 0.5173 1.7337 1.7337 1.7367 1.7367 2.7890 2.7890 2.7956 2.7956 2.8655 2.8655 2.8752 2.8752 3.8491 3.8491 3.8888 3.8888 4.1345 4.1345 4.1677 4.1677 5.6480 5.6480 5.6540 5.6540 9.1771 9.1771 9.1892 9.1892 10.5798 10.5798 k = 0.4043 0.4385-0.0000 ( 5044 PWs) bands (ev): -10.6639 -10.6639 -10.6637 -10.6637 -10.6245 -10.6245 -10.6241 -10.6241 -1.2455 -1.2455 -1.2420 -1.2420 -0.6278 -0.6278 -0.6184 -0.6184 0.0112 0.0112 0.0229 0.0229 0.2556 0.2556 0.2572 0.2572 0.5681 0.5681 0.5797 0.5797 1.6866 1.6866 1.6914 1.6914 2.8141 2.8141 2.8236 2.8236 2.9063 2.9063 2.9173 2.9173 3.8310 3.8310 3.8723 3.8723 4.1264 4.1264 4.1584 4.1584 5.6212 5.6212 5.6273 5.6273 9.2140 9.2140 9.2251 9.2251 10.6274 10.6274 k = 0.3936 0.4385-0.0000 ( 5044 PWs) bands (ev): -10.6637 -10.6637 -10.6633 -10.6633 -10.6383 -10.6383 -10.6378 -10.6378 -1.2007 -1.2007 -1.1963 -1.1963 -0.6707 -0.6707 -0.6601 -0.6601 -0.0150 -0.0150 -0.0014 -0.0014 0.2432 0.2432 0.2478 0.2478 0.6373 0.6373 0.6469 0.6469 1.6387 1.6387 1.6454 1.6454 2.8386 2.8386 2.8505 2.8505 2.9484 2.9484 2.9616 2.9616 3.8111 3.8111 3.8543 3.8543 4.1179 4.1179 4.1486 4.1486 5.5926 5.5926 5.5988 5.5988 9.2544 9.2544 9.2644 9.2644 10.6801 10.6801 k = 0.3830 0.4385-0.0000 ( 5032 PWs) bands (ev): -10.6643 -10.6643 -10.6634 -10.6634 -10.6528 -10.6528 -10.6517 -10.6517 -1.1521 -1.1521 -1.1465 -1.1465 -0.7114 -0.7114 -0.6991 -0.6991 -0.0483 -0.0483 -0.0335 -0.0335 0.2347 0.2347 0.2413 0.2413 0.7085 0.7085 0.7163 0.7163 1.5907 1.5907 1.5993 1.5993 2.8624 2.8624 2.8765 2.8765 2.9910 2.9910 3.0069 3.0069 3.7895 3.7895 3.8349 3.8349 4.1094 4.1094 4.1386 4.1386 5.5626 5.5626 5.5689 5.5689 9.2979 9.2979 9.3068 9.3068 10.7376 10.7376 k = 0.3723 0.4385-0.0000 ( 5024 PWs) bands (ev): -10.6720 -10.6720 -10.6711 -10.6711 -10.6607 -10.6607 -10.6597 -10.6597 -1.1001 -1.1001 -1.0926 -1.0926 -0.7496 -0.7496 -0.7350 -0.7350 -0.0879 -0.0879 -0.0725 -0.0725 0.2305 0.2305 0.2383 0.2383 0.7805 0.7805 0.7864 0.7864 1.5427 1.5427 1.5535 1.5535 2.8853 2.8853 2.9014 2.9014 3.0335 3.0335 3.0527 3.0527 3.7664 3.7664 3.8143 3.8143 4.1010 4.1010 4.1285 4.1285 5.5316 5.5316 5.5381 5.5381 9.3443 9.3443 9.3520 9.3520 10.7996 10.7996 k = 0.3617 0.4385-0.0000 ( 5032 PWs) bands (ev): -10.6879 -10.6879 -10.6876 -10.6876 -10.6608 -10.6608 -10.6603 -10.6603 -1.0459 -1.0459 -1.0353 -1.0353 -0.7850 -0.7850 -0.7668 -0.7668 -0.1326 -0.1326 -0.1170 -0.1170 0.2302 0.2302 0.2386 0.2386 0.8523 0.8523 0.8559 0.8559 1.4954 1.4954 1.5087 1.5087 2.9068 2.9068 2.9249 2.9249 3.0754 3.0754 3.0982 3.0982 3.7420 3.7420 3.7928 3.7928 4.0926 4.0926 4.1183 4.1183 5.5001 5.5001 5.5068 5.5068 9.3933 9.3933 9.3997 9.3997 10.8658 10.8658 k = 0.3511 0.4385-0.0000 ( 5032 PWs) bands (ev): -10.7056 -10.7056 -10.7055 -10.7055 -10.6603 -10.6603 -10.6600 -10.6600 -0.9921 -0.9921 -0.9756 -0.9756 -0.8165 -0.8165 -0.7920 -0.7920 -0.1813 -0.1813 -0.1657 -0.1657 0.2330 0.2330 0.2417 0.2417 0.9230 0.9230 0.9238 0.9238 1.4493 1.4493 1.4657 1.4657 2.9266 2.9266 2.9469 2.9469 3.1163 3.1163 3.1433 3.1433 3.7165 3.7165 3.7708 3.7708 4.0845 4.0845 4.1082 4.1082 5.4686 5.4686 5.4754 5.4754 9.4445 9.4445 9.4496 9.4496 10.9358 10.9358 k = 0.3404 0.4385-0.0000 ( 5032 PWs) bands (ev): -10.7243 -10.7243 -10.7242 -10.7242 -10.6597 -10.6597 -10.6595 -10.6595 -0.9469 -0.9469 -0.9197 -0.9197 -0.8382 -0.8382 -0.8026 -0.8026 -0.2329 -0.2329 -0.2173 -0.2173 0.2382 0.2382 0.2468 0.2468 0.9882 0.9882 0.9912 0.9912 1.4054 1.4054 1.4259 1.4259 2.9443 2.9443 2.9669 2.9669 3.1560 3.1560 3.1875 3.1875 3.6902 3.6902 3.7484 3.7484 4.0767 4.0767 4.0984 4.0984 5.4375 5.4375 5.4445 5.4445 9.4976 9.4976 9.5015 9.5015 11.0092 11.0092 k = 0.3298 0.4385-0.0000 ( 5040 PWs) bands (ev): -10.7437 -10.7437 -10.7437 -10.7437 -10.6591 -10.6591 -10.6589 -10.6589 -0.9268 -0.9268 -0.9021 -0.9021 -0.8158 -0.8158 -0.7821 -0.7821 -0.2864 -0.2864 -0.2709 -0.2709 0.2452 0.2452 0.2537 0.2537 1.0462 1.0462 1.0547 1.0547 1.3657 1.3657 1.3920 1.3920 2.9598 2.9598 2.9847 2.9847 3.1939 3.1939 3.2306 3.2306 3.6633 3.6633 3.7262 3.7262 4.0694 4.0694 4.0889 4.0889 5.4074 5.4074 5.4146 5.4146 9.5522 9.5522 9.5549 9.5549 11.0853 11.0853 k = 0.3191 0.4385-0.0000 ( 5036 PWs) bands (ev): -10.7638 -10.7638 -10.7637 -10.7637 -10.6584 -10.6584 -10.6583 -10.6583 -0.9327 -0.9327 -0.9204 -0.9204 -0.7520 -0.7520 -0.7300 -0.7300 -0.3411 -0.3411 -0.3257 -0.3257 0.2537 0.2537 0.2620 0.2620 1.0922 1.0922 1.1081 1.1081 1.3354 1.3354 1.3693 1.3693 2.9726 2.9726 2.9999 2.9999 3.2296 3.2296 3.2723 3.2723 3.6362 3.6362 3.7046 3.7046 4.0628 4.0628 4.0799 4.0799 5.3788 5.3788 5.3861 5.3861 9.6080 9.6080 9.6094 9.6094 11.1634 11.1634 k = 0.3085 0.4385-0.0000 ( 5028 PWs) bands (ev): -10.7843 -10.7843 -10.7842 -10.7842 -10.6577 -10.6577 -10.6576 -10.6576 -0.9485 -0.9485 -0.9429 -0.9429 -0.6788 -0.6788 -0.6630 -0.6630 -0.3961 -0.3961 -0.3807 -0.3807 0.2633 0.2633 0.2713 0.2713 1.1175 1.1175 1.1392 1.1392 1.3261 1.3261 1.3659 1.3659 2.9827 2.9827 3.0124 3.0124 3.2627 3.2627 3.3121 3.3121 3.6093 3.6093 3.6842 3.6842 4.0568 4.0568 4.0716 4.0716 5.3520 5.3520 5.3595 5.3595 9.6645 9.6645 9.6648 9.6648 11.2426 11.2426 k = 0.2979 0.4385-0.0000 ( 5032 PWs) bands (ev): -10.8052 -10.8052 -10.8051 -10.8051 -10.6570 -10.6570 -10.6569 -10.6569 -0.9663 -0.9663 -0.9647 -0.9647 -0.6029 -0.6029 -0.5904 -0.5904 -0.4495 -0.4495 -0.4342 -0.4342 0.2739 0.2739 0.2816 0.2816 1.1172 1.1172 1.1371 1.1371 1.3486 1.3486 1.3867 1.3867 2.9898 2.9898 3.0219 3.0219 3.2922 3.2922 3.3492 3.3492 3.5835 3.5835 3.6656 3.6656 4.0517 4.0517 4.0639 4.0639 5.3277 5.3277 5.3354 5.3354 9.7205 9.7205 9.7214 9.7214 11.3218 11.3218 k = 0.2872 0.4385-0.0000 ( 5030 PWs) bands (ev): -10.8264 -10.8264 -10.8263 -10.8263 -10.6563 -10.6563 -10.6562 -10.6562 -0.9847 -0.9847 -0.9838 -0.9838 -0.5386 -0.5386 -0.5371 -0.5371 -0.4790 -0.4790 -0.4725 -0.4725 0.2852 0.2852 0.2926 0.2926 1.0976 1.0976 1.1118 1.1118 1.3925 1.3925 1.4249 1.4249 2.9940 2.9940 3.0284 3.0284 3.3173 3.3173 3.3822 3.3822 3.5602 3.5602 3.6499 3.6499 4.0474 4.0474 4.0572 4.0572 5.3062 5.3062 5.3140 5.3140 9.7762 9.7762 9.7781 9.7781 11.3995 11.3995 k = 0.2766 0.4385-0.0000 ( 5018 PWs) bands (ev): -10.8477 -10.8477 -10.8476 -10.8476 -10.6556 -10.6556 -10.6555 -10.6555 -1.0029 -1.0029 -0.9999 -0.9999 -0.5736 -0.5736 -0.5601 -0.5601 -0.4216 -0.4216 -0.4147 -0.4147 0.2972 0.2972 0.3043 0.3043 1.0677 1.0677 1.0770 1.0770 1.4437 1.4437 1.4712 1.4712 2.9953 2.9953 3.0317 3.0317 3.3366 3.3366 3.4074 3.4074 3.5431 3.5431 3.6383 3.6383 4.0441 4.0441 4.0515 4.0515 5.2881 5.2881 5.2960 5.2960 9.8314 9.8314 9.8343 9.8343 11.4737 11.4737 k = 0.2660 0.4385-0.0000 ( 5026 PWs) bands (ev): -10.8691 -10.8691 -10.8691 -10.8691 -10.6549 -10.6549 -10.6548 -10.6548 -1.0192 -1.0192 -1.0143 -1.0143 -0.6265 -0.6265 -0.6111 -0.6111 -0.3379 -0.3379 -0.3304 -0.3304 0.3097 0.3097 0.3164 0.3164 1.0332 1.0332 1.0388 1.0388 1.4958 1.4958 1.5194 1.5194 2.9936 2.9936 3.0318 3.0318 3.3487 3.3487 3.4180 3.4180 3.5390 3.5390 3.6322 3.6322 4.0419 4.0419 4.0469 4.0469 5.2736 5.2736 5.2815 5.2815 9.8855 9.8855 9.8894 9.8894 11.5412 11.5412 k = 0.2553 0.4385-0.0000 ( 5022 PWs) bands (ev): -10.8905 -10.8905 -10.8905 -10.8905 -10.6543 -10.6543 -10.6541 -10.6541 -1.0337 -1.0337 -1.0270 -1.0270 -0.6802 -0.6802 -0.6637 -0.6637 -0.2493 -0.2493 -0.2419 -0.2419 0.3228 0.3228 0.3290 0.3290 0.9967 0.9967 0.9995 0.9995 1.5462 1.5462 1.5668 1.5668 2.9892 2.9892 3.0288 3.0288 3.3527 3.3527 3.4104 3.4104 3.5514 3.5514 3.6326 3.6326 4.0407 4.0407 4.0435 4.0435 5.2631 5.2631 5.2711 5.2711 9.9382 9.9382 9.9430 9.9430 11.5984 11.5984 k = 0.2447 0.4385-0.0000 ( 5026 PWs) bands (ev): -10.9118 -10.9118 -10.9117 -10.9117 -10.6536 -10.6536 -10.6535 -10.6535 -1.0464 -1.0464 -1.0377 -1.0377 -0.7334 -0.7334 -0.7156 -0.7156 -0.1580 -0.1580 -0.1508 -0.1508 0.3363 0.3363 0.3420 0.3420 0.9596 0.9596 0.9602 0.9602 1.5935 1.5935 1.6117 1.6117 2.9823 2.9823 3.0229 3.0229 3.3483 3.3483 3.3906 3.3906 3.5744 3.5744 3.6395 3.6395 4.0405 4.0405 4.0414 4.0414 5.2569 5.2569 5.2648 5.2648 9.9889 9.9889 9.9944 9.9944 11.6443 11.6443 k = 0.2340 0.4385-0.0000 ( 5014 PWs) bands (ev): -10.9329 -10.9329 -10.9328 -10.9328 -10.6529 -10.6529 -10.6528 -10.6528 -1.0575 -1.0575 -1.0467 -1.0467 -0.7854 -0.7854 -0.7661 -0.7661 -0.0648 -0.0648 -0.0577 -0.0577 0.3503 0.3503 0.3555 0.3555 0.9214 0.9214 0.9226 0.9226 1.6371 1.6371 1.6531 1.6531 2.9731 2.9731 3.0143 3.0143 3.3363 3.3363 3.3649 3.3649 3.6013 3.6013 3.6519 3.6519 4.0406 4.0406 4.0416 4.0416 5.2552 5.2552 5.2631 5.2631 10.0370 10.0370 10.0433 10.0433 11.6769 11.6769 k = 0.2234 0.4385-0.0000 ( 5012 PWs) bands (ev): -10.9536 -10.9536 -10.9536 -10.9536 -10.6523 -10.6523 -10.6522 -10.6522 -1.0674 -1.0674 -1.0538 -1.0538 -0.8360 -0.8360 -0.8146 -0.8146 0.0296 0.0296 0.0366 0.0366 0.3649 0.3649 0.3695 0.3695 0.8835 0.8835 0.8862 0.8862 1.6766 1.6766 1.6905 1.6905 2.9618 2.9618 3.0030 3.0030 3.3182 3.3182 3.3362 3.3362 3.6292 3.6292 3.6683 3.6683 4.0412 4.0412 4.0437 4.0437 5.2581 5.2581 5.2659 5.2659 10.0820 10.0820 10.0890 10.0890 11.6955 11.6955 k = 0.2128 0.4385-0.0000 ( 5020 PWs) bands (ev): -10.9740 -10.9740 -10.9740 -10.9740 -10.6516 -10.6516 -10.6516 -10.6516 -1.0763 -1.0763 -1.0593 -1.0593 -0.8851 -0.8851 -0.8607 -0.8607 0.1245 0.1245 0.1314 0.1314 0.3806 0.3806 0.3845 0.3845 0.8466 0.8466 0.8506 0.8506 1.7115 1.7115 1.7235 1.7235 2.9487 2.9487 2.9896 2.9896 3.2952 3.2952 3.3055 3.3055 3.6568 3.6568 3.6872 3.6872 4.0432 4.0432 4.0469 4.0469 5.2657 5.2657 5.2733 5.2733 10.1236 10.1236 10.1310 10.1310 11.7009 11.7009 k = 0.2021 0.4385-0.0000 ( 5016 PWs) bands (ev): -10.9939 -10.9939 -10.9939 -10.9939 -10.6510 -10.6510 -10.6510 -10.6510 -1.0851 -1.0851 -1.0633 -1.0633 -0.9323 -0.9323 -0.9036 -0.9036 0.2179 0.2179 0.2247 0.2247 0.3987 0.3987 0.4021 0.4021 0.8110 0.8110 0.8163 0.8163 1.7419 1.7419 1.7520 1.7520 2.9340 2.9340 2.9740 2.9740 3.2685 3.2685 3.2732 3.2732 3.6835 3.6835 3.7074 3.7074 4.0466 4.0466 4.0513 4.0513 5.2778 5.2778 5.2854 5.2854 10.1610 10.1610 10.1690 10.1690 11.6949 11.6949 k = 0.1915 0.4385-0.0000 ( 5012 PWs) bands (ev): -11.0133 -11.0133 -11.0132 -11.0132 -10.6505 -10.6505 -10.6504 -10.6504 -1.0948 -1.0948 -1.0662 -1.0662 -0.9772 -0.9772 -0.9422 -0.9422 0.3045 0.3045 0.3104 0.3104 0.4242 0.4242 0.4276 0.4276 0.7771 0.7771 0.7836 0.7836 1.7676 1.7676 1.7760 1.7760 2.9180 2.9180 2.9567 2.9567 3.2386 3.2386 3.2397 3.2397 3.7090 3.7090 3.7281 3.7281 4.0515 4.0515 4.0568 4.0568 5.2945 5.2945 5.3018 5.3018 10.1941 10.1941 10.2024 10.2024 11.6801 11.6801 k = 0.1809 0.4385-0.0000 ( 5016 PWs) bands (ev): -11.0321 -11.0321 -11.0320 -11.0320 -10.6499 -10.6499 -10.6498 -10.6498 -1.1070 -1.1070 -1.0693 -1.0693 -1.0185 -1.0185 -0.9747 -0.9747 0.3679 0.3679 0.3712 0.3712 0.4724 0.4724 0.4777 0.4777 0.7455 0.7455 0.7530 0.7530 1.7889 1.7889 1.7955 1.7955 2.9008 2.9008 2.9378 2.9378 3.2050 3.2050 3.2062 3.2062 3.7329 3.7329 3.7485 3.7485 4.0577 4.0577 4.0635 4.0635 5.3154 5.3154 5.3225 5.3225 10.2223 10.2223 10.2309 10.2309 11.6590 11.6590 k = 0.1702 0.4385-0.0000 ( 5002 PWs) bands (ev): -11.0501 -11.0501 -11.0500 -11.0500 -10.6494 -10.6494 -10.6493 -10.6493 -1.1237 -1.1237 -1.0805 -1.0805 -1.0483 -1.0483 -0.9995 -0.9995 0.4004 0.4004 0.4009 0.4009 0.5484 0.5484 0.5562 0.5562 0.7185 0.7185 0.7266 0.7266 1.8060 1.8060 1.8108 1.8108 2.8825 2.8825 2.9174 2.9174 3.1692 3.1692 3.1717 3.1717 3.7551 3.7551 3.7681 3.7681 4.0653 4.0653 4.0712 4.0712 5.3403 5.3403 5.3471 5.3471 10.2454 10.2454 10.2542 10.2542 11.6339 11.6339 k = 0.1596 0.4385-0.0000 ( 4998 PWs) bands (ev): -11.0674 -11.0674 -11.0673 -11.0673 -10.6489 -10.6489 -10.6488 -10.6488 -1.1456 -1.1456 -1.1110 -1.1110 -1.0555 -1.0555 -1.0155 -1.0155 0.4179 0.4179 0.4194 0.4194 0.6200 0.6200 0.6316 0.6316 0.7110 0.7110 0.7175 0.7175 1.8190 1.8190 1.8222 1.8222 2.8630 2.8630 2.8954 2.8954 3.1326 3.1326 3.1355 3.1355 3.7754 3.7754 3.7865 3.7865 4.0740 4.0740 4.0800 4.0800 5.3687 5.3687 5.3753 5.3753 10.2633 10.2633 10.2722 10.2722 11.6065 11.6065 k = 0.1489 0.4385-0.0000 ( 5000 PWs) bands (ev): -11.0839 -11.0839 -11.0838 -11.0838 -10.6484 -10.6484 -10.6484 -10.6484 -1.1716 -1.1716 -1.1464 -1.1464 -1.0544 -1.0544 -1.0243 -1.0243 0.4301 0.4301 0.4337 0.4337 0.6305 0.6305 0.6453 0.6453 0.7703 0.7703 0.7759 0.7759 1.8285 1.8285 1.8300 1.8300 2.8422 2.8422 2.8716 2.8716 3.0956 3.0956 3.0980 3.0980 3.7938 3.7938 3.8035 3.8035 4.0838 4.0838 4.0897 4.0897 5.4001 5.4001 5.4064 5.4064 10.2760 10.2760 10.2848 10.2848 11.5783 11.5783 k = 0.1383 0.4385-0.0000 ( 4998 PWs) bands (ev): -11.0995 -11.0995 -11.0994 -11.0994 -10.6480 -10.6480 -10.6479 -10.6479 -1.1995 -1.1995 -1.1809 -1.1809 -1.0511 -1.0511 -1.0279 -1.0279 0.4395 0.4395 0.4455 0.4455 0.6114 0.6114 0.6278 0.6278 0.8627 0.8627 0.8691 0.8691 1.8348 1.8348 1.8349 1.8349 2.8197 2.8197 2.8456 2.8456 3.0587 3.0587 3.0600 3.0600 3.8101 3.8101 3.8188 3.8188 4.0945 4.0945 4.1001 4.1001 5.4341 5.4341 5.4401 5.4401 10.2836 10.2836 10.2923 10.2923 11.5504 11.5504 k = 0.1277 0.4385-0.0000 ( 4990 PWs) bands (ev): -11.1141 -11.1141 -11.1141 -11.1141 -10.6476 -10.6476 -10.6475 -10.6475 -1.2276 -1.2276 -1.2135 -1.2135 -1.0467 -1.0467 -1.0282 -1.0282 0.4465 0.4465 0.4551 0.4551 0.5897 0.5897 0.6081 0.6081 0.9604 0.9604 0.9675 0.9675 1.8368 1.8368 1.8385 1.8385 2.7949 2.7949 2.8169 2.8169 3.0223 3.0223 3.0226 3.0226 3.8246 3.8246 3.8324 3.8324 4.1058 4.1058 4.1112 4.1112 5.4699 5.4699 5.4756 5.4756 10.2864 10.2864 10.2948 10.2948 11.5235 11.5235 k = 0.1170 0.4385-0.0000 ( 4986 PWs) bands (ev): -11.1278 -11.1278 -11.1278 -11.1278 -10.6472 -10.6472 -10.6472 -10.6472 -1.2548 -1.2548 -1.2438 -1.2438 -1.0414 -1.0414 -1.0264 -1.0264 0.4508 0.4508 0.4623 0.4623 0.5697 0.5697 0.5905 0.5905 1.0592 1.0592 1.0670 1.0670 1.8367 1.8367 1.8400 1.8400 2.7669 2.7669 2.7846 2.7846 2.9858 2.9858 2.9884 2.9884 3.8371 3.8371 3.8442 3.8442 4.1175 4.1175 4.1225 4.1225 5.5069 5.5069 5.5122 5.5122 10.2850 10.2850 10.2930 10.2930 11.4980 11.4980 k = 0.1064 0.4385-0.0000 ( 4998 PWs) bands (ev): -11.1405 -11.1405 -11.1404 -11.1404 -10.6469 -10.6469 -10.6468 -10.6468 -1.2805 -1.2805 -1.2717 -1.2717 -1.0357 -1.0357 -1.0233 -1.0233 0.4519 0.4519 0.4661 0.4661 0.5536 0.5536 0.5763 0.5763 1.1576 1.1576 1.1662 1.1662 1.8349 1.8349 1.8399 1.8399 2.7346 2.7346 2.7479 2.7479 2.9519 2.9519 2.9568 2.9568 3.8479 3.8479 3.8544 3.8544 4.1292 4.1292 4.1338 4.1338 5.5444 5.5444 5.5493 5.5493 10.2800 10.2800 10.2875 10.2875 11.4745 11.4745 k = 0.0957 0.4385-0.0000 ( 5004 PWs) bands (ev): -11.1520 -11.1520 -11.1520 -11.1520 -10.6466 -10.6466 -10.6465 -10.6465 -1.3042 -1.3042 -1.2972 -1.2972 -1.0297 -1.0297 -1.0193 -1.0193 0.4497 0.4497 0.4650 0.4650 0.5429 0.5429 0.5662 0.5662 1.2550 1.2550 1.2645 1.2645 1.8318 1.8318 1.8387 1.8387 2.6971 2.6971 2.7061 2.7061 2.9217 2.9217 2.9288 2.9288 3.8572 3.8572 3.8631 3.8631 4.1407 4.1407 4.1448 4.1448 5.5815 5.5815 5.5860 5.5860 10.2720 10.2720 10.2789 10.2789 11.4529 11.4529 k = 0.0851 0.4385-0.0000 ( 5008 PWs) bands (ev): -11.1625 -11.1625 -11.1624 -11.1624 -10.6463 -10.6463 -10.6463 -10.6463 -1.3258 -1.3258 -1.3201 -1.3201 -1.0236 -1.0236 -1.0149 -1.0149 0.4444 0.4444 0.4588 0.4588 0.5383 0.5383 0.5600 0.5600 1.3508 1.3508 1.3615 1.3615 1.8281 1.8281 1.8370 1.8370 2.6538 2.6538 2.6593 2.6593 2.8959 2.8959 2.9045 2.9045 3.8650 3.8650 3.8703 3.8703 4.1516 4.1516 4.1554 4.1554 5.6175 5.6175 5.6216 5.6216 10.2619 10.2619 10.2681 10.2681 11.4334 11.4334 k = 0.0745 0.4385-0.0000 ( 5004 PWs) bands (ev): -11.1718 -11.1718 -11.1717 -11.1717 -10.6461 -10.6461 -10.6460 -10.6460 -1.3451 -1.3451 -1.3405 -1.3405 -1.0176 -1.0176 -1.0104 -1.0104 0.4370 0.4370 0.4491 0.4491 0.5383 0.5383 0.5570 0.5570 1.4440 1.4440 1.4565 1.4565 1.8242 1.8242 1.8358 1.8358 2.6050 2.6050 2.6077 2.6077 2.8745 2.8745 2.8838 2.8838 3.8716 3.8716 3.8764 3.8764 4.1619 4.1619 4.1652 4.1652 5.6517 5.6517 5.6553 5.6553 10.2505 10.2505 10.2560 10.2560 11.4158 11.4158 k = 0.0638 0.4385-0.0000 ( 5016 PWs) bands (ev): -11.1799 -11.1799 -11.1799 -11.1799 -10.6459 -10.6459 -10.6458 -10.6458 -1.3619 -1.3619 -1.3583 -1.3583 -1.0120 -1.0120 -1.0060 -1.0060 0.4285 0.4285 0.4382 0.4382 0.5407 0.5407 0.5561 0.5561 1.5334 1.5334 1.5487 1.5487 1.8210 1.8210 1.8361 1.8361 2.5511 2.5511 2.5517 2.5517 2.8574 2.8574 2.8665 2.8665 3.8771 3.8771 3.8812 3.8812 4.1712 4.1712 4.1741 4.1741 5.6831 5.6831 5.6862 5.6862 10.2388 10.2388 10.2435 10.2435 11.4005 11.4005 k = 0.0532 0.4385-0.0000 ( 5012 PWs) bands (ev): -11.1868 -11.1868 -11.1868 -11.1868 -10.6457 -10.6457 -10.6457 -10.6457 -1.3763 -1.3763 -1.3734 -1.3734 -1.0068 -1.0068 -1.0019 -1.0019 0.4201 0.4201 0.4275 0.4275 0.5440 0.5440 0.5563 0.5563 1.6166 1.6166 1.6363 1.6363 1.8200 1.8200 1.8403 1.8403 2.4921 2.4921 2.4930 2.4930 2.8439 2.8439 2.8523 2.8523 3.8816 3.8816 3.8851 3.8851 4.1793 4.1793 4.1818 4.1818 5.7112 5.7112 5.7138 5.7138 10.2273 10.2273 10.2312 10.2312 11.3875 11.3875 k = 0.0426 0.4385-0.0000 ( 5016 PWs) bands (ev): -11.1925 -11.1925 -11.1925 -11.1925 -10.6456 -10.6456 -10.6455 -10.6455 -1.3880 -1.3880 -1.3858 -1.3858 -1.0022 -1.0022 -0.9984 -0.9984 0.4126 0.4126 0.4180 0.4180 0.5475 0.5475 0.5570 0.5570 1.6878 1.6878 1.7137 1.7137 1.8262 1.8262 1.8536 1.8536 2.4298 2.4298 2.4318 2.4318 2.8335 2.8335 2.8407 2.8407 3.8852 3.8852 3.8880 3.8880 4.1862 4.1862 4.1882 4.1882 5.7352 5.7352 5.7374 5.7374 10.2170 10.2170 10.2201 10.2201 11.3768 11.3768 k = 0.0319 0.4385-0.0000 ( 5020 PWs) bands (ev): -11.1970 -11.1970 -11.1969 -11.1969 -10.6455 -10.6455 -10.6454 -10.6454 -1.3972 -1.3972 -1.3955 -1.3955 -0.9984 -0.9984 -0.9956 -0.9956 0.4064 0.4064 0.4102 0.4102 0.5507 0.5507 0.5576 0.5576 1.7371 1.7371 1.7625 1.7625 1.8571 1.8571 1.8848 1.8848 2.3663 2.3663 2.3691 2.3691 2.8261 2.8261 2.8317 2.8317 3.8880 3.8880 3.8901 3.8901 4.1917 4.1917 4.1932 4.1932 5.7546 5.7546 5.7562 5.7562 10.2083 10.2083 10.2106 10.2106 11.3684 11.3684 k = 0.0213 0.4385-0.0000 ( 5012 PWs) bands (ev): -11.2002 -11.2002 -11.2001 -11.2001 -10.6454 -10.6454 -10.6453 -10.6453 -1.4036 -1.4036 -1.4026 -1.4026 -0.9955 -0.9955 -0.9936 -0.9936 0.4019 0.4019 0.4043 0.4043 0.5534 0.5534 0.5579 0.5579 1.7617 1.7617 1.7767 1.7767 1.9162 1.9162 1.9341 1.9341 2.3045 2.3045 2.3078 2.3078 2.8212 2.8212 2.8251 2.8251 3.8901 3.8901 3.8915 3.8915 4.1958 4.1958 4.1968 4.1968 5.7689 5.7689 5.7700 5.7700 10.2019 10.2019 10.2034 10.2034 11.3624 11.3624 k = 0.0106 0.4385-0.0000 ( 5012 PWs) bands (ev): -11.2021 -11.2021 -11.2020 -11.2020 -10.6453 -10.6453 -10.6453 -10.6453 -1.4074 -1.4074 -1.4069 -1.4069 -0.9935 -0.9935 -0.9926 -0.9926 0.3993 0.3993 0.4005 0.4005 0.5555 0.5555 0.5578 0.5578 1.7722 1.7722 1.7787 1.7787 1.9737 1.9737 1.9828 1.9828 2.2525 2.2525 2.2553 2.2553 2.8187 2.8187 2.8207 2.8207 3.8915 3.8915 3.8922 3.8922 4.1984 4.1984 4.1989 4.1989 5.7778 5.7778 5.7783 5.7783 10.1980 10.1980 10.1988 10.1988 11.3589 11.3589 k = 0.0000 0.4385-0.0000 ( 5004 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4085 -1.4085 -1.4085 -1.4085 -0.9926 -0.9926 -0.9925 -0.9925 0.3988 0.3988 0.3989 0.3989 0.5570 0.5570 0.5570 0.5570 1.7769 1.7769 1.7769 1.7769 2.0025 2.0025 2.0025 2.0025 2.2305 2.2305 2.2306 2.2306 2.8186 2.8186 2.8187 2.8187 3.8921 3.8921 3.8922 3.8922 4.1994 4.1994 4.1995 4.1995 5.7809 5.7809 5.7810 5.7810 10.1969 10.1969 10.1970 10.1970 11.3577 11.3577 k = 0.0000 0.4385-0.0000 ( 5004 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4085 -1.4085 -1.4085 -1.4085 -0.9926 -0.9926 -0.9925 -0.9925 0.3988 0.3988 0.3989 0.3989 0.5570 0.5570 0.5570 0.5570 1.7769 1.7769 1.7769 1.7769 2.0025 2.0025 2.0025 2.0025 2.2305 2.2305 2.2306 2.2306 2.8186 2.8186 2.8187 2.8187 3.8921 3.8921 3.8922 3.8922 4.1994 4.1994 4.1995 4.1995 5.7809 5.7809 5.7810 5.7810 10.1969 10.1969 10.1970 10.1970 11.3577 11.3577 k = 0.0000 0.4280-0.0000 ( 5010 PWs) bands (ev): -11.2076 -11.2076 -11.1982 -11.1982 -10.6509 -10.6509 -10.6398 -10.6398 -1.4163 -1.4163 -1.4003 -1.4003 -0.9938 -0.9938 -0.9913 -0.9913 0.3931 0.3931 0.4032 0.4032 0.5497 0.5497 0.5691 0.5691 1.7686 1.7686 1.7853 1.7853 1.9976 1.9976 2.0071 2.0071 2.2295 2.2295 2.2317 2.2317 2.8184 2.8184 2.8192 2.8192 3.8884 3.8884 3.8950 3.8950 4.1954 4.1954 4.2025 4.2025 5.7751 5.7751 5.7866 5.7866 10.1645 10.1645 10.2325 10.2325 11.2909 11.2909 k = 0.0000 0.4176-0.0000 ( 5014 PWs) bands (ev): -11.2131 -11.2131 -11.1943 -11.1943 -10.6566 -10.6566 -10.6345 -10.6345 -1.4235 -1.4235 -1.3916 -1.3916 -0.9950 -0.9950 -0.9901 -0.9901 0.3870 0.3870 0.4049 0.4049 0.5486 0.5486 0.5851 0.5851 1.7603 1.7603 1.7938 1.7938 1.9923 1.9923 2.0113 2.0113 2.2287 2.2287 2.2330 2.2330 2.8186 2.8186 2.8202 2.8202 3.8835 3.8835 3.8969 3.8969 4.1905 4.1905 4.2045 4.2045 5.7692 5.7692 5.7922 5.7922 10.1354 10.1354 10.2705 10.2705 11.2239 11.2239 k = 0.0000 0.4072-0.0000 ( 5004 PWs) bands (ev): -11.2191 -11.2191 -11.1909 -11.1909 -10.6624 -10.6624 -10.6293 -10.6293 -1.4304 -1.4304 -1.3824 -1.3824 -0.9962 -0.9962 -0.9889 -0.9889 0.3814 0.3814 0.4036 0.4036 0.5544 0.5544 0.6038 0.6038 1.7521 1.7521 1.8024 1.8024 1.9866 1.9866 2.0151 2.0151 2.2280 2.2280 2.2345 2.2345 2.8192 2.8192 2.8216 2.8216 3.8776 3.8776 3.8979 3.8979 4.1851 4.1851 4.2054 4.2054 5.7633 5.7633 5.7978 5.7978 10.1100 10.1100 10.3101 10.3101 11.1581 11.1581 k = 0.0000 0.3967-0.0000 ( 5008 PWs) bands (ev): -11.2255 -11.2255 -11.1881 -11.1881 -10.6683 -10.6683 -10.6242 -10.6242 -1.4368 -1.4368 -1.3727 -1.3727 -0.9974 -0.9974 -0.9877 -0.9877 0.3768 0.3768 0.3995 0.3995 0.5666 0.5666 0.6248 0.6248 1.7438 1.7438 1.8111 1.8111 1.9807 1.9807 2.0186 2.0186 2.2274 2.2274 2.2361 2.2361 2.8202 2.8202 2.8233 2.8233 3.8707 3.8707 3.8979 3.8979 4.1791 4.1791 4.2050 4.2050 5.7573 5.7573 5.8032 5.8032 10.0884 10.0884 10.3497 10.3497 11.0952 11.0952 k = 0.0000 0.3863-0.0000 ( 5012 PWs) bands (ev): -11.2324 -11.2324 -11.1857 -11.1857 -10.6743 -10.6743 -10.6193 -10.6193 -1.4429 -1.4429 -1.3624 -1.3624 -0.9986 -0.9986 -0.9865 -0.9865 0.3733 0.3733 0.3937 0.3937 0.5844 0.5844 0.6476 0.6476 1.7355 1.7355 1.8200 1.8200 1.9745 1.9745 2.0218 2.0218 2.2270 2.2270 2.2378 2.2378 2.8216 2.8216 2.8254 2.8254 3.8626 3.8626 3.8970 3.8970 4.1729 4.1729 4.2035 4.2035 5.7513 5.7513 5.8085 5.8085 10.0705 10.0705 10.3869 10.3869 11.0380 11.0380 k = 0.0000 0.3758-0.0000 ( 5004 PWs) bands (ev): -11.2396 -11.2396 -11.1839 -11.1839 -10.6804 -10.6804 -10.6145 -10.6145 -1.4486 -1.4486 -1.3517 -1.3517 -0.9998 -0.9998 -0.9853 -0.9853 0.3708 0.3708 0.3877 0.3877 0.6067 0.6067 0.6720 0.6720 1.7270 1.7270 1.8291 1.8291 1.9680 1.9680 2.0246 2.0246 2.2268 2.2268 2.2396 2.2396 2.8233 2.8233 2.8278 2.8278 3.8534 3.8534 3.8952 3.8952 4.1665 4.1665 4.2007 4.2007 5.7452 5.7452 5.8136 5.8136 10.0564 10.0564 10.4177 10.4177 10.9904 10.9904 k = 0.0000 0.3654-0.0000 ( 5012 PWs) bands (ev): -11.2473 -11.2473 -11.1826 -11.1826 -10.6866 -10.6866 -10.6100 -10.6100 -1.4541 -1.4541 -1.3405 -1.3405 -1.0011 -1.0011 -0.9841 -0.9841 0.3686 0.3686 0.3830 0.3830 0.6328 0.6328 0.6977 0.6977 1.7183 1.7183 1.8382 1.8382 1.9613 1.9613 2.0272 2.0272 2.2267 2.2267 2.2415 2.2415 2.8253 2.8253 2.8305 2.8305 3.8432 3.8432 3.8924 3.8924 4.1601 4.1601 4.1967 4.1967 5.7392 5.7392 5.8186 5.8186 10.0458 10.0458 10.4364 10.4364 10.9583 10.9583 k = 0.0000 0.3550-0.0000 ( 5004 PWs) bands (ev): -11.2554 -11.2554 -11.1818 -11.1818 -10.6928 -10.6928 -10.6055 -10.6055 -1.4594 -1.4594 -1.3289 -1.3289 -1.0023 -1.0023 -0.9829 -0.9829 0.3656 0.3656 0.3814 0.3814 0.6621 0.6621 0.7248 0.7248 1.7095 1.7095 1.8473 1.8473 1.9546 1.9546 2.0295 2.0295 2.2268 2.2268 2.2436 2.2436 2.8278 2.8278 2.8335 2.8335 3.8318 3.8318 3.8887 3.8887 4.1538 4.1538 4.1917 4.1917 5.7331 5.7331 5.8236 5.8236 10.0387 10.0387 10.4369 10.4369 10.9478 10.9478 k = 0.0000 0.3445-0.0000 ( 5000 PWs) bands (ev): -11.2638 -11.2638 -11.1815 -11.1815 -10.6990 -10.6990 -10.6013 -10.6013 -1.4646 -1.4646 -1.3170 -1.3170 -1.0035 -1.0035 -0.9817 -0.9817 0.3617 0.3617 0.3832 0.3832 0.6941 0.6941 0.7531 0.7531 1.7004 1.7004 1.8563 1.8563 1.9479 1.9479 2.0316 2.0316 2.2271 2.2271 2.2457 2.2457 2.8304 2.8304 2.8368 2.8368 3.8195 3.8195 3.8840 3.8840 4.1476 4.1476 4.1858 4.1858 5.7270 5.7270 5.8284 5.8284 10.0349 10.0349 10.4163 10.4163 10.9617 10.9617 k = 0.0000 0.3341-0.0000 ( 5000 PWs) bands (ev): -11.2725 -11.2725 -11.1816 -11.1816 -10.7054 -10.7054 -10.5972 -10.5972 -1.4696 -1.4696 -1.3046 -1.3046 -1.0046 -1.0046 -0.9806 -0.9806 0.3581 0.3581 0.3876 0.3876 0.7286 0.7286 0.7826 0.7826 1.6910 1.6910 1.8651 1.8651 1.9414 1.9414 2.0337 2.0337 2.2274 2.2274 2.2479 2.2479 2.8334 2.8334 2.8403 2.8403 3.8062 3.8062 3.8782 3.8782 4.1416 4.1416 4.1793 4.1793 5.7210 5.7210 5.8330 5.8330 10.0341 10.0341 10.3772 10.3772 10.9974 10.9974 k = 0.0000 0.3236-0.0000 ( 5016 PWs) bands (ev): -11.2814 -11.2814 -11.1821 -11.1821 -10.7117 -10.7117 -10.5934 -10.5934 -1.4745 -1.4745 -1.2920 -1.2920 -1.0058 -1.0058 -0.9794 -0.9794 0.3554 0.3554 0.3938 0.3938 0.7652 0.7652 0.8133 0.8133 1.6812 1.6812 1.8731 1.8731 1.9355 1.9355 2.0357 2.0357 2.2279 2.2279 2.2500 2.2500 2.8366 2.8366 2.8440 2.8440 3.7921 3.7921 3.8712 3.8712 4.1357 4.1357 4.1723 4.1723 5.7150 5.7150 5.8375 5.8375 10.0361 10.0361 10.3246 10.3246 11.0497 11.0497 k = 0.0000 0.3132-0.0000 ( 5012 PWs) bands (ev): -11.2906 -11.2906 -11.1831 -11.1831 -10.7181 -10.7181 -10.5897 -10.5897 -1.4795 -1.4795 -1.2791 -1.2791 -1.0070 -1.0070 -0.9782 -0.9782 0.3541 0.3541 0.4018 0.4018 0.8036 0.8036 0.8453 0.8453 1.6711 1.6711 1.8798 1.8798 1.9309 1.9309 2.0378 2.0378 2.2285 2.2285 2.2523 2.2523 2.8400 2.8400 2.8479 2.8479 3.7772 3.7772 3.8631 3.8631 4.1296 4.1296 4.1655 4.1655 5.7090 5.7090 5.8418 5.8418 10.0406 10.0406 10.2635 10.2635 11.1136 11.1136 k = 0.0000 0.3028-0.0000 ( 5014 PWs) bands (ev): -11.3000 -11.3000 -11.1845 -11.1845 -10.7244 -10.7244 -10.5862 -10.5862 -1.4844 -1.4844 -1.2661 -1.2661 -1.0081 -1.0081 -0.9771 -0.9771 0.3542 0.3542 0.4111 0.4111 0.8433 0.8433 0.8790 0.8790 1.6606 1.6606 1.8838 1.8838 1.9287 1.9287 2.0401 2.0401 2.2293 2.2293 2.2547 2.2547 2.8436 2.8436 2.8519 2.8519 3.7617 3.7617 3.8538 3.8538 4.1233 4.1233 4.1592 4.1592 5.7031 5.7031 5.8460 5.8460 10.0472 10.0472 10.1971 10.1971 11.1855 11.1855 k = 0.0000 0.2923-0.0000 ( 5014 PWs) bands (ev): -11.3095 -11.3095 -11.1862 -11.1862 -10.7308 -10.7308 -10.5829 -10.5829 -1.4894 -1.4894 -1.2529 -1.2529 -1.0093 -1.0093 -0.9759 -0.9759 0.3559 0.3559 0.4218 0.4218 0.8839 0.8839 0.9146 0.9146 1.6496 1.6496 1.8842 1.8842 1.9298 1.9298 2.0428 2.0428 2.2301 2.2301 2.2570 2.2570 2.8473 2.8473 2.8560 2.8560 3.7456 3.7456 3.8431 3.8431 4.1163 4.1163 4.1538 4.1538 5.6973 5.6973 5.8501 5.8501 10.0556 10.0556 10.1275 10.1275 11.2631 11.2631 k = 0.0000 0.2819-0.0000 ( 5002 PWs) bands (ev): -11.3191 -11.3191 -11.1882 -11.1882 -10.7371 -10.7371 -10.5797 -10.5797 -1.4945 -1.4945 -1.2397 -1.2397 -1.0104 -1.0104 -0.9748 -0.9748 0.3593 0.3593 0.4335 0.4335 0.9243 0.9243 0.9529 0.9529 1.6382 1.6382 1.8812 1.8812 1.9339 1.9339 2.0460 2.0460 2.2311 2.2311 2.2594 2.2594 2.8512 2.8512 2.8602 2.8602 3.7292 3.7292 3.8310 3.8310 4.1089 4.1089 4.1497 4.1497 5.6916 5.6916 5.8540 5.8540 10.0552 10.0552 10.0664 10.0664 11.3444 11.3444 k = 0.0000 0.2714-0.0000 ( 5006 PWs) bands (ev): -11.3288 -11.3288 -11.1906 -11.1906 -10.7434 -10.7434 -10.5768 -10.5768 -1.4997 -1.4997 -1.2265 -1.2265 -1.0115 -1.0115 -0.9736 -0.9736 0.3644 0.3644 0.4462 0.4462 0.9639 0.9639 0.9944 0.9944 1.6264 1.6264 1.8759 1.8759 1.9396 1.9396 2.0500 2.0500 2.2322 2.2322 2.2618 2.2618 2.8551 2.8551 2.8644 2.8644 3.7125 3.7125 3.8172 3.8172 4.1009 4.1009 4.1469 4.1469 5.6860 5.6860 5.8578 5.8578 9.9834 9.9834 10.0768 10.0768 11.4273 11.4273 k = 0.0000 0.2610-0.0000 ( 5010 PWs) bands (ev): -11.3385 -11.3385 -11.1932 -11.1932 -10.7496 -10.7496 -10.5741 -10.5741 -1.5050 -1.5050 -1.2133 -1.2133 -1.0126 -1.0126 -0.9725 -0.9725 0.3711 0.3711 0.4598 0.4598 1.0027 1.0027 1.0387 1.0387 1.6142 1.6142 1.8695 1.8695 1.9458 1.9458 2.0550 2.0550 2.2333 2.2333 2.2641 2.2641 2.8590 2.8590 2.8685 2.8685 3.6957 3.6957 3.8020 3.8020 4.0928 4.0928 4.1454 4.1454 5.6805 5.6805 5.8614 5.8614 9.9106 9.9106 10.0887 10.0887 11.5003 11.5003 k = 0.0000 0.2506-0.0000 ( 5004 PWs) bands (ev): -11.3482 -11.3482 -11.1960 -11.1960 -10.7558 -10.7558 -10.5715 -10.5715 -1.5105 -1.5105 -1.2003 -1.2003 -1.0136 -1.0136 -0.9713 -0.9713 0.3796 0.3796 0.4740 0.4740 1.0414 1.0414 1.0849 1.0849 1.6018 1.6018 1.8624 1.8624 1.9517 1.9517 2.0611 2.0611 2.2345 2.2345 2.2665 2.2665 2.8629 2.8629 2.8728 2.8728 3.6788 3.6788 3.7852 3.7852 4.0849 4.0849 4.1449 4.1449 5.6752 5.6752 5.8649 5.8649 9.8378 9.8378 10.1010 10.1010 11.4847 11.4847 k = 0.0000 0.2401-0.0000 ( 5012 PWs) bands (ev): -11.3579 -11.3579 -11.1991 -11.1991 -10.7619 -10.7619 -10.5692 -10.5692 -1.5161 -1.5161 -1.1875 -1.1875 -1.0146 -1.0146 -0.9702 -0.9702 0.3896 0.3896 0.4887 0.4887 1.0802 1.0802 1.1323 1.1323 1.5893 1.5893 1.8550 1.8550 1.9569 1.9569 2.0684 2.0684 2.2357 2.2357 2.2688 2.2688 2.8669 2.8669 2.8769 2.8769 3.6618 3.6618 3.7667 3.7667 4.0774 4.0774 4.1454 4.1454 5.6700 5.6700 5.8682 5.8682 9.7655 9.7655 10.1135 10.1135 11.4249 11.4249 k = 0.0000 0.2297-0.0000 ( 5018 PWs) bands (ev): -11.3675 -11.3675 -11.2023 -11.2023 -10.7679 -10.7679 -10.5670 -10.5670 -1.5218 -1.5218 -1.1750 -1.1750 -1.0156 -1.0156 -0.9690 -0.9690 0.4013 0.4013 0.5038 0.5038 1.1195 1.1195 1.1801 1.1801 1.5772 1.5772 1.8476 1.8476 1.9612 1.9612 2.0771 2.0771 2.2370 2.2370 2.2710 2.2710 2.8707 2.8707 2.8809 2.8809 3.6449 3.6449 3.7466 3.7466 4.0705 4.0705 4.1468 4.1468 5.6649 5.6649 5.8714 5.8714 9.6940 9.6940 10.1258 10.1258 11.3585 11.3585 k = 0.0000 0.2192-0.0000 ( 5022 PWs) bands (ev): -11.3769 -11.3769 -11.2056 -11.2056 -10.7738 -10.7738 -10.5650 -10.5650 -1.5276 -1.5276 -1.1629 -1.1629 -1.0166 -1.0166 -0.9678 -0.9678 0.4145 0.4145 0.5190 0.5190 1.1593 1.1593 1.2272 1.2272 1.5659 1.5659 1.8402 1.8402 1.9646 1.9646 2.0870 2.0870 2.2383 2.2383 2.2732 2.2732 2.8746 2.8746 2.8849 2.8849 3.6282 3.6282 3.7249 3.7249 4.0643 4.0643 4.1490 4.1490 5.6600 5.6600 5.8745 5.8745 9.6235 9.6235 10.1376 10.1376 11.2887 11.2887 k = 0.0000 0.2088-0.0000 ( 5020 PWs) bands (ev): -11.3862 -11.3862 -11.2091 -11.2091 -10.7795 -10.7795 -10.5631 -10.5631 -1.5335 -1.5335 -1.1511 -1.1511 -1.0175 -1.0175 -0.9666 -0.9666 0.4291 0.4291 0.5344 0.5344 1.1995 1.1995 1.2723 1.2723 1.5567 1.5567 1.8329 1.8329 1.9672 1.9672 2.0979 2.0979 2.2397 2.2397 2.2754 2.2754 2.8783 2.8783 2.8887 2.8887 3.6115 3.6115 3.7018 3.7018 4.0589 4.0589 4.1519 4.1519 5.6553 5.6553 5.8774 5.8774 9.5543 9.5543 10.1486 10.1486 11.2168 11.2168 k = 0.0000 0.1984-0.0000 ( 5020 PWs) bands (ev): -11.3952 -11.3952 -11.2126 -11.2126 -10.7852 -10.7852 -10.5614 -10.5614 -1.5395 -1.5395 -1.1398 -1.1398 -1.0183 -1.0183 -0.9654 -0.9654 0.4452 0.4452 0.5497 0.5497 1.2401 1.2401 1.3132 1.3132 1.5517 1.5517 1.8257 1.8257 1.9690 1.9690 2.1099 2.1099 2.2410 2.2410 2.2774 2.2774 2.8820 2.8820 2.8922 2.8922 3.5951 3.5951 3.6773 3.6773 4.0545 4.0545 4.1554 4.1554 5.6508 5.6508 5.8802 5.8802 9.4866 9.4866 10.1587 10.1587 11.1434 11.1434 k = 0.0000 0.1879-0.0000 ( 5008 PWs) bands (ev): -11.4040 -11.4040 -11.2161 -11.2161 -10.7906 -10.7906 -10.5599 -10.5599 -1.5455 -1.5455 -1.1290 -1.1290 -1.0191 -1.0191 -0.9642 -0.9642 0.4625 0.4625 0.5649 0.5649 1.2807 1.2807 1.3465 1.3465 1.5543 1.5543 1.8188 1.8188 1.9703 1.9703 2.1225 2.1225 2.2424 2.2424 2.2793 2.2793 2.8855 2.8855 2.8956 2.8956 3.5787 3.5787 3.6517 3.6517 4.0509 4.0509 4.1596 4.1596 5.6465 5.6465 5.8829 5.8829 9.4206 9.4206 10.1675 10.1675 11.0694 11.0694 k = 0.0000 0.1775-0.0000 ( 5009 PWs) bands (ev): -11.4126 -11.4126 -11.2197 -11.2197 -10.7958 -10.7958 -10.5585 -10.5585 -1.5514 -1.5514 -1.1187 -1.1187 -1.0198 -1.0198 -0.9629 -0.9629 0.4811 0.4811 0.5797 0.5797 1.3199 1.3199 1.3691 1.3691 1.5685 1.5685 1.8122 1.8122 1.9711 1.9711 2.1358 2.1358 2.2438 2.2438 2.2811 2.2811 2.8887 2.8887 2.8986 2.8986 3.5626 3.5626 3.6250 3.6250 4.0483 4.0483 4.1644 4.1644 5.6423 5.6423 5.8854 5.8854 9.3565 9.3565 10.1750 10.1750 10.9955 10.9955 k = 0.0000 0.1670-0.0000 ( 5011 PWs) bands (ev): -11.4208 -11.4208 -11.2232 -11.2232 -10.8009 -10.8009 -10.5573 -10.5573 -1.5574 -1.5574 -1.1091 -1.1091 -1.0205 -1.0205 -0.9616 -0.9616 0.5008 0.5008 0.5942 0.5942 1.3511 1.3511 1.3860 1.3860 1.5955 1.5955 1.8059 1.8059 1.9716 1.9716 2.1495 2.1495 2.2451 2.2451 2.2828 2.2828 2.8918 2.8918 2.9014 2.9014 3.5465 3.5465 3.5975 3.5975 4.0464 4.0464 4.1697 4.1697 5.6384 5.6384 5.8878 5.8878 9.2946 9.2946 10.1810 10.1810 10.9222 10.9222 k = 0.0000 0.1566-0.0000 ( 5011 PWs) bands (ev): -11.4287 -11.4287 -11.2267 -11.2267 -10.8057 -10.8057 -10.5562 -10.5562 -1.5632 -1.5632 -1.1001 -1.1001 -1.0211 -1.0211 -0.9602 -0.9602 0.5214 0.5214 0.6081 0.6081 1.3580 1.3580 1.4164 1.4164 1.6321 1.6321 1.8001 1.8001 1.9718 1.9718 2.1634 2.1634 2.2465 2.2465 2.2843 2.2843 2.8947 2.8947 2.9038 2.9038 3.5305 3.5305 3.5694 3.5694 4.0453 4.0453 4.1754 4.1754 5.6346 5.6346 5.8900 5.8900 9.2350 9.2350 10.1854 10.1854 10.8504 10.8504 k = 0.0000 0.1462-0.0000 ( 5007 PWs) bands (ev): -11.4363 -11.4363 -11.2301 -11.2301 -10.8104 -10.8104 -10.5552 -10.5552 -1.5689 -1.5689 -1.0918 -1.0918 -1.0216 -1.0216 -0.9589 -0.9589 0.5429 0.5429 0.6214 0.6214 1.3492 1.3492 1.4551 1.4551 1.6742 1.6742 1.7948 1.7948 1.9721 1.9721 2.1774 2.1774 2.2480 2.2480 2.2856 2.2856 2.8973 2.8973 2.9059 2.9059 3.5145 3.5145 3.5410 3.5410 4.0450 4.0450 4.1814 4.1814 5.6311 5.6311 5.8921 5.8921 9.1781 9.1781 10.1881 10.1881 10.7805 10.7805 k = 0.0000 0.1357-0.0000 ( 5021 PWs) bands (ev): -11.4434 -11.4434 -11.2333 -11.2333 -10.8147 -10.8147 -10.5543 -10.5543 -1.5745 -1.5745 -1.0842 -1.0842 -1.0220 -1.0220 -0.9575 -0.9575 0.5652 0.5652 0.6341 0.6341 1.3343 1.3343 1.4950 1.4950 1.7182 1.7182 1.7906 1.7906 1.9723 1.9723 2.1913 2.1913 2.2496 2.2496 2.2867 2.2867 2.8995 2.8995 2.9075 2.9075 3.4980 3.4980 3.5132 3.5132 4.0453 4.0453 4.1878 4.1878 5.6278 5.6278 5.8940 5.8940 9.1239 9.1239 10.1889 10.1889 10.7135 10.7135 k = 0.0000 0.1253-0.0000 ( 5021 PWs) bands (ev): -11.4501 -11.4501 -11.2365 -11.2365 -10.8188 -10.8188 -10.5536 -10.5536 -1.5798 -1.5798 -1.0773 -1.0773 -1.0222 -1.0222 -0.9561 -0.9561 0.5881 0.5881 0.6461 0.6461 1.3162 1.3162 1.5346 1.5346 1.7594 1.7594 1.7904 1.7904 1.9729 1.9729 2.2048 2.2048 2.2515 2.2515 2.2876 2.2876 2.9014 2.9014 2.9087 2.9087 3.4780 3.4780 3.4891 3.4891 4.0462 4.0462 4.1943 4.1943 5.6248 5.6248 5.8959 5.8959 9.0728 9.0728 10.1878 10.1878 10.6499 10.6499 k = 0.0000 0.1148-0.0000 ( 5019 PWs) bands (ev): -11.4564 -11.4564 -11.2395 -11.2395 -10.8227 -10.8227 -10.5529 -10.5529 -1.5849 -1.5849 -1.0712 -1.0712 -1.0224 -1.0224 -0.9547 -0.9547 0.6114 0.6114 0.6573 0.6573 1.2962 1.2962 1.5730 1.5730 1.7749 1.7749 1.8157 1.8157 1.9739 1.9739 2.2174 2.2174 2.2541 2.2541 2.2883 2.2883 2.9029 2.9029 2.9095 2.9095 3.4520 3.4520 3.4717 3.4717 4.0476 4.0476 4.2010 4.2010 5.6220 5.6220 5.8975 5.8975 9.0249 9.0249 10.1847 10.1847 10.5905 10.5905 k = 0.0000 0.1044-0.0000 ( 5023 PWs) bands (ev): -11.4622 -11.4622 -11.2423 -11.2423 -10.8262 -10.8262 -10.5523 -10.5523 -1.5897 -1.5897 -1.0658 -1.0658 -1.0224 -1.0224 -0.9533 -0.9533 0.6349 0.6349 0.6677 0.6677 1.2750 1.2750 1.6097 1.6097 1.7741 1.7741 1.8559 1.8559 1.9761 1.9761 2.2282 2.2282 2.2581 2.2581 2.2887 2.2887 2.9039 2.9039 2.9099 2.9099 3.4248 3.4248 3.4565 3.4565 4.0493 4.0493 4.2075 4.2075 5.6194 5.6194 5.8991 5.8991 8.9804 8.9804 10.1794 10.1794 10.5360 10.5360 k = 0.0000 0.0940-0.0000 ( 5015 PWs) bands (ev): -11.4676 -11.4676 -11.2449 -11.2449 -10.8295 -10.8295 -10.5518 -10.5518 -1.5942 -1.5942 -1.0612 -1.0612 -1.0222 -1.0222 -0.9519 -0.9519 0.6583 0.6583 0.6776 0.6776 1.2531 1.2531 1.6439 1.6439 1.7726 1.7726 1.8937 1.8937 1.9808 1.9808 2.2362 2.2362 2.2645 2.2645 2.2891 2.2891 2.9042 2.9042 2.9101 2.9101 3.3983 3.3983 3.4422 3.4422 4.0514 4.0514 4.2140 4.2140 5.6170 5.6170 5.9005 5.9005 8.9395 8.9395 10.1720 10.1720 10.4873 10.4873 k = 0.0000 0.0835-0.0000 ( 5023 PWs) bands (ev): -11.4724 -11.4724 -11.2472 -11.2472 -10.8324 -10.8324 -10.5514 -10.5514 -1.5983 -1.5983 -1.0573 -1.0573 -1.0220 -1.0220 -0.9506 -0.9506 0.6796 0.6796 0.6884 0.6884 1.2309 1.2309 1.6745 1.6745 1.7724 1.7724 1.9239 1.9239 1.9913 1.9913 2.2408 2.2408 2.2730 2.2730 2.2897 2.2897 2.9036 2.9036 2.9102 2.9102 3.3730 3.3730 3.4287 3.4287 4.0536 4.0536 4.2202 4.2202 5.6149 5.6149 5.9017 5.9017 8.9024 8.9024 10.1622 10.1622 10.4448 10.4448 k = 0.0000 0.0731-0.0000 ( 5023 PWs) bands (ev): -11.4766 -11.4766 -11.2494 -11.2494 -10.8350 -10.8350 -10.5510 -10.5510 -1.6019 -1.6019 -1.0541 -1.0541 -1.0216 -1.0216 -0.9494 -0.9494 0.6914 0.6914 0.7075 0.7075 1.2087 1.2087 1.7000 1.7000 1.7749 1.7749 1.9419 1.9419 2.0115 2.0115 2.2433 2.2433 2.2801 2.2801 2.2927 2.2927 2.9022 2.9022 2.9103 2.9103 3.3495 3.3495 3.4161 3.4161 4.0558 4.0558 4.2261 4.2261 5.6130 5.6130 5.9028 5.9028 8.8692 8.8692 10.1505 10.1505 10.4090 10.4090 k = 0.0000 0.0626-0.0000 ( 5031 PWs) bands (ev): -11.4804 -11.4804 -11.2513 -11.2513 -10.8373 -10.8373 -10.5507 -10.5507 -1.6052 -1.6052 -1.0516 -1.0516 -1.0211 -1.0211 -0.9482 -0.9482 0.6986 0.6986 0.7294 0.7294 1.1872 1.1872 1.7183 1.7183 1.7819 1.7819 1.9502 1.9502 2.0383 2.0383 2.2446 2.2446 2.2821 2.2821 2.3008 2.3008 2.9001 2.9001 2.9103 2.9103 3.3281 3.3281 3.4046 3.4046 4.0580 4.0580 4.2314 4.2314 5.6114 5.6114 5.9037 5.9037 8.8401 8.8401 10.1371 10.1371 10.3799 10.3799 k = 0.0000 0.0522-0.0000 ( 5027 PWs) bands (ev): -11.4836 -11.4836 -11.2529 -11.2529 -10.8393 -10.8393 -10.5505 -10.5505 -1.6080 -1.6080 -1.0496 -1.0496 -1.0205 -1.0205 -0.9472 -0.9472 0.7044 0.7044 0.7505 0.7505 1.1666 1.1666 1.7286 1.7286 1.7936 1.7936 1.9541 1.9541 2.0660 2.0660 2.2453 2.2453 2.2814 2.2814 2.3107 2.3107 2.8976 2.8976 2.9102 2.9102 3.3093 3.3093 3.3943 3.3943 4.0601 4.0601 4.2361 4.2361 5.6100 5.6100 5.9046 5.9046 8.8153 8.8153 10.1231 10.1231 10.3571 10.3571 k = 0.0000 0.0418-0.0000 ( 5031 PWs) bands (ev): -11.4862 -11.4862 -11.2542 -11.2542 -10.8409 -10.8409 -10.5503 -10.5503 -1.6103 -1.6103 -1.0481 -1.0481 -1.0200 -1.0200 -0.9463 -0.9463 0.7091 0.7091 0.7698 0.7698 1.1477 1.1477 1.7334 1.7334 1.8074 1.8074 1.9562 1.9562 2.0914 2.0914 2.2453 2.2453 2.2798 2.2798 2.3202 2.3202 2.8948 2.8948 2.9100 2.9100 3.2934 3.2934 3.3856 3.3856 4.0619 4.0619 4.2402 4.2402 5.6089 5.6089 5.9052 5.9052 8.7948 8.7948 10.1095 10.1095 10.3400 10.3400 k = 0.0000 0.0313-0.0000 ( 5051 PWs) bands (ev): -11.4883 -11.4883 -11.2553 -11.2553 -10.8421 -10.8421 -10.5502 -10.5502 -1.6122 -1.6122 -1.0471 -1.0471 -1.0195 -1.0195 -0.9456 -0.9456 0.7127 0.7127 0.7865 0.7865 1.1313 1.1313 1.7353 1.7353 1.8202 1.8202 1.9575 1.9575 2.1128 2.1128 2.2450 2.2450 2.2778 2.2778 2.3284 2.3284 2.8922 2.8922 2.9097 2.9097 3.2807 3.2807 3.3785 3.3785 4.0634 4.0634 4.2434 4.2434 5.6080 5.6080 5.9057 5.9057 8.7788 8.7788 10.0975 10.0975 10.3277 10.3277 k = 0.0000 0.0209-0.0000 ( 5039 PWs) bands (ev): -11.4897 -11.4897 -11.2560 -11.2560 -10.8430 -10.8430 -10.5500 -10.5500 -1.6135 -1.6135 -1.0463 -1.0463 -1.0191 -1.0191 -0.9451 -0.9451 0.7153 0.7153 0.7997 0.7997 1.1184 1.1184 1.7361 1.7361 1.8301 1.8301 1.9584 1.9584 2.1294 2.1294 2.2445 2.2445 2.2760 2.2760 2.3347 2.3347 2.8900 2.8900 2.9095 2.9095 3.2716 3.2716 3.3733 3.3733 4.0645 4.0645 4.2458 4.2458 5.6074 5.6074 5.9061 5.9061 8.7673 8.7673 10.0882 10.0882 10.3195 10.3195 k = 0.0000 0.0104-0.0000 ( 5041 PWs) bands (ev): -11.4906 -11.4906 -11.2565 -11.2565 -10.8436 -10.8436 -10.5500 -10.5500 -1.6143 -1.6143 -1.0459 -1.0459 -1.0189 -1.0189 -0.9448 -0.9448 0.7168 0.7168 0.8082 0.8082 1.1101 1.1101 1.7363 1.7363 1.8362 1.8362 1.9589 1.9589 2.1399 2.1399 2.2439 2.2439 2.2746 2.2746 2.3386 2.3386 2.8885 2.8885 2.9094 2.9094 3.2660 3.2660 3.3701 3.3701 4.0652 4.0652 4.2472 4.2472 5.6070 5.6070 5.9063 5.9063 8.7604 8.7604 10.0823 10.0823 10.3147 10.3147 k = 0.0000 0.0000 0.0000 ( 5035 PWs) bands (ev): -11.4909 -11.4909 -11.2566 -11.2566 -10.8438 -10.8438 -10.5500 -10.5500 -1.6145 -1.6145 -1.0458 -1.0458 -1.0188 -1.0188 -0.9447 -0.9447 0.7173 0.7173 0.8111 0.8111 1.1072 1.1072 1.7364 1.7364 1.8383 1.8383 1.9590 1.9590 2.1435 2.1435 2.2437 2.2437 2.2741 2.2741 2.3400 2.3400 2.8880 2.8880 2.9093 2.9093 3.2641 3.2641 3.3690 3.3690 4.0655 4.0655 4.2477 4.2477 5.6069 5.6069 5.9064 5.9064 8.7581 8.7581 10.0803 10.0803 10.3132 10.3132 k = 0.0000 0.0000 0.0000 ( 5035 PWs) bands (ev): -11.4909 -11.4909 -11.2566 -11.2566 -10.8438 -10.8438 -10.5500 -10.5500 -1.6145 -1.6145 -1.0458 -1.0458 -1.0188 -1.0188 -0.9447 -0.9447 0.7173 0.7173 0.8111 0.8111 1.1072 1.1072 1.7364 1.7364 1.8383 1.8383 1.9590 1.9590 2.1435 2.1435 2.2437 2.2437 2.2741 2.2741 2.3400 2.3400 2.8880 2.8880 2.9093 2.9093 3.2641 3.2641 3.3690 3.3690 4.0655 4.0655 4.2477 4.2477 5.6069 5.6069 5.9064 5.9064 8.7581 8.7581 10.0803 10.0803 10.3132 10.3132 k = 0.0000 0.0000 0.0101 ( 5039 PWs) bands (ev): -11.4905 -11.4905 -11.2577 -11.2577 -10.8425 -10.8425 -10.5506 -10.5506 -1.6132 -1.6132 -1.0467 -1.0467 -1.0194 -1.0194 -0.9455 -0.9455 0.7166 0.7166 0.8105 0.8105 1.1113 1.1113 1.7371 1.7371 1.8394 1.8394 1.9583 1.9583 2.1415 2.1415 2.2426 2.2426 2.2744 2.2744 2.3392 2.3392 2.8881 2.8881 2.9093 2.9093 3.2644 3.2644 3.3687 3.3687 4.0661 4.0661 4.2473 4.2473 5.6077 5.6077 5.9056 5.9056 8.7612 8.7612 10.0822 10.0822 10.3027 10.3027 k = 0.0000 0.0000 0.0203 ( 5035 PWs) bands (ev): -11.4891 -11.4891 -11.2609 -11.2609 -10.8388 -10.8388 -10.5524 -10.5524 -1.6093 -1.6093 -1.0497 -1.0497 -1.0208 -1.0208 -0.9475 -0.9475 0.7146 0.7146 0.8086 0.8086 1.1235 1.1235 1.7392 1.7392 1.8426 1.8426 1.9560 1.9560 2.1353 2.1353 2.2396 2.2396 2.2754 2.2754 2.3369 2.3369 2.8884 2.8884 2.9092 2.9092 3.2653 3.2653 3.3679 3.3679 4.0678 4.0678 4.2461 4.2461 5.6102 5.6102 5.9032 5.9032 8.7704 8.7704 10.0878 10.0878 10.2734 10.2734 k = 0.0000 0.0000 0.0304 ( 5031 PWs) bands (ev): -11.4869 -11.4869 -11.2661 -11.2661 -10.8329 -10.8329 -10.5555 -10.5555 -1.6027 -1.6027 -1.0557 -1.0557 -1.0222 -1.0222 -0.9507 -0.9507 0.7118 0.7118 0.8056 0.8056 1.1431 1.1431 1.7426 1.7426 1.8479 1.8479 1.9521 1.9521 2.1252 2.1252 2.2346 2.2346 2.2767 2.2767 2.3335 2.3335 2.8890 2.8890 2.9091 2.9091 3.2668 3.2668 3.3665 3.3665 4.0707 4.0707 4.2440 4.2440 5.6144 5.6144 5.8992 5.8992 8.7856 8.7856 10.0971 10.0971 10.2297 10.2297 k = 0.0000 0.0000 0.0405 ( 5029 PWs) bands (ev): -11.4838 -11.4838 -11.2730 -11.2730 -10.8248 -10.8248 -10.5597 -10.5597 -1.5936 -1.5936 -1.0656 -1.0656 -1.0230 -1.0230 -0.9545 -0.9545 0.7085 0.7085 0.8015 0.8015 1.1694 1.1694 1.7473 1.7473 1.8552 1.8552 1.9468 1.9468 2.1111 2.1111 2.2276 2.2276 2.2782 2.2782 2.3292 2.3292 2.8896 2.8896 2.9089 2.9089 3.2688 3.2688 3.3646 3.3646 4.0747 4.0747 4.2412 4.2412 5.6201 5.6201 5.8937 5.8937 8.8069 8.8069 10.1096 10.1096 10.1760 10.1760 k = 0.0000 0.0000 0.0507 ( 5017 PWs) bands (ev): -11.4798 -11.4798 -11.2815 -11.2815 -10.8150 -10.8150 -10.5651 -10.5651 -1.5819 -1.5819 -1.0798 -1.0798 -1.0229 -1.0229 -0.9586 -0.9586 0.7054 0.7054 0.7964 0.7964 1.2013 1.2013 1.7533 1.7533 1.8643 1.8643 1.9398 1.9398 2.0933 2.0933 2.2186 2.2186 2.2798 2.2798 2.3246 2.3246 2.8905 2.8905 2.9087 2.9087 3.2714 3.2714 3.3621 3.3621 4.0798 4.0798 4.2376 4.2376 5.6275 5.6275 5.8868 5.8868 8.8339 8.8339 10.1091 10.1091 10.1312 10.1312 k = 0.0000 0.0000 0.0608 ( 5007 PWs) bands (ev): -11.4750 -11.4750 -11.2912 -11.2912 -10.8036 -10.8036 -10.5717 -10.5717 -1.5678 -1.5678 -1.0978 -1.0978 -1.0220 -1.0220 -0.9627 -0.9627 0.7027 0.7027 0.7905 0.7905 1.2382 1.2382 1.7603 1.7603 1.8751 1.8751 1.9311 1.9311 2.0722 2.0722 2.2075 2.2075 2.2814 2.2814 2.3200 2.3200 2.8915 2.8915 2.9084 2.9084 3.2745 3.2745 3.3592 3.3592 4.0858 4.0858 4.2331 4.2331 5.6362 5.6362 5.8784 5.8784 8.8666 8.8666 10.0452 10.0452 10.1480 10.1480 k = 0.0000 0.0000 0.0709 ( 5005 PWs) bands (ev): -11.4693 -11.4693 -11.3018 -11.3018 -10.7910 -10.7910 -10.5793 -10.5793 -1.5514 -1.5514 -1.1193 -1.1193 -1.0205 -1.0205 -0.9668 -0.9668 0.7009 0.7009 0.7839 0.7839 1.2791 1.2791 1.7685 1.7685 1.8870 1.8870 1.9208 1.9208 2.0482 2.0482 2.1944 2.1944 2.2829 2.2829 2.3157 2.3157 2.8926 2.8926 2.9080 2.9080 3.2781 3.2781 3.3558 3.3558 4.0926 4.0926 4.2280 4.2280 5.6462 5.6462 5.8687 5.8687 8.9048 8.9048 9.9744 9.9744 10.1708 10.1708 k = 0.0000 0.0000 0.0811 ( 5005 PWs) bands (ev): -11.4629 -11.4629 -11.3132 -11.3132 -10.7775 -10.7775 -10.5880 -10.5880 -1.5326 -1.5326 -1.1436 -1.1436 -1.0186 -1.0186 -0.9708 -0.9708 0.7001 0.7001 0.7768 0.7768 1.3233 1.3233 1.7776 1.7776 1.8973 1.8973 1.9105 1.9105 2.0226 2.0226 2.1794 2.1794 2.2844 2.2844 2.3118 2.3118 2.8937 2.8937 2.9075 2.9075 3.2820 3.2820 3.3520 3.3520 4.1003 4.1003 4.2221 4.2221 5.6575 5.6575 5.8578 5.8578 8.9481 8.9481 9.9006 9.9006 10.1967 10.1967 k = 0.0000 0.0000 0.0912 ( 5007 PWs) bands (ev): -11.4556 -11.4556 -11.3251 -11.3251 -10.7632 -10.7632 -10.5977 -10.5977 -1.5118 -1.5118 -1.1703 -1.1703 -1.0163 -1.0163 -0.9747 -0.9747 0.7004 0.7004 0.7692 0.7692 1.3701 1.3701 1.7875 1.7875 1.8878 1.8878 1.9164 1.9164 1.9975 1.9975 2.1628 2.1628 2.2858 2.2858 2.3084 2.3084 2.8949 2.8949 2.9069 2.9069 3.2864 3.2864 3.3478 3.3478 4.1085 4.1085 4.2155 4.2155 5.6699 5.6699 5.8458 5.8458 8.9963 8.9963 9.8248 9.8248 10.2254 10.2254 k = 0.0000 0.0000 0.1013 ( 5001 PWs) bands (ev): -11.4476 -11.4476 -11.3373 -11.3373 -10.7484 -10.7484 -10.6084 -10.6084 -1.4890 -1.4890 -1.1987 -1.1987 -1.0136 -1.0136 -0.9786 -0.9786 0.7019 0.7019 0.7614 0.7614 1.4188 1.4188 1.7981 1.7981 1.8668 1.8668 1.9250 1.9250 1.9784 1.9784 2.1449 2.1449 2.2873 2.2873 2.3055 2.3055 2.8961 2.8961 2.9063 2.9063 3.2910 3.2910 3.3433 3.3433 4.1173 4.1173 4.2083 4.2083 5.6832 5.6832 5.8328 5.8328 9.0491 9.0491 9.7480 9.7480 10.2565 10.2565 k = 0.0000 0.0000 0.1115 ( 4991 PWs) bands (ev): -11.4389 -11.4389 -11.3497 -11.3497 -10.7333 -10.7333 -10.6199 -10.6199 -1.4643 -1.4643 -1.2284 -1.2284 -1.0107 -1.0107 -0.9825 -0.9825 0.7044 0.7044 0.7536 0.7536 1.4689 1.4689 1.8089 1.8089 1.8394 1.8394 1.9215 1.9215 1.9757 1.9757 2.1259 2.1259 2.2887 2.2887 2.3029 2.3029 2.8973 2.8973 2.9056 2.9056 3.2960 3.2960 3.3384 3.3384 4.1265 4.1265 4.2005 4.2005 5.6974 5.6974 5.8190 5.8190 9.1062 9.1062 9.6708 9.6708 10.2896 10.2896 k = 0.0000 0.0000 0.1216 ( 4983 PWs) bands (ev): -11.4294 -11.4294 -11.3620 -11.3620 -10.7180 -10.7180 -10.6322 -10.6322 -1.4380 -1.4380 -1.2590 -1.2590 -1.0076 -1.0076 -0.9863 -0.9863 0.7080 0.7080 0.7457 0.7457 1.5197 1.5197 1.8014 1.8014 1.8242 1.8242 1.9076 1.9076 1.9877 1.9877 2.1061 2.1061 2.2902 2.2902 2.3006 2.3006 2.8986 2.8986 2.9048 2.9048 3.3012 3.3012 3.3334 3.3334 4.1360 4.1360 4.1922 4.1922 5.7121 5.7121 5.8045 5.8045 9.1672 9.1672 9.5938 9.5938 10.3243 10.3243 k = 0.0000 0.0000 0.1317 ( 4983 PWs) bands (ev): -11.4194 -11.4194 -11.3742 -11.3742 -10.7029 -10.7029 -10.6453 -10.6453 -1.4103 -1.4103 -1.2899 -1.2899 -1.0044 -1.0044 -0.9900 -0.9900 0.7125 0.7125 0.7381 0.7381 1.5706 1.5706 1.7622 1.7622 1.8356 1.8356 1.8920 1.8920 2.0051 2.0051 2.0857 2.0857 2.2917 2.2917 2.2985 2.2985 2.8997 2.8997 2.9039 2.9039 3.3065 3.3065 3.3282 3.3282 4.1456 4.1456 4.1835 4.1835 5.7273 5.7273 5.7895 5.7895 9.2318 9.2318 9.5177 9.5177 10.3601 10.3601 k = 0.0000 0.0000 0.1419 ( 4983 PWs) bands (ev): -11.4088 -11.4088 -11.3861 -11.3861 -10.6879 -10.6879 -10.6590 -10.6590 -1.3813 -1.3813 -1.3208 -1.3208 -1.0009 -1.0009 -0.9937 -0.9937 0.7179 0.7179 0.7309 0.7309 1.6211 1.6211 1.7178 1.7178 1.8487 1.8487 1.8769 1.8769 2.0244 2.0244 2.0652 2.0652 2.2933 2.2933 2.2966 2.2966 2.9009 2.9009 2.9030 2.9030 3.3119 3.3119 3.3228 3.3228 4.1553 4.1553 4.1743 4.1743 5.7428 5.7428 5.7741 5.7741 9.2996 9.2996 9.4430 9.4430 10.3965 10.3965 k = 0.0000 0.0000 0.1520 ( 4972 PWs) bands (ev): -11.3977 -11.3977 -11.3976 -11.3976 -10.6732 -10.6732 -10.6732 -10.6732 -1.3514 -1.3514 -1.3514 -1.3514 -0.9974 -0.9974 -0.9973 -0.9973 0.7241 0.7241 0.7241 0.7241 1.6704 1.6704 1.6704 1.6704 1.8624 1.8624 1.8625 1.8625 2.0446 2.0446 2.0446 2.0446 2.2949 2.2949 2.2950 2.2950 2.9019 2.9019 2.9020 2.9020 3.3173 3.3173 3.3174 3.3174 4.1649 4.1649 4.1649 4.1649 5.7584 5.7584 5.7585 5.7585 9.3701 9.3701 9.3701 9.3701 10.4330 10.4330 k = 0.0000 0.0000 0.1520 ( 4972 PWs) bands (ev): -11.3977 -11.3977 -11.3976 -11.3976 -10.6732 -10.6732 -10.6732 -10.6732 -1.3514 -1.3514 -1.3514 -1.3514 -0.9974 -0.9974 -0.9973 -0.9973 0.7241 0.7241 0.7241 0.7241 1.6704 1.6704 1.6704 1.6704 1.8624 1.8624 1.8625 1.8625 2.0446 2.0446 2.0446 2.0446 2.2949 2.2949 2.2950 2.2950 2.9019 2.9019 2.9020 2.9020 3.3173 3.3173 3.3174 3.3174 4.1649 4.1649 4.1649 4.1649 5.7584 5.7584 5.7585 5.7585 9.3701 9.3701 9.3701 9.3701 10.4330 10.4330 k = 0.0106-0.0000 0.1520 ( 4978 PWs) bands (ev): -11.3971 -11.3971 -11.3970 -11.3970 -10.6733 -10.6733 -10.6732 -10.6732 -1.3515 -1.3515 -1.3496 -1.3496 -0.9985 -0.9985 -0.9959 -0.9959 0.7249 0.7249 0.7252 0.7252 1.6689 1.6689 1.6700 1.6700 1.8461 1.8461 1.8489 1.8489 2.0413 2.0413 2.0447 2.0447 2.3070 2.3070 2.3091 2.3091 2.8996 2.8996 2.9078 2.9078 3.3159 3.3159 3.3195 3.3195 4.1633 4.1633 4.1645 4.1645 5.7551 5.7551 5.7552 5.7552 9.3737 9.3737 9.3738 9.3738 10.4352 10.4352 k = 0.0213-0.0000 0.1520 ( 4982 PWs) bands (ev): -11.3951 -11.3951 -11.3950 -11.3950 -10.6733 -10.6733 -10.6731 -10.6731 -1.3499 -1.3499 -1.3460 -1.3460 -0.9994 -0.9994 -0.9942 -0.9942 0.7275 0.7275 0.7281 0.7281 1.6636 1.6636 1.6666 1.6666 1.8073 1.8073 1.8096 1.8096 2.0369 2.0369 2.0399 2.0399 2.3413 2.3413 2.3439 2.3439 2.9007 2.9007 2.9171 2.9171 3.3151 3.3151 3.3225 3.3225 4.1598 4.1598 4.1623 4.1623 5.7453 5.7453 5.7454 5.7454 9.3843 9.3843 9.3846 9.3846 10.4422 10.4422 k = 0.0319-0.0000 0.1520 ( 4990 PWs) bands (ev): -11.3919 -11.3919 -11.3917 -11.3917 -10.6734 -10.6734 -10.6731 -10.6731 -1.3466 -1.3466 -1.3408 -1.3408 -0.9998 -0.9998 -0.9920 -0.9920 0.7320 0.7320 0.7329 0.7329 1.6474 1.6474 1.6547 1.6547 1.7596 1.7596 1.7618 1.7618 2.0310 2.0310 2.0312 2.0312 2.3885 2.3885 2.3905 2.3905 2.9051 2.9051 2.9297 2.9297 3.3150 3.3150 3.3263 3.3263 4.1544 4.1544 4.1581 4.1581 5.7292 5.7292 5.7293 5.7293 9.4019 9.4019 9.4024 9.4024 10.4539 10.4539 k = 0.0426-0.0000 0.1520 ( 4988 PWs) bands (ev): -11.3874 -11.3874 -11.3871 -11.3871 -10.6735 -10.6735 -10.6730 -10.6730 -1.3417 -1.3417 -1.3340 -1.3340 -0.9997 -0.9997 -0.9892 -0.9892 0.7383 0.7383 0.7395 0.7395 1.6058 1.6058 1.6171 1.6171 1.7231 1.7231 1.7302 1.7302 2.0194 2.0194 2.0234 2.0234 2.4414 2.4414 2.4424 2.4424 2.9127 2.9127 2.9452 2.9452 3.3156 3.3156 3.3309 3.3309 4.1470 4.1470 4.1520 4.1520 5.7073 5.7073 5.7076 5.7076 9.4262 9.4262 9.4268 9.4268 10.4700 10.4700 k = 0.0532-0.0000 0.1520 ( 4998 PWs) bands (ev): -11.3817 -11.3817 -11.3813 -11.3813 -10.6736 -10.6736 -10.6730 -10.6730 -1.3355 -1.3355 -1.3258 -1.3258 -0.9988 -0.9988 -0.9857 -0.9857 0.7464 0.7464 0.7479 0.7479 1.5374 1.5374 1.5486 1.5486 1.7098 1.7098 1.7175 1.7175 2.0060 2.0060 2.0135 2.0135 2.4955 2.4955 2.4959 2.4959 2.9231 2.9231 2.9635 2.9635 3.3168 3.3168 3.3364 3.3364 4.1377 4.1377 4.1441 4.1441 5.6803 5.6803 5.6806 5.6806 9.4568 9.4568 9.4576 9.4576 10.4906 10.4906 k = 0.0638-0.0000 0.1520 ( 4998 PWs) bands (ev): -11.3747 -11.3747 -11.3741 -11.3741 -10.6737 -10.6737 -10.6730 -10.6730 -1.3280 -1.3280 -1.3164 -1.3164 -0.9969 -0.9969 -0.9812 -0.9812 0.7562 0.7562 0.7581 0.7581 1.4545 1.4545 1.4647 1.4647 1.7061 1.7061 1.7131 1.7131 1.9913 1.9913 2.0018 2.0018 2.5480 2.5480 2.5496 2.5496 2.9360 2.9360 2.9841 2.9841 3.3187 3.3187 3.3429 3.3429 4.1265 4.1265 4.1343 4.1343 5.6488 5.6488 5.6493 5.6493 9.4933 9.4933 9.4942 9.4942 10.5153 10.5153 k = 0.0745-0.0000 0.1520 ( 4998 PWs) bands (ev): -11.3664 -11.3664 -11.3658 -11.3658 -10.6737 -10.6737 -10.6730 -10.6730 -1.3196 -1.3196 -1.3059 -1.3059 -0.9936 -0.9936 -0.9753 -0.9753 0.7677 0.7677 0.7700 0.7700 1.3641 1.3641 1.3735 1.3735 1.7048 1.7048 1.7110 1.7110 1.9761 1.9761 1.9886 1.9886 2.5985 2.5985 2.6014 2.6014 2.9508 2.9508 3.0067 3.0067 3.3213 3.3213 3.3503 3.3503 4.1134 4.1134 4.1227 4.1227 5.6137 5.6137 5.6144 5.6144 9.5350 9.5350 9.5362 9.5362 10.5439 10.5439 k = 0.0851-0.0000 0.1520 ( 4998 PWs) bands (ev): -11.3569 -11.3569 -11.3563 -11.3563 -10.6738 -10.6738 -10.6730 -10.6730 -1.3103 -1.3103 -1.2948 -1.2948 -0.9884 -0.9884 -0.9678 -0.9678 0.7808 0.7808 0.7836 0.7836 1.2691 1.2691 1.2781 1.2781 1.7037 1.7037 1.7086 1.7086 1.9609 1.9609 1.9745 1.9745 2.6463 2.6463 2.6504 2.6504 2.9673 2.9673 3.0309 3.0309 3.3245 3.3245 3.3588 3.3588 4.0985 4.0985 4.1092 4.1092 5.5760 5.5760 5.5768 5.5768 9.5815 9.5815 9.5829 9.5829 10.5762 10.5762 k = 0.0957-0.0000 0.1520 ( 5014 PWs) bands (ev): -11.3463 -11.3463 -11.3456 -11.3456 -10.6740 -10.6740 -10.6730 -10.6730 -1.3006 -1.3006 -1.2833 -1.2833 -0.9811 -0.9811 -0.9582 -0.9582 0.7951 0.7951 0.7987 0.7987 1.1709 1.1709 1.1800 1.1800 1.7013 1.7013 1.7047 1.7047 1.9461 1.9461 1.9600 1.9600 2.6909 2.6909 2.6964 2.6964 2.9847 2.9847 3.0560 3.0560 3.3286 3.3286 3.3684 3.3684 4.0816 4.0816 4.0940 4.0940 5.5365 5.5365 5.5375 5.5375 9.6322 9.6322 9.6338 9.6338 10.6120 10.6120 k = 0.1064-0.0000 0.1520 ( 5010 PWs) bands (ev): -11.3345 -11.3345 -11.3337 -11.3337 -10.6741 -10.6741 -10.6730 -10.6730 -1.2906 -1.2906 -1.2718 -1.2718 -0.9710 -0.9710 -0.9461 -0.9461 0.8100 0.8100 0.8151 0.8151 1.0706 1.0706 1.0807 1.0807 1.6969 1.6969 1.6984 1.6984 1.9322 1.9322 1.9455 1.9455 2.7323 2.7323 2.7392 2.7392 3.0029 3.0029 3.0815 3.0815 3.3338 3.3338 3.3791 3.3791 4.0629 4.0629 4.0770 4.0770 5.4962 5.4962 5.4976 5.4976 9.6863 9.6863 9.6882 9.6882 10.6509 10.6509 k = 0.1170-0.0000 0.1520 ( 5014 PWs) bands (ev): -11.3217 -11.3217 -11.3207 -11.3207 -10.6742 -10.6742 -10.6730 -10.6730 -1.2806 -1.2806 -1.2606 -1.2606 -0.9577 -0.9577 -0.9314 -0.9314 0.8231 0.8231 0.8314 0.8314 0.9702 0.9702 0.9831 0.9831 1.6890 1.6890 1.6898 1.6898 1.9194 1.9194 1.9313 1.9313 2.7704 2.7704 2.7787 2.7787 3.0211 3.0211 3.1068 3.1068 3.3403 3.3403 3.3909 3.3909 4.0424 4.0424 4.0583 4.0583 5.4561 5.4561 5.4578 5.4578 9.7434 9.7434 9.7454 9.7454 10.6921 10.6921 k = 0.1277-0.0000 0.1520 ( 5020 PWs) bands (ev): -11.3077 -11.3077 -11.3067 -11.3067 -10.6744 -10.6744 -10.6731 -10.6731 -1.2708 -1.2708 -1.2500 -1.2500 -0.9410 -0.9410 -0.9135 -0.9135 0.8169 0.8169 0.8321 0.8321 0.8856 0.8856 0.9051 0.9051 1.6763 1.6763 1.6797 1.6797 1.9074 1.9074 1.9174 1.9174 2.8051 2.8051 2.8150 2.8150 3.0391 3.0391 3.1309 3.1309 3.3486 3.3486 3.4039 3.4039 4.0202 4.0202 4.0380 4.0380 5.4170 5.4170 5.4192 5.4192 9.8026 9.8026 9.8047 9.8047 10.7358 10.7358 k = 0.1383-0.0000 0.1520 ( 5022 PWs) bands (ev): -11.2928 -11.2928 -11.2917 -11.2917 -10.6745 -10.6745 -10.6732 -10.6732 -1.2612 -1.2612 -1.2400 -1.2400 -0.9206 -0.9206 -0.8925 -0.8925 0.7452 0.7452 0.7495 0.7495 0.8849 0.8849 0.8933 0.8933 1.6604 1.6604 1.6666 1.6666 1.8958 1.8958 1.9035 1.9035 2.8367 2.8367 2.8483 2.8483 3.0564 3.0564 3.1529 3.1529 3.3593 3.3593 3.4181 3.4181 3.9963 3.9963 4.0162 4.0162 5.3799 5.3799 5.3825 5.3825 9.8633 9.8633 9.8656 9.8656 10.7818 10.7818 k = 0.1489-0.0000 0.1520 ( 5022 PWs) bands (ev): -11.2769 -11.2769 -11.2757 -11.2757 -10.6747 -10.6747 -10.6733 -10.6733 -1.2519 -1.2519 -1.2307 -1.2307 -0.8964 -0.8964 -0.8681 -0.8681 0.6460 0.6460 0.6463 0.6463 0.9058 0.9058 0.9101 0.9101 1.6418 1.6418 1.6504 1.6504 1.8838 1.8838 1.8892 1.8892 2.8652 2.8652 2.8787 2.8787 3.0726 3.0726 3.1719 3.1719 3.3729 3.3729 3.4334 3.4334 3.9709 3.9709 3.9929 3.9929 5.3456 5.3456 5.3487 5.3487 9.9249 9.9249 9.9271 9.9271 10.8299 10.8299 k = 0.1596-0.0000 0.1520 ( 5014 PWs) bands (ev): -11.2600 -11.2600 -11.2588 -11.2588 -10.6749 -10.6749 -10.6734 -10.6734 -1.2427 -1.2427 -1.2219 -1.2219 -0.8684 -0.8684 -0.8403 -0.8403 0.5409 0.5409 0.5421 0.5421 0.9300 0.9300 0.9328 0.9328 1.6207 1.6207 1.6317 1.6317 1.8705 1.8705 1.8737 1.8737 2.8909 2.8909 2.9065 2.9065 3.0877 3.0877 3.1872 3.1872 3.3898 3.3898 3.4498 3.4498 3.9439 3.9439 3.9683 3.9683 5.3147 5.3147 5.3184 5.3184 9.9866 9.9866 9.9887 9.9887 10.8798 10.8798 k = 0.1702-0.0000 0.1520 ( 5020 PWs) bands (ev): -11.2424 -11.2424 -11.2411 -11.2411 -10.6751 -10.6751 -10.6735 -10.6735 -1.2337 -1.2337 -1.2135 -1.2135 -0.8368 -0.8368 -0.8092 -0.8092 0.4352 0.4352 0.4372 0.4372 0.9562 0.9562 0.9582 0.9582 1.5979 1.5979 1.6108 1.6108 1.8550 1.8550 1.8562 1.8562 2.9138 2.9138 2.9318 2.9318 3.1013 3.1013 3.1985 3.1985 3.4101 3.4101 3.4670 3.4670 3.9155 3.9155 3.9424 3.9424 5.2878 5.2878 5.2922 5.2922 10.0476 10.0476 10.0496 10.0496 10.9315 10.9315 k = 0.1809-0.0000 0.1520 ( 5024 PWs) bands (ev): -11.2239 -11.2239 -11.2225 -11.2225 -10.6754 -10.6754 -10.6737 -10.6737 -1.2245 -1.2245 -1.2051 -1.2051 -0.8018 -0.8018 -0.7750 -0.7750 0.3297 0.3297 0.3321 0.3321 0.9839 0.9839 0.9856 0.9856 1.5736 1.5736 1.5882 1.5882 1.8359 1.8359 1.8366 1.8366 2.9343 2.9343 2.9549 2.9549 3.1134 3.1134 3.2059 3.2059 3.4333 3.4333 3.4850 3.4850 3.8858 3.8858 3.9156 3.9156 5.2655 5.2655 5.2707 5.2707 10.1073 10.1073 10.1090 10.1090 10.9846 10.9846 k = 0.1915-0.0000 0.1520 ( 5018 PWs) bands (ev): -11.2048 -11.2048 -11.2033 -11.2033 -10.6757 -10.6757 -10.6739 -10.6739 -1.2150 -1.2150 -1.1965 -1.1965 -0.7637 -0.7637 -0.7379 -0.7379 0.2247 0.2247 0.2274 0.2274 1.0131 1.0131 1.0146 1.0146 1.5483 1.5483 1.5642 1.5642 1.8124 1.8124 1.8146 1.8146 2.9523 2.9523 2.9759 2.9759 3.1240 3.1240 3.2100 3.2100 3.4590 3.4590 3.5033 3.5033 3.8549 3.8549 3.8880 3.8880 5.2480 5.2480 5.2540 5.2540 10.1650 10.1650 10.1662 10.1662 11.0391 11.0391 k = 0.2021-0.0000 0.1520 ( 5014 PWs) bands (ev): -11.1849 -11.1849 -11.1834 -11.1834 -10.6759 -10.6759 -10.6741 -10.6741 -1.2050 -1.2050 -1.1874 -1.1874 -0.7227 -0.7227 -0.6980 -0.6980 0.1206 0.1206 0.1237 0.1237 1.0435 1.0435 1.0451 1.0451 1.5224 1.5224 1.5392 1.5392 1.7849 1.7849 1.7885 1.7885 2.9681 2.9681 2.9950 2.9950 3.1333 3.1333 3.2112 3.2112 3.4863 3.4863 3.5217 3.5217 3.8229 3.8229 3.8599 3.8599 5.2357 5.2357 5.2426 5.2426 10.2198 10.2198 10.2204 10.2204 11.0947 11.0947 k = 0.2128-0.0000 0.1520 ( 5024 PWs) bands (ev): -11.1645 -11.1645 -11.1630 -11.1630 -10.6763 -10.6763 -10.6743 -10.6743 -1.1942 -1.1942 -1.1775 -1.1775 -0.6792 -0.6792 -0.6557 -0.6557 0.0178 0.0178 0.0213 0.0213 1.0752 1.0752 1.0768 1.0768 1.4960 1.4960 1.5135 1.5135 1.7532 1.7532 1.7581 1.7581 2.9816 2.9816 3.0122 3.0122 3.1413 3.1413 3.2100 3.2100 3.5148 3.5148 3.5395 3.5395 3.7899 3.7899 3.8320 3.8320 5.2287 5.2287 5.2364 5.2364 10.2710 10.2710 10.2711 10.2711 11.1514 11.1514 k = 0.2234-0.0000 0.1520 ( 5022 PWs) bands (ev): -11.1437 -11.1437 -11.1420 -11.1420 -10.6766 -10.6766 -10.6746 -10.6746 -1.1825 -1.1825 -1.1667 -1.1667 -0.6336 -0.6336 -0.6114 -0.6114 -0.0833 -0.0833 -0.0792 -0.0792 1.1080 1.1080 1.1097 1.1097 1.4694 1.4694 1.4874 1.4874 1.7173 1.7173 1.7233 1.7233 2.9928 2.9928 3.0275 3.0275 3.1482 3.1482 3.2071 3.2071 3.5439 3.5439 3.5557 3.5557 3.7561 3.7561 3.8051 3.8051 5.2268 5.2268 5.2355 5.2355 10.3174 10.3174 10.3182 10.3182 11.2088 11.2088 k = 0.2340-0.0000 0.1520 ( 5026 PWs) bands (ev): -11.1224 -11.1224 -11.1207 -11.1207 -10.6769 -10.6769 -10.6749 -10.6749 -1.1697 -1.1697 -1.1546 -1.1546 -0.5864 -0.5864 -0.5659 -0.5659 -0.1821 -0.1821 -0.1772 -0.1772 1.1415 1.1415 1.1435 1.1435 1.4427 1.4427 1.4610 1.4610 1.6773 1.6773 1.6842 1.6842 3.0015 3.0015 3.0406 3.0406 3.1542 3.1542 3.2027 3.2027 3.5688 3.5688 3.5730 3.5730 3.7218 3.7218 3.7808 3.7808 5.2302 5.2302 5.2397 5.2397 10.3588 10.3588 10.3604 10.3604 11.2669 11.2669 k = 0.2447-0.0000 0.1520 ( 5026 PWs) bands (ev): -11.1008 -11.1008 -11.0990 -11.0990 -10.6773 -10.6773 -10.6752 -10.6752 -1.1556 -1.1556 -1.1412 -1.1412 -0.5390 -0.5390 -0.5212 -0.5212 -0.2773 -0.2773 -0.2704 -0.2704 1.1754 1.1754 1.1778 1.1778 1.4164 1.4164 1.4344 1.4344 1.6335 1.6335 1.6412 1.6412 3.0078 3.0078 3.0514 3.0514 3.1595 3.1595 3.1975 3.1975 3.5763 3.5763 3.6013 3.6013 3.6877 3.6877 3.7616 3.7616 5.2385 5.2385 5.2488 5.2488 10.3949 10.3949 10.3973 10.3973 11.3252 11.3252 k = 0.2553-0.0000 0.1520 ( 5028 PWs) bands (ev): -11.0789 -11.0789 -11.0771 -11.0771 -10.6777 -10.6777 -10.6756 -10.6756 -1.1401 -1.1401 -1.1262 -1.1262 -0.4974 -0.4974 -0.4862 -0.4862 -0.3628 -0.3628 -0.3499 -0.3499 1.2086 1.2086 1.2119 1.2119 1.3907 1.3907 1.4078 1.4078 1.5870 1.5870 1.5952 1.5952 3.0112 3.0112 3.0591 3.0591 3.1642 3.1642 3.1920 3.1920 3.5753 3.5753 3.6230 3.6230 3.6595 3.6595 3.7504 3.7504 5.2515 5.2515 5.2626 5.2626 10.4251 10.4251 10.4284 10.4284 11.3835 11.3835 k = 0.2660-0.0000 0.1520 ( 5012 PWs) bands (ev): -11.0569 -11.0569 -11.0550 -11.0550 -10.6782 -10.6782 -10.6760 -10.6760 -1.1232 -1.1232 -1.1097 -1.1097 -0.5050 -0.5050 -0.5048 -0.5048 -0.3953 -0.3953 -0.3715 -0.3715 1.2387 1.2387 1.2440 1.2440 1.3671 1.3671 1.3817 1.3817 1.5394 1.5394 1.5476 1.5476 3.0118 3.0118 3.0632 3.0632 3.1683 3.1683 3.1867 3.1867 3.5642 3.5642 3.6069 3.6069 3.6687 3.6687 3.7490 3.7490 5.2688 5.2688 5.2806 5.2806 10.4494 10.4494 10.4535 10.4535 11.4412 11.4412 k = 0.2766-0.0000 0.1520 ( 5008 PWs) bands (ev): -11.0349 -11.0349 -11.0329 -11.0329 -10.6786 -10.6786 -10.6764 -10.6764 -1.1048 -1.1048 -1.0916 -1.0916 -0.5788 -0.5788 -0.5785 -0.5785 -0.3572 -0.3572 -0.3343 -0.3343 1.2585 1.2585 1.2685 1.2685 1.3502 1.3502 1.3582 1.3582 1.4945 1.4945 1.5015 1.5015 3.0094 3.0094 3.0630 3.0630 3.1714 3.1714 3.1821 3.1821 3.5445 3.5445 3.5734 3.5734 3.6949 3.6949 3.7562 3.7562 5.2901 5.2901 5.3025 5.3025 10.4676 10.4676 10.4724 10.4724 11.4977 11.4977 k = 0.2872-0.0000 0.1520 ( 5012 PWs) bands (ev): -11.0129 -11.0129 -11.0109 -11.0109 -10.6791 -10.6791 -10.6769 -10.6769 -1.0853 -1.0853 -1.0720 -1.0720 -0.6626 -0.6626 -0.6608 -0.6608 -0.3052 -0.3052 -0.2839 -0.2839 1.2545 1.2545 1.2705 1.2705 1.3443 1.3443 1.3464 1.3464 1.4609 1.4609 1.4645 1.4645 3.0039 3.0039 3.0580 3.0580 3.1732 3.1732 3.1779 3.1779 3.5195 3.5195 3.5388 3.5388 3.7222 3.7222 3.7691 3.7691 5.3148 5.3148 5.3278 5.3278 10.4798 10.4798 10.4852 10.4852 11.5522 11.5522 k = 0.2979-0.0000 0.1520 ( 5002 PWs) bands (ev): -10.9910 -10.9910 -10.9890 -10.9890 -10.6797 -10.6797 -10.6774 -10.6774 -1.0650 -1.0650 -1.0511 -1.0511 -0.7452 -0.7452 -0.7417 -0.7417 -0.2500 -0.2500 -0.2297 -0.2297 1.2265 1.2265 1.2413 1.2413 1.3341 1.3341 1.3399 1.3399 1.4530 1.4530 1.4536 1.4536 2.9955 2.9955 3.0484 3.0484 3.1729 3.1729 3.1736 3.1736 3.4924 3.4924 3.5053 3.5053 3.7494 3.7494 3.7853 3.7853 5.3426 5.3426 5.3560 5.3560 10.4864 10.4864 10.4922 10.4922 11.6038 11.6038 k = 0.3085-0.0000 0.1520 ( 5000 PWs) bands (ev): -10.9693 -10.9693 -10.9673 -10.9673 -10.6802 -10.6802 -10.6779 -10.6779 -1.0456 -1.0456 -1.0303 -1.0303 -0.8234 -0.8234 -0.8177 -0.8177 -0.1935 -0.1935 -0.1741 -0.1741 1.1836 1.1836 1.1933 1.1933 1.3140 1.3140 1.3169 1.3169 1.4723 1.4723 1.4744 1.4744 2.9843 2.9843 3.0345 3.0345 3.1674 3.1674 3.1693 3.1693 3.4656 3.4656 3.4741 3.4741 3.7759 3.7759 3.8033 3.8033 5.3729 5.3729 5.3866 5.3866 10.4877 10.4877 10.4938 10.4938 11.6512 11.6512 k = 0.3191-0.0000 0.1520 ( 5000 PWs) bands (ev): -10.9481 -10.9481 -10.9460 -10.9460 -10.6808 -10.6808 -10.6785 -10.6785 -1.0328 -1.0328 -1.0146 -1.0146 -0.8913 -0.8913 -0.8821 -0.8821 -0.1366 -0.1366 -0.1179 -0.1179 1.1302 1.1302 1.1348 1.1348 1.2891 1.2891 1.2903 1.2903 1.5068 1.5068 1.5092 1.5092 2.9703 2.9703 3.0172 3.0172 3.1577 3.1577 3.1609 3.1609 3.4413 3.4413 3.4467 3.4467 3.8016 3.8016 3.8220 3.8220 5.4052 5.4052 5.4192 5.4192 10.4843 10.4843 10.4906 10.4906 11.6935 11.6935 k = 0.3298-0.0000 0.1520 ( 5004 PWs) bands (ev): -10.9272 -10.9272 -10.9251 -10.9251 -10.6815 -10.6815 -10.6791 -10.6791 -1.0445 -1.0445 -1.0271 -1.0271 -0.9256 -0.9256 -0.9167 -0.9167 -0.0799 -0.0799 -0.0617 -0.0617 1.0695 1.0695 1.0701 1.0701 1.2630 1.2630 1.2672 1.2672 1.5476 1.5476 1.5501 1.5501 2.9540 2.9540 2.9970 2.9970 3.1427 3.1427 3.1466 3.1466 3.4212 3.4212 3.4243 3.4243 3.8264 3.8264 3.8410 3.8410 5.4390 5.4390 5.4532 5.4532 10.4769 10.4769 10.4833 10.4833 11.7295 11.7295 k = 0.3404-0.0000 0.1520 ( 5008 PWs) bands (ev): -10.9069 -10.9069 -10.9048 -10.9048 -10.6821 -10.6821 -10.6798 -10.6798 -1.0904 -1.0904 -1.0796 -1.0796 -0.9142 -0.9142 -0.9113 -0.9113 -0.0239 -0.0239 -0.0061 -0.0061 1.0019 1.0019 1.0042 1.0042 1.2395 1.2395 1.2455 1.2455 1.5915 1.5915 1.5941 1.5941 2.9354 2.9354 2.9743 2.9743 3.1212 3.1212 3.1254 3.1254 3.4063 3.4063 3.4077 3.4077 3.8502 3.8502 3.8598 3.8598 5.4739 5.4739 5.4882 5.4882 10.4662 10.4662 10.4725 10.4725 11.7586 11.7586 k = 0.3511-0.0000 0.1520 ( 5008 PWs) bands (ev): -10.8872 -10.8872 -10.8851 -10.8851 -10.6829 -10.6829 -10.6806 -10.6806 -1.1496 -1.1496 -1.1423 -1.1423 -0.8867 -0.8867 -0.8864 -0.8864 0.0305 0.0305 0.0481 0.0481 0.9320 0.9320 0.9366 0.9366 1.2182 1.2182 1.2252 1.2252 1.6375 1.6375 1.6403 1.6403 2.9150 2.9150 2.9497 2.9497 3.0931 3.0931 3.0974 3.0974 3.3967 3.3967 3.3969 3.3969 3.8728 3.8728 3.8782 3.8782 5.5093 5.5093 5.5237 5.5237 10.4529 10.4529 10.4590 10.4590 11.7803 11.7803 k = 0.3617-0.0000 0.1520 ( 5006 PWs) bands (ev): -10.8682 -10.8682 -10.8661 -10.8661 -10.6836 -10.6836 -10.6814 -10.6814 -1.2101 -1.2101 -1.2046 -1.2046 -0.8546 -0.8546 -0.8528 -0.8528 0.0826 0.0826 0.1002 0.1002 0.8620 0.8620 0.8684 0.8684 1.1988 1.1988 1.2061 1.2061 1.6850 1.6850 1.6880 1.6880 2.8928 2.8928 2.9236 2.9236 3.0591 3.0591 3.0634 3.0634 3.3910 3.3910 3.3917 3.3917 3.8943 3.8943 3.8959 3.8959 5.5448 5.5448 5.5591 5.5591 10.4377 10.4377 10.4435 10.4435 11.7950 11.7950 k = 0.3723-0.0000 0.1520 ( 5014 PWs) bands (ev): -10.8500 -10.8500 -10.8480 -10.8480 -10.6845 -10.6845 -10.6823 -10.6823 -1.2686 -1.2686 -1.2641 -1.2641 -0.8182 -0.8182 -0.8158 -0.8158 0.1310 0.1310 0.1487 0.1487 0.7933 0.7933 0.8014 0.8014 1.1810 1.1810 1.1884 1.1884 1.7336 1.7336 1.7369 1.7369 2.8694 2.8694 2.8962 2.8962 3.0203 3.0203 3.0247 3.0247 3.3889 3.3889 3.3902 3.3902 3.9129 3.9129 3.9145 3.9145 5.5798 5.5798 5.5941 5.5941 10.4213 10.4213 10.4268 10.4268 11.8033 11.8033 k = 0.3830-0.0000 0.1520 ( 5012 PWs) bands (ev): -10.8327 -10.8327 -10.8307 -10.8307 -10.6854 -10.6854 -10.6833 -10.6833 -1.3236 -1.3236 -1.3198 -1.3198 -0.7786 -0.7786 -0.7758 -0.7758 0.1737 0.1737 0.1919 0.1919 0.7280 0.7280 0.7376 0.7376 1.1647 1.1647 1.1718 1.1718 1.7833 1.7833 1.7868 1.7868 2.8449 2.8449 2.8679 2.8679 2.9780 2.9780 2.9823 2.9823 3.3894 3.3894 3.3910 3.3910 3.9289 3.9289 3.9334 3.9334 5.6140 5.6140 5.6282 5.6282 10.4044 10.4044 10.4095 10.4095 11.8061 11.8061 k = 0.3936-0.0000 0.1520 ( 5012 PWs) bands (ev): -10.8163 -10.8163 -10.8144 -10.8144 -10.6865 -10.6865 -10.6844 -10.6844 -1.3748 -1.3748 -1.3714 -1.3714 -0.7362 -0.7362 -0.7333 -0.7333 0.2078 0.2078 0.2263 0.2263 0.6693 0.6693 0.6801 0.6801 1.1499 1.1499 1.1564 1.1564 1.8338 1.8338 1.8375 1.8375 2.8197 2.8197 2.8391 2.8391 2.9331 2.9331 2.9374 2.9374 3.3915 3.3915 3.3934 3.3934 3.9440 3.9440 3.9509 3.9509 5.6468 5.6468 5.6609 5.6609 10.3874 10.3874 10.3922 10.3922 11.8045 11.8045 k = 0.4043-0.0000 0.1520 ( 5014 PWs) bands (ev): -10.8010 -10.8010 -10.7992 -10.7992 -10.6876 -10.6876 -10.6857 -10.6857 -1.4218 -1.4218 -1.4186 -1.4186 -0.6913 -0.6913 -0.6883 -0.6883 0.2287 0.2287 0.2470 0.2470 0.6221 0.6221 0.6333 0.6333 1.1365 1.1365 1.1421 1.1421 1.8850 1.8850 1.8889 1.8889 2.7939 2.7939 2.8098 2.8098 2.8869 2.8869 2.8909 2.8909 3.3945 3.3945 3.3967 3.3967 3.9578 3.9578 3.9669 3.9669 5.6779 5.6779 5.6919 5.6919 10.3709 10.3709 10.3753 10.3753 11.7997 11.7997 k = 0.4149-0.0000 0.1520 ( 5018 PWs) bands (ev): -10.7868 -10.7868 -10.7850 -10.7850 -10.6889 -10.6889 -10.6871 -10.6871 -1.4643 -1.4643 -1.4613 -1.4613 -0.6439 -0.6439 -0.6410 -0.6410 0.2309 0.2309 0.2477 0.2477 0.5925 0.5925 0.6027 0.6027 1.1245 1.1245 1.1291 1.1291 1.9367 1.9367 1.9409 1.9409 2.7674 2.7674 2.7796 2.7796 2.8406 2.8406 2.8440 2.8440 3.3981 3.3981 3.4004 3.4004 3.9705 3.9705 3.9814 3.9814 5.7068 5.7068 5.7207 5.7207 10.3553 10.3553 10.3592 10.3592 11.7927 11.7927 k = 0.4255-0.0000 0.1520 ( 5018 PWs) bands (ev): -10.7736 -10.7736 -10.7720 -10.7720 -10.6904 -10.6904 -10.6888 -10.6888 -1.5021 -1.5021 -1.4993 -1.4993 -0.5943 -0.5943 -0.5914 -0.5914 0.2115 0.2115 0.2252 0.2252 0.5833 0.5833 0.5907 0.5907 1.1138 1.1138 1.1173 1.1173 1.9888 1.9888 1.9933 1.9933 2.7393 2.7393 2.7471 2.7471 2.7969 2.7969 2.7986 2.7986 3.4018 3.4018 3.4042 3.4042 3.9818 3.9818 3.9944 3.9944 5.7333 5.7333 5.7470 5.7470 10.3409 10.3409 10.3444 10.3444 11.7843 11.7843 k = 0.4362-0.0000 0.1520 ( 5022 PWs) bands (ev): -10.7616 -10.7616 -10.7602 -10.7602 -10.6921 -10.6921 -10.6906 -10.6906 -1.5352 -1.5352 -1.5325 -1.5325 -0.5424 -0.5424 -0.5396 -0.5396 0.1733 0.1733 0.1836 0.1836 0.5902 0.5902 0.5942 0.5942 1.1045 1.1045 1.1067 1.1067 2.0411 2.0411 2.0459 2.0459 2.7063 2.7063 2.7091 2.7091 2.7589 2.7589 2.7599 2.7599 3.4054 3.4054 3.4078 3.4078 3.9918 3.9918 4.0057 4.0057 5.7569 5.7569 5.7705 5.7705 10.3279 10.3279 10.3311 10.3311 11.7755 11.7755 k = 0.4468-0.0000 0.1520 ( 5028 PWs) bands (ev): -10.7508 -10.7508 -10.7495 -10.7495 -10.6941 -10.6941 -10.6928 -10.6928 -1.5633 -1.5633 -1.5607 -1.5607 -0.4885 -0.4885 -0.4858 -0.4858 0.1226 0.1226 0.1301 0.1301 0.6056 0.6056 0.6066 0.6066 1.0965 1.0965 1.0974 1.0974 2.0933 2.0933 2.0985 2.0985 2.6645 2.6645 2.6654 2.6654 2.7289 2.7289 2.7315 2.7315 3.4086 3.4086 3.4111 3.4111 4.0003 4.0003 4.0154 4.0154 5.7774 5.7774 5.7909 5.7909 10.3167 10.3167 10.3195 10.3195 11.7669 11.7669 k = 0.4574-0.0000 0.1520 ( 5028 PWs) bands (ev): -10.7411 -10.7411 -10.7400 -10.7400 -10.6964 -10.6964 -10.6953 -10.6953 -1.5865 -1.5865 -1.5839 -1.5839 -0.4326 -0.4326 -0.4300 -0.4300 0.0648 0.0648 0.0702 0.0702 0.6221 0.6221 0.6236 0.6236 1.0895 1.0895 1.0900 1.0900 2.1449 2.1449 2.1504 2.1504 2.6167 2.6167 2.6190 2.6190 2.7072 2.7072 2.7098 2.7098 3.4115 3.4115 3.4140 3.4140 4.0074 4.0074 4.0233 4.0233 5.7946 5.7946 5.8079 5.8079 10.3073 10.3073 10.3099 10.3099 11.7590 11.7590 k = 0.4681-0.0000 0.1520 ( 5012 PWs) bands (ev): -10.7325 -10.7325 -10.7317 -10.7317 -10.6990 -10.6990 -10.6983 -10.6983 -1.6046 -1.6046 -1.6021 -1.6021 -0.3750 -0.3750 -0.3725 -0.3725 0.0035 0.0035 0.0076 0.0076 0.6371 0.6371 0.6403 0.6403 1.0832 1.0832 1.0849 1.0849 2.1949 2.1949 2.2010 2.2010 2.5687 2.5687 2.5712 2.5712 2.6913 2.6913 2.6932 2.6932 3.4138 3.4138 3.4163 3.4163 4.0130 4.0130 4.0296 4.0296 5.8082 5.8082 5.8214 5.8214 10.2999 10.2999 10.3022 10.3022 11.7524 11.7524 k = 0.4787-0.0000 0.1520 ( 5016 PWs) bands (ev): -10.7251 -10.7251 -10.7246 -10.7246 -10.7021 -10.7021 -10.7016 -10.7016 -1.6175 -1.6175 -1.6150 -1.6150 -0.3163 -0.3163 -0.3136 -0.3136 -0.0591 -0.0591 -0.0557 -0.0557 0.6491 0.6491 0.6535 0.6535 1.0785 1.0785 1.0812 1.0812 2.2414 2.2414 2.2481 2.2481 2.5232 2.5232 2.5255 2.5255 2.6801 2.6801 2.6812 2.6812 3.4154 3.4154 3.4180 3.4180 4.0169 4.0169 4.0340 4.0340 5.8180 5.8180 5.8312 5.8312 10.2945 10.2945 10.2967 10.2967 11.7474 11.7474 k = 0.4894-0.0000 0.1520 ( 5024 PWs) bands (ev): -10.7192 -10.7192 -10.7190 -10.7190 -10.7053 -10.7053 -10.7051 -10.7051 -1.6253 -1.6253 -1.6229 -1.6229 -0.2581 -0.2581 -0.2544 -0.2544 -0.1208 -0.1208 -0.1169 -0.1169 0.6567 0.6567 0.6620 0.6620 1.0756 1.0756 1.0789 1.0789 2.2789 2.2789 2.2866 2.2866 2.4862 2.4862 2.4878 2.4878 2.6734 2.6734 2.6740 2.6740 3.4164 3.4164 3.4190 3.4190 4.0193 4.0193 4.0367 4.0367 5.8239 5.8239 5.8371 5.8371 10.2913 10.2913 10.2934 10.2934 11.7444 11.7444 k = 0.5000-0.0000 0.1520 ( 5020 PWs) bands (ev): -10.7163 -10.7163 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6279 -1.6279 -1.6255 -1.6255 -0.2189 -0.2189 -0.2108 -0.2108 -0.1653 -0.1653 -0.1572 -0.1572 0.6594 0.6594 0.6649 0.6649 1.0746 1.0746 1.0782 1.0782 2.2949 2.2949 2.3032 2.3032 2.4704 2.4704 2.4714 2.4714 2.6712 2.6712 2.6716 2.6716 3.4168 3.4168 3.4193 3.4193 4.0201 4.0201 4.0376 4.0376 5.8259 5.8259 5.8390 5.8390 10.2902 10.2902 10.2923 10.2923 11.7433 11.7433 k = 0.5000-0.0000 0.1520 ( 5020 PWs) bands (ev): -10.7163 -10.7163 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6279 -1.6279 -1.6255 -1.6255 -0.2189 -0.2189 -0.2108 -0.2108 -0.1653 -0.1653 -0.1572 -0.1572 0.6594 0.6594 0.6649 0.6649 1.0746 1.0746 1.0782 1.0782 2.2949 2.2949 2.3032 2.3032 2.4704 2.4704 2.4714 2.4714 2.6712 2.6712 2.6716 2.6716 3.4168 3.4168 3.4193 3.4193 4.0201 4.0201 4.0376 4.0376 5.8259 5.8259 5.8390 5.8390 10.2902 10.2902 10.2923 10.2923 11.7433 11.7433 k = 0.5000 0.0104 0.1520 ( 5020 PWs) bands (ev): -10.7166 -10.7166 -10.7165 -10.7165 -10.7067 -10.7067 -10.7066 -10.7066 -1.6276 -1.6276 -1.6252 -1.6252 -0.2188 -0.2188 -0.2107 -0.2107 -0.1652 -0.1652 -0.1571 -0.1571 0.6590 0.6590 0.6645 0.6645 1.0729 1.0729 1.0764 1.0764 2.2946 2.2946 2.3029 2.3029 2.4709 2.4709 2.4719 2.4719 2.6711 2.6711 2.6715 2.6715 3.4173 3.4173 3.4199 3.4199 4.0200 4.0200 4.0375 4.0375 5.8258 5.8258 5.8389 5.8389 10.2896 10.2896 10.2916 10.2916 11.7449 11.7449 k = 0.5000 0.0209 0.1520 ( 5016 PWs) bands (ev): -10.7171 -10.7171 -10.7170 -10.7170 -10.7053 -10.7053 -10.7053 -10.7053 -1.6268 -1.6268 -1.6244 -1.6244 -0.2184 -0.2184 -0.2105 -0.2105 -0.1649 -0.1649 -0.1568 -0.1568 0.6580 0.6580 0.6634 0.6634 1.0678 1.0678 1.0713 1.0713 2.2938 2.2938 2.3021 2.3021 2.4725 2.4725 2.4733 2.4733 2.6710 2.6710 2.6714 2.6714 3.4187 3.4187 3.4214 3.4214 4.0197 4.0197 4.0373 4.0373 5.8256 5.8256 5.8386 5.8386 10.2876 10.2876 10.2895 10.2895 11.7496 11.7496 k = 0.5000 0.0313 0.1520 ( 5020 PWs) bands (ev): -10.7177 -10.7177 -10.7177 -10.7177 -10.7034 -10.7034 -10.7033 -10.7033 -1.6255 -1.6255 -1.6231 -1.6231 -0.2179 -0.2179 -0.2101 -0.2101 -0.1642 -0.1642 -0.1564 -0.1564 0.6563 0.6563 0.6616 0.6616 1.0594 1.0594 1.0628 1.0628 2.2922 2.2922 2.3008 2.3008 2.4751 2.4751 2.4757 2.4757 2.6708 2.6708 2.6712 2.6712 3.4211 3.4211 3.4240 3.4240 4.0192 4.0192 4.0369 4.0369 5.8251 5.8251 5.8381 5.8381 10.2843 10.2843 10.2861 10.2861 11.7569 11.7569 k = 0.5000 0.0418 0.1520 ( 5012 PWs) bands (ev): -10.7183 -10.7183 -10.7182 -10.7182 -10.7010 -10.7010 -10.7009 -10.7009 -1.6237 -1.6237 -1.6213 -1.6213 -0.2172 -0.2172 -0.2097 -0.2097 -0.1633 -0.1633 -0.1558 -0.1558 0.6538 0.6538 0.6591 0.6591 1.0478 1.0478 1.0511 1.0511 2.2901 2.2901 2.2988 2.2988 2.4787 2.4787 2.4790 2.4790 2.6706 2.6706 2.6709 2.6709 3.4245 3.4245 3.4277 3.4277 4.0186 4.0186 4.0364 4.0364 5.8245 5.8245 5.8374 5.8374 10.2798 10.2798 10.2813 10.2813 11.7663 11.7663 k = 0.5000 0.0522 0.1520 ( 5012 PWs) bands (ev): -10.7187 -10.7187 -10.7187 -10.7187 -10.6982 -10.6982 -10.6981 -10.6981 -1.6214 -1.6214 -1.6189 -1.6189 -0.2163 -0.2163 -0.2091 -0.2091 -0.1621 -0.1621 -0.1549 -0.1549 0.6507 0.6507 0.6558 0.6558 1.0331 1.0331 1.0363 1.0363 2.2872 2.2872 2.2962 2.2962 2.4831 2.4831 2.4833 2.4833 2.6703 2.6703 2.6705 2.6705 3.4289 3.4289 3.4324 3.4324 4.0178 4.0178 4.0358 4.0358 5.8237 5.8237 5.8365 5.8365 10.2739 10.2739 10.2751 10.2751 11.7767 11.7767 k = 0.5000 0.0626 0.1520 ( 5008 PWs) bands (ev): -10.7189 -10.7189 -10.7189 -10.7189 -10.6951 -10.6951 -10.6951 -10.6951 -1.6185 -1.6185 -1.6161 -1.6161 -0.2153 -0.2153 -0.2086 -0.2086 -0.1605 -0.1605 -0.1538 -0.1538 0.6468 0.6468 0.6518 0.6518 1.0157 1.0157 1.0188 1.0188 2.2836 2.2836 2.2929 2.2929 2.4880 2.4880 2.4888 2.4888 2.6700 2.6700 2.6701 2.6701 3.4343 3.4343 3.4382 3.4382 4.0169 4.0169 4.0351 4.0351 5.8228 5.8228 5.8355 5.8355 10.2666 10.2666 10.2675 10.2675 11.7869 11.7869 k = 0.5000 0.0731 0.1520 ( 5000 PWs) bands (ev): -10.7189 -10.7189 -10.7189 -10.7189 -10.6918 -10.6918 -10.6917 -10.6917 -1.6152 -1.6152 -1.6128 -1.6128 -0.2143 -0.2143 -0.2081 -0.2081 -0.1585 -0.1585 -0.1523 -0.1523 0.6421 0.6421 0.6469 0.6469 0.9956 0.9956 0.9986 0.9986 2.2792 2.2792 2.2889 2.2889 2.4937 2.4937 2.4950 2.4950 2.6695 2.6695 2.6696 2.6696 3.4407 3.4407 3.4452 3.4452 4.0160 4.0160 4.0345 4.0345 5.8216 5.8216 5.8342 5.8342 10.2581 10.2581 10.2586 10.2586 11.7949 11.7949 k = 0.5000 0.0835 0.1520 ( 5004 PWs) bands (ev): -10.7187 -10.7187 -10.7187 -10.7187 -10.6882 -10.6882 -10.6881 -10.6881 -1.6114 -1.6114 -1.6090 -1.6090 -0.2133 -0.2133 -0.2077 -0.2077 -0.1560 -0.1560 -0.1505 -0.1505 0.6366 0.6366 0.6412 0.6412 0.9733 0.9733 0.9762 0.9762 2.2739 2.2739 2.2840 2.2840 2.5001 2.5001 2.5020 2.5020 2.6690 2.6690 2.6691 2.6691 3.4483 3.4483 3.4534 3.4534 4.0150 4.0150 4.0338 4.0338 5.8204 5.8204 5.8327 5.8327 10.2481 10.2481 10.2482 10.2482 11.7988 11.7988 k = 0.5000 0.0940 0.1520 ( 5004 PWs) bands (ev): -10.7183 -10.7183 -10.7182 -10.7182 -10.6843 -10.6843 -10.6843 -10.6843 -1.6072 -1.6072 -1.6049 -1.6049 -0.2124 -0.2124 -0.2075 -0.2075 -0.1531 -0.1531 -0.1482 -0.1482 0.6302 0.6302 0.6346 0.6346 0.9490 0.9490 0.9517 0.9517 2.2677 2.2677 2.2782 2.2782 2.5070 2.5070 2.5097 2.5097 2.6683 2.6683 2.6686 2.6686 3.4569 3.4569 3.4627 3.4627 4.0140 4.0140 4.0331 4.0331 5.8189 5.8189 5.8311 5.8311 10.2363 10.2363 10.2368 10.2368 11.7959 11.7959 k = 0.5000 0.1044 0.1520 ( 5004 PWs) bands (ev): -10.7176 -10.7176 -10.7176 -10.7176 -10.6803 -10.6803 -10.6802 -10.6802 -1.6026 -1.6026 -1.6003 -1.6003 -0.2116 -0.2116 -0.2075 -0.2075 -0.1496 -0.1496 -0.1454 -0.1454 0.6229 0.6229 0.6270 0.6270 0.9231 0.9231 0.9257 0.9257 2.2606 2.2606 2.2715 2.2715 2.5144 2.5144 2.5179 2.5179 2.6676 2.6676 2.6681 2.6681 3.4668 3.4668 3.4733 3.4733 4.0130 4.0130 4.0326 4.0326 5.8174 5.8174 5.8293 5.8293 10.2230 10.2230 10.2240 10.2240 11.7838 11.7838 k = 0.5000 0.1148 0.1520 ( 5008 PWs) bands (ev): -10.7168 -10.7168 -10.7167 -10.7167 -10.6760 -10.6760 -10.6760 -10.6760 -1.5976 -1.5976 -1.5953 -1.5953 -0.2111 -0.2111 -0.2077 -0.2077 -0.1457 -0.1457 -0.1422 -0.1422 0.6145 0.6145 0.6184 0.6184 0.8959 0.8959 0.8984 0.8984 2.2525 2.2525 2.2639 2.2639 2.5223 2.5223 2.5265 2.5265 2.6668 2.6668 2.6675 2.6675 3.4777 3.4777 3.4851 3.4851 4.0122 4.0122 4.0322 4.0322 5.8156 5.8156 5.8273 5.8273 10.2081 10.2081 10.2098 10.2098 11.7603 11.7603 k = 0.5000 0.1253 0.1520 ( 5020 PWs) bands (ev): -10.7157 -10.7157 -10.7157 -10.7157 -10.6716 -10.6716 -10.6716 -10.6716 -1.5923 -1.5923 -1.5899 -1.5899 -0.2108 -0.2108 -0.2081 -0.2081 -0.1412 -0.1412 -0.1384 -0.1384 0.6050 0.6050 0.6086 0.6086 0.8679 0.8679 0.8701 0.8701 2.2435 2.2435 2.2553 2.2553 2.5305 2.5305 2.5355 2.5355 2.6659 2.6659 2.6669 2.6669 3.4899 3.4899 3.4982 3.4982 4.0114 4.0114 4.0319 4.0319 5.8137 5.8137 5.8251 5.8251 10.1916 10.1916 10.1939 10.1939 11.7242 11.7242 k = 0.5000 0.1357 0.1520 ( 5020 PWs) bands (ev): -10.7145 -10.7145 -10.7144 -10.7144 -10.6671 -10.6671 -10.6670 -10.6670 -1.5866 -1.5866 -1.5843 -1.5843 -0.2109 -0.2109 -0.2088 -0.2088 -0.1362 -0.1362 -0.1341 -0.1341 0.5942 0.5942 0.5974 0.5974 0.8393 0.8393 0.8415 0.8415 2.2336 2.2336 2.2458 2.2458 2.5389 2.5389 2.5447 2.5447 2.6651 2.6651 2.6663 2.6663 3.5034 3.5034 3.5127 3.5127 4.0107 4.0107 4.0318 4.0318 5.8117 5.8117 5.8228 5.8228 10.1734 10.1734 10.1764 10.1764 11.6757 11.6757 k = 0.5000 0.1462 0.1520 ( 5032 PWs) bands (ev): -10.7131 -10.7131 -10.7130 -10.7130 -10.6624 -10.6624 -10.6623 -10.6623 -1.5806 -1.5806 -1.5783 -1.5783 -0.2112 -0.2112 -0.2097 -0.2097 -0.1308 -0.1308 -0.1292 -0.1292 0.5819 0.5819 0.5848 0.5848 0.8108 0.8108 0.8128 0.8128 2.2228 2.2228 2.2354 2.2354 2.5474 2.5474 2.5541 2.5541 2.6642 2.6642 2.6657 2.6657 3.5181 3.5181 3.5286 3.5286 4.0102 4.0102 4.0319 4.0319 5.8096 5.8096 5.8203 5.8203 10.1534 10.1534 10.1570 10.1570 11.6160 11.6160 k = 0.5000 0.1566 0.1520 ( 5044 PWs) bands (ev): -10.7115 -10.7115 -10.7114 -10.7114 -10.6576 -10.6576 -10.6575 -10.6575 -1.5744 -1.5744 -1.5721 -1.5721 -0.2118 -0.2118 -0.2108 -0.2108 -0.1251 -0.1251 -0.1240 -0.1240 0.5680 0.5680 0.5705 0.5705 0.7827 0.7827 0.7846 0.7846 2.2113 2.2113 2.2241 2.2241 2.5560 2.5560 2.5634 2.5634 2.6633 2.6633 2.6652 2.6652 3.5341 3.5341 3.5457 3.5457 4.0098 4.0098 4.0322 4.0322 5.8073 5.8073 5.8176 5.8176 10.1314 10.1314 10.1358 10.1358 11.5473 11.5473 k = 0.5000 0.1670 0.1520 ( 5048 PWs) bands (ev): -10.7098 -10.7098 -10.7097 -10.7097 -10.6526 -10.6526 -10.6526 -10.6526 -1.5679 -1.5679 -1.5657 -1.5657 -0.2127 -0.2127 -0.2122 -0.2122 -0.1189 -0.1189 -0.1182 -0.1182 0.5523 0.5523 0.5545 0.5545 0.7556 0.7556 0.7573 0.7573 2.1989 2.1989 2.2120 2.2120 2.5644 2.5644 2.5727 2.5727 2.6625 2.6625 2.6649 2.6649 3.5513 3.5513 3.5643 3.5643 4.0096 4.0096 4.0328 4.0328 5.8049 5.8049 5.8148 5.8148 10.1073 10.1073 10.1125 10.1125 11.4720 11.4720 k = 0.5000 0.1775 0.1520 ( 5040 PWs) bands (ev): -10.7079 -10.7079 -10.7078 -10.7078 -10.6477 -10.6477 -10.6476 -10.6476 -1.5612 -1.5612 -1.5590 -1.5590 -0.2139 -0.2139 -0.2138 -0.2138 -0.1125 -0.1125 -0.1121 -0.1121 0.5347 0.5347 0.5365 0.5365 0.7297 0.7297 0.7313 0.7313 2.1860 2.1860 2.1993 2.1993 2.5726 2.5726 2.5818 2.5818 2.6618 2.6618 2.6646 2.6646 3.5698 3.5698 3.5842 3.5842 4.0095 4.0095 4.0336 4.0336 5.8024 5.8024 5.8119 5.8119 10.0809 10.0809 10.0869 10.0869 11.3924 11.3924 k = 0.5000 0.1879 0.1520 ( 5032 PWs) bands (ev): -10.7059 -10.7059 -10.7058 -10.7058 -10.6426 -10.6426 -10.6425 -10.6425 -1.5544 -1.5544 -1.5522 -1.5522 -0.2156 -0.2156 -0.2154 -0.2154 -0.1058 -0.1058 -0.1056 -0.1056 0.5152 0.5152 0.5166 0.5166 0.7053 0.7053 0.7068 0.7068 2.1725 2.1725 2.1859 2.1859 2.5804 2.5804 2.5905 2.5905 2.6612 2.6612 2.6646 2.6646 3.5895 3.5895 3.6055 3.6055 4.0096 4.0096 4.0347 4.0347 5.7997 5.7997 5.8088 5.8088 10.0521 10.0521 10.0589 10.0589 11.3108 11.3108 k = 0.5000 0.1984 0.1520 ( 5036 PWs) bands (ev): -10.7038 -10.7038 -10.7038 -10.7038 -10.6375 -10.6375 -10.6375 -10.6375 -1.5475 -1.5475 -1.5453 -1.5453 -0.2176 -0.2176 -0.2171 -0.2171 -0.0990 -0.0990 -0.0989 -0.0989 0.4940 0.4940 0.4950 0.4950 0.6826 0.6826 0.6841 0.6841 2.1585 2.1585 2.1721 2.1721 2.5877 2.5877 2.5986 2.5986 2.6609 2.6609 2.6649 2.6649 3.6103 3.6103 3.6279 3.6279 4.0099 4.0099 4.0360 4.0360 5.7970 5.7970 5.8056 5.8056 10.0206 10.0206 10.0282 10.0282 11.2290 11.2290 k = 0.5000 0.2088 0.1520 ( 5036 PWs) bands (ev): -10.7016 -10.7016 -10.7016 -10.7016 -10.6325 -10.6325 -10.6324 -10.6324 -1.5404 -1.5404 -1.5384 -1.5384 -0.2198 -0.2198 -0.2191 -0.2191 -0.0921 -0.0921 -0.0920 -0.0920 0.4712 0.4712 0.4719 0.4719 0.6616 0.6616 0.6630 0.6630 2.1443 2.1443 2.1579 2.1579 2.5944 2.5944 2.6061 2.6061 2.6609 2.6609 2.6654 2.6654 3.6321 3.6321 3.6516 3.6516 4.0104 4.0104 4.0377 4.0377 5.7941 5.7941 5.8022 5.8022 9.9863 9.9863 9.9947 9.9947 11.1484 11.1484 k = 0.5000 0.2192 0.1520 ( 5024 PWs) bands (ev): -10.6994 -10.6994 -10.6993 -10.6993 -10.6274 -10.6274 -10.6273 -10.6273 -1.5334 -1.5334 -1.5314 -1.5314 -0.2222 -0.2222 -0.2214 -0.2214 -0.0852 -0.0852 -0.0850 -0.0850 0.4474 0.4474 0.4477 0.4477 0.6421 0.6421 0.6436 0.6436 2.1298 2.1298 2.1434 2.1434 2.6004 2.6004 2.6127 2.6127 2.6614 2.6614 2.6665 2.6665 3.6549 3.6549 3.6763 3.6763 4.0110 4.0110 4.0397 4.0397 5.7911 5.7911 5.7987 5.7987 9.9490 9.9490 9.9582 9.9582 11.0705 11.0705 k = 0.5000 0.2297 0.1520 ( 5012 PWs) bands (ev): -10.6971 -10.6971 -10.6970 -10.6970 -10.6223 -10.6223 -10.6223 -10.6223 -1.5263 -1.5263 -1.5243 -1.5243 -0.2248 -0.2248 -0.2239 -0.2239 -0.0783 -0.0783 -0.0782 -0.0782 0.4230 0.4230 0.4231 0.4231 0.6240 0.6240 0.6255 0.6255 2.1152 2.1152 2.1288 2.1288 2.6055 2.6055 2.6182 2.6182 2.6626 2.6626 2.6679 2.6679 3.6785 3.6785 3.7020 3.7020 4.0118 4.0118 4.0420 4.0420 5.7880 5.7880 5.7951 5.7951 9.9086 9.9086 9.9185 9.9185 10.9962 10.9962 k = 0.5000 0.2401 0.1520 ( 5012 PWs) bands (ev): -10.6948 -10.6948 -10.6947 -10.6947 -10.6174 -10.6174 -10.6173 -10.6173 -1.5193 -1.5193 -1.5174 -1.5174 -0.2276 -0.2276 -0.2267 -0.2267 -0.0716 -0.0716 -0.0715 -0.0715 0.3983 0.3983 0.3986 0.3986 0.6069 0.6069 0.6085 0.6085 2.1007 2.1007 2.1141 2.1141 2.6097 2.6097 2.6225 2.6225 2.6646 2.6646 2.6699 2.6699 3.7026 3.7026 3.7284 3.7284 4.0128 4.0128 4.0446 4.0446 5.7848 5.7848 5.7913 5.7913 9.8651 9.8651 9.8756 9.8756 10.9263 10.9263 k = 0.5000 0.2506 0.1520 ( 5016 PWs) bands (ev): -10.6924 -10.6924 -10.6924 -10.6924 -10.6125 -10.6125 -10.6124 -10.6124 -1.5124 -1.5124 -1.5105 -1.5105 -0.2307 -0.2307 -0.2297 -0.2297 -0.0652 -0.0652 -0.0651 -0.0651 0.3741 0.3741 0.3745 0.3745 0.5907 0.5907 0.5924 0.5924 2.0863 2.0863 2.0996 2.0996 2.6130 2.6130 2.6254 2.6254 2.6673 2.6673 2.6723 2.6723 3.7272 3.7272 3.7555 3.7555 4.0140 4.0140 4.0477 4.0477 5.7815 5.7815 5.7875 5.7875 9.8188 9.8188 9.8297 9.8297 10.8614 10.8614 k = 0.5000 0.2610 0.1520 ( 5016 PWs) bands (ev): -10.6901 -10.6901 -10.6900 -10.6900 -10.6077 -10.6077 -10.6076 -10.6076 -1.5056 -1.5056 -1.5038 -1.5038 -0.2339 -0.2339 -0.2329 -0.2329 -0.0593 -0.0593 -0.0590 -0.0590 0.3508 0.3508 0.3514 0.3514 0.5753 0.5753 0.5771 0.5771 2.0722 2.0722 2.0852 2.0852 2.6154 2.6154 2.6272 2.6272 2.6707 2.6707 2.6752 2.6752 3.7519 3.7519 3.7828 3.7828 4.0155 4.0155 4.0512 4.0512 5.7781 5.7781 5.7836 5.7836 9.7698 9.7698 9.7810 9.7810 10.8018 10.8018 k = 0.5000 0.2714 0.1520 ( 5012 PWs) bands (ev): -10.6878 -10.6878 -10.6877 -10.6877 -10.6030 -10.6030 -10.6030 -10.6030 -1.4989 -1.4989 -1.4972 -1.4972 -0.2374 -0.2374 -0.2364 -0.2364 -0.0540 -0.0540 -0.0535 -0.0535 0.3288 0.3288 0.3297 0.3297 0.5604 0.5604 0.5624 0.5624 2.0584 2.0584 2.0711 2.0711 2.6171 2.6171 2.6281 2.6281 2.6746 2.6746 2.6783 2.6783 3.7766 3.7766 3.8103 3.8103 4.0173 4.0173 4.0553 4.0553 5.7747 5.7747 5.7796 5.7796 9.7185 9.7185 9.7299 9.7299 10.7477 10.7477 k = 0.5000 0.2819 0.1520 ( 5016 PWs) bands (ev): -10.6855 -10.6855 -10.6855 -10.6855 -10.5985 -10.5985 -10.5985 -10.5985 -1.4924 -1.4924 -1.4908 -1.4908 -0.2410 -0.2410 -0.2401 -0.2401 -0.0494 -0.0494 -0.0486 -0.0486 0.3085 0.3085 0.3096 0.3096 0.5460 0.5460 0.5481 0.5481 2.0450 2.0450 2.0573 2.0573 2.6182 2.6182 2.6283 2.6283 2.6787 2.6787 2.6817 2.6817 3.8009 3.8009 3.8375 3.8375 4.0196 4.0196 4.0600 4.0600 5.7712 5.7712 5.7755 5.7755 9.6656 9.6656 9.6770 9.6770 10.6990 10.6990 k = 0.5000 0.2923 0.1520 ( 5028 PWs) bands (ev): -10.6833 -10.6833 -10.6832 -10.6832 -10.5942 -10.5942 -10.5941 -10.5941 -1.4862 -1.4862 -1.4846 -1.4846 -0.2448 -0.2448 -0.2440 -0.2440 -0.0455 -0.0455 -0.0445 -0.0445 0.2903 0.2903 0.2915 0.2915 0.5321 0.5321 0.5343 0.5343 2.0322 2.0322 2.0441 2.0441 2.6188 2.6188 2.6280 2.6280 2.6828 2.6828 2.6851 2.6851 3.8244 3.8244 3.8639 3.8639 4.0226 4.0226 4.0655 4.0655 5.7676 5.7676 5.7714 5.7714 9.6118 9.6118 9.6229 9.6229 10.6555 10.6555 k = 0.5000 0.3028 0.1520 ( 5024 PWs) bands (ev): -10.6812 -10.6812 -10.6811 -10.6811 -10.5901 -10.5901 -10.5900 -10.5900 -1.4802 -1.4802 -1.4787 -1.4787 -0.2488 -0.2488 -0.2480 -0.2480 -0.0426 -0.0426 -0.0414 -0.0414 0.2744 0.2744 0.2757 0.2757 0.5186 0.5186 0.5209 0.5209 2.0200 2.0200 2.0314 2.0314 2.6190 2.6190 2.6274 2.6274 2.6868 2.6868 2.6885 2.6885 3.8468 3.8468 3.8891 3.8891 4.0267 4.0267 4.0718 4.0718 5.7640 5.7640 5.7673 5.7673 9.5577 9.5577 9.5684 9.5684 10.6168 10.6168 k = 0.5000 0.3132 0.1520 ( 5016 PWs) bands (ev): -10.6791 -10.6791 -10.6790 -10.6790 -10.5861 -10.5861 -10.5861 -10.5861 -1.4745 -1.4745 -1.4731 -1.4731 -0.2530 -0.2530 -0.2522 -0.2522 -0.0407 -0.0407 -0.0393 -0.0393 0.2609 0.2609 0.2622 0.2622 0.5056 0.5056 0.5080 0.5080 2.0086 2.0086 2.0193 2.0193 2.6190 2.6190 2.6266 2.6266 2.6906 2.6906 2.6918 2.6918 3.8678 3.8678 3.9121 3.9121 4.0323 4.0323 4.0790 4.0790 5.7605 5.7605 5.7632 5.7632 9.5041 9.5041 9.5142 9.5142 10.5827 10.5827 k = 0.5000 0.3236 0.1520 ( 5016 PWs) bands (ev): -10.6771 -10.6771 -10.6771 -10.6771 -10.5824 -10.5824 -10.5824 -10.5824 -1.4691 -1.4691 -1.4678 -1.4678 -0.2572 -0.2572 -0.2565 -0.2565 -0.0398 -0.0398 -0.0382 -0.0382 0.2498 0.2498 0.2513 0.2513 0.4930 0.4930 0.4955 0.4955 1.9978 1.9978 2.0079 2.0079 2.6188 2.6188 2.6256 2.6256 2.6941 2.6941 2.6949 2.6949 3.8870 3.8870 3.9322 3.9322 4.0400 4.0400 4.0872 4.0872 5.7569 5.7569 5.7592 5.7592 9.4518 9.4518 9.4613 9.4613 10.5528 10.5528 k = 0.5000 0.3341 0.1520 ( 5020 PWs) bands (ev): -10.6753 -10.6753 -10.6753 -10.6753 -10.5790 -10.5790 -10.5789 -10.5789 -1.4641 -1.4641 -1.4629 -1.4629 -0.2615 -0.2615 -0.2609 -0.2609 -0.0397 -0.0397 -0.0380 -0.0380 0.2413 0.2413 0.2427 0.2427 0.4810 0.4810 0.4835 0.4835 1.9879 1.9879 1.9973 1.9973 2.6185 2.6185 2.6246 2.6246 2.6973 2.6973 2.6978 2.6978 3.9041 3.9041 3.9485 3.9485 4.0504 4.0504 4.0963 4.0963 5.7534 5.7534 5.7553 5.7553 9.4015 9.4015 9.4102 9.4102 10.5267 10.5267 k = 0.5000 0.3445 0.1520 ( 5028 PWs) bands (ev): -10.6736 -10.6736 -10.6736 -10.6736 -10.5758 -10.5758 -10.5758 -10.5758 -1.4595 -1.4595 -1.4584 -1.4584 -0.2657 -0.2657 -0.2652 -0.2652 -0.0405 -0.0405 -0.0387 -0.0387 0.2350 0.2350 0.2363 0.2363 0.4696 0.4696 0.4720 0.4720 1.9788 1.9788 1.9875 1.9875 2.6182 2.6182 2.6236 2.6236 2.7001 2.7001 2.7004 2.7004 3.9191 3.9191 3.9607 3.9607 4.0634 4.0634 4.1063 4.1063 5.7501 5.7501 5.7516 5.7516 9.3539 9.3539 9.3618 9.3618 10.5040 10.5040 k = 0.5000 0.3550 0.1520 ( 5032 PWs) bands (ev): -10.6720 -10.6720 -10.6720 -10.6720 -10.5730 -10.5730 -10.5729 -10.5729 -1.4553 -1.4553 -1.4543 -1.4543 -0.2699 -0.2699 -0.2695 -0.2695 -0.0419 -0.0419 -0.0401 -0.0401 0.2308 0.2308 0.2320 0.2320 0.4588 0.4588 0.4612 0.4612 1.9706 1.9706 1.9785 1.9785 2.6178 2.6178 2.6225 2.6225 2.7027 2.7027 2.7028 2.7028 3.9319 3.9319 3.9692 3.9692 4.0785 4.0785 4.1167 4.1167 5.7469 5.7469 5.7480 5.7480 9.3096 9.3096 9.3167 9.3167 10.4845 10.4845 k = 0.5000 0.3654 0.1520 ( 5032 PWs) bands (ev): -10.6706 -10.6706 -10.6706 -10.6706 -10.5704 -10.5704 -10.5703 -10.5703 -1.4515 -1.4515 -1.4506 -1.4506 -0.2739 -0.2739 -0.2735 -0.2735 -0.0436 -0.0436 -0.0420 -0.0420 0.2283 0.2283 0.2294 0.2294 0.4489 0.4489 0.4512 0.4512 1.9634 1.9634 1.9704 1.9704 2.6174 2.6174 2.6215 2.6215 2.7049 2.7049 2.7050 2.7050 3.9427 3.9427 3.9749 3.9749 4.0944 4.0944 4.1273 4.1273 5.7439 5.7439 5.7447 5.7447 9.2693 9.2693 9.2755 9.2755 10.4678 10.4678 k = 0.5000 0.3758 0.1520 ( 5036 PWs) bands (ev): -10.6694 -10.6694 -10.6693 -10.6693 -10.5681 -10.5681 -10.5681 -10.5681 -1.4482 -1.4482 -1.4474 -1.4474 -0.2776 -0.2776 -0.2773 -0.2773 -0.0456 -0.0456 -0.0441 -0.0441 0.2272 0.2272 0.2281 0.2281 0.4398 0.4398 0.4420 0.4420 1.9571 1.9571 1.9632 1.9632 2.6170 2.6170 2.6206 2.6206 2.7067 2.7067 2.7068 2.7068 3.9516 3.9516 3.9785 3.9785 4.1101 4.1101 4.1375 4.1375 5.7411 5.7411 5.7417 5.7417 9.2334 9.2334 9.2387 9.2387 10.4538 10.4538 k = 0.5000 0.3863 0.1520 ( 5032 PWs) bands (ev): -10.6683 -10.6683 -10.6683 -10.6683 -10.5662 -10.5662 -10.5661 -10.5661 -1.4453 -1.4453 -1.4447 -1.4447 -0.2809 -0.2809 -0.2806 -0.2806 -0.0475 -0.0475 -0.0462 -0.0462 0.2271 0.2271 0.2278 0.2278 0.4319 0.4319 0.4337 0.4337 1.9519 1.9519 1.9570 1.9570 2.6168 2.6168 2.6197 2.6197 2.7083 2.7083 2.7085 2.7085 3.9589 3.9589 3.9807 3.9807 4.1248 4.1248 4.1469 4.1469 5.7387 5.7387 5.7391 5.7391 9.2023 9.2023 9.2067 9.2067 10.4423 10.4423 k = 0.5000 0.3967 0.1520 ( 5028 PWs) bands (ev): -10.6675 -10.6675 -10.6674 -10.6674 -10.5646 -10.5646 -10.5646 -10.5646 -1.4429 -1.4429 -1.4424 -1.4424 -0.2837 -0.2837 -0.2836 -0.2836 -0.0493 -0.0493 -0.0482 -0.0482 0.2276 0.2276 0.2281 0.2281 0.4251 0.4251 0.4267 0.4267 1.9477 1.9477 1.9518 1.9518 2.6166 2.6166 2.6189 2.6189 2.7096 2.7096 2.7098 2.7098 3.9649 3.9649 3.9818 3.9818 4.1379 4.1379 4.1550 4.1550 5.7366 5.7366 5.7369 5.7369 9.1764 9.1764 9.1799 9.1799 10.4331 10.4331 k = 0.5000 0.4072 0.1520 ( 5028 PWs) bands (ev): -10.6668 -10.6668 -10.6667 -10.6667 -10.5634 -10.5634 -10.5633 -10.5633 -1.4411 -1.4411 -1.4407 -1.4407 -0.2861 -0.2861 -0.2859 -0.2859 -0.0508 -0.0508 -0.0500 -0.0500 0.2284 0.2284 0.2288 0.2288 0.4196 0.4196 0.4209 0.4209 1.9445 1.9445 1.9476 1.9476 2.6165 2.6165 2.6183 2.6183 2.7106 2.7106 2.7108 2.7108 3.9697 3.9697 3.9821 3.9821 4.1488 4.1488 4.1613 4.1613 5.7349 5.7349 5.7351 5.7351 9.1561 9.1561 9.1587 9.1587 10.4261 10.4261 k = 0.5000 0.4176 0.1520 ( 5024 PWs) bands (ev): -10.6663 -10.6663 -10.6662 -10.6662 -10.5625 -10.5625 -10.5624 -10.5624 -1.4397 -1.4397 -1.4394 -1.4394 -0.2878 -0.2878 -0.2877 -0.2877 -0.0519 -0.0519 -0.0514 -0.0514 0.2292 0.2292 0.2295 0.2295 0.4157 0.4157 0.4166 0.4166 1.9424 1.9424 1.9445 1.9445 2.6165 2.6165 2.6177 2.6177 2.7114 2.7114 2.7115 2.7115 3.9736 3.9736 3.9817 3.9817 4.1573 4.1573 4.1655 4.1655 5.7337 5.7337 5.7338 5.7338 9.1415 9.1415 9.1433 9.1433 10.4212 10.4212 k = 0.5000 0.4280 0.1520 ( 5020 PWs) bands (ev): -10.6660 -10.6660 -10.6659 -10.6659 -10.5619 -10.5619 -10.5619 -10.5619 -1.4388 -1.4388 -1.4387 -1.4387 -0.2888 -0.2888 -0.2887 -0.2887 -0.0525 -0.0525 -0.0523 -0.0523 0.2299 0.2299 0.2300 0.2300 0.4134 0.4134 0.4138 0.4138 1.9413 1.9413 1.9423 1.9423 2.6167 2.6167 2.6173 2.6173 2.7118 2.7118 2.7119 2.7119 3.9766 3.9766 3.9807 3.9807 4.1633 4.1633 4.1674 4.1674 5.7329 5.7329 5.7330 5.7330 9.1329 9.1329 9.1338 9.1338 10.4184 10.4184 k = 0.5000 0.4385 0.1520 ( 5024 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5617 -10.5617 -10.5617 -10.5617 -1.4385 -1.4385 -1.4385 -1.4385 -0.2891 -0.2891 -0.2891 -0.2891 -0.0527 -0.0527 -0.0527 -0.0527 0.2301 0.2301 0.2301 0.2301 0.4127 0.4127 0.4127 0.4127 1.9413 1.9413 1.9413 1.9413 2.6169 2.6169 2.6170 2.6170 2.7120 2.7120 2.7120 2.7120 3.9789 3.9789 3.9790 3.9790 4.1666 4.1666 4.1667 4.1667 5.7327 5.7327 5.7327 5.7327 9.1303 9.1303 9.1303 9.1303 10.4176 10.4176 k = 0.5000 0.4385 0.1520 ( 5024 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5617 -10.5617 -10.5617 -10.5617 -1.4385 -1.4385 -1.4385 -1.4385 -0.2891 -0.2891 -0.2891 -0.2891 -0.0527 -0.0527 -0.0527 -0.0527 0.2301 0.2301 0.2301 0.2301 0.4127 0.4127 0.4127 0.4127 1.9413 1.9413 1.9413 1.9413 2.6169 2.6169 2.6170 2.6170 2.7120 2.7120 2.7120 2.7120 3.9789 3.9789 3.9790 3.9790 4.1666 4.1666 4.1667 4.1667 5.7327 5.7327 5.7327 5.7327 9.1303 9.1303 9.1303 9.1303 10.4176 10.4176 k = 0.4894 0.4385 0.1520 ( 5032 PWs) bands (ev): -10.6658 -10.6658 -10.6658 -10.6658 -10.5625 -10.5625 -10.5625 -10.5625 -1.4360 -1.4360 -1.4360 -1.4360 -0.3013 -0.3013 -0.3013 -0.3013 -0.0422 -0.0422 -0.0422 -0.0422 0.2339 0.2339 0.2339 0.2339 0.4092 0.4092 0.4093 0.4093 1.9370 1.9370 1.9370 1.9370 2.6210 2.6210 2.6210 2.6210 2.7144 2.7144 2.7145 2.7145 3.9774 3.9774 3.9774 3.9774 4.1660 4.1660 4.1661 4.1661 5.7312 5.7312 5.7313 5.7313 9.1324 9.1324 9.1325 9.1325 10.4201 10.4201 k = 0.4787 0.4385 0.1520 ( 5024 PWs) bands (ev): -10.6657 -10.6657 -10.6657 -10.6657 -10.5650 -10.5650 -10.5649 -10.5649 -1.4285 -1.4285 -1.4284 -1.4284 -0.3322 -0.3322 -0.3322 -0.3322 -0.0167 -0.0167 -0.0167 -0.0167 0.2457 0.2457 0.2457 0.2457 0.3989 0.3989 0.3989 0.3989 1.9245 1.9245 1.9245 1.9245 2.6330 2.6330 2.6331 2.6331 2.7218 2.7218 2.7219 2.7219 3.9727 3.9727 3.9728 3.9728 4.1642 4.1642 4.1643 4.1643 5.7269 5.7269 5.7269 5.7269 9.1389 9.1389 9.1389 9.1389 10.4274 10.4275 k = 0.4681 0.4385 0.1520 ( 5020 PWs) bands (ev): -10.6656 -10.6656 -10.6656 -10.6656 -10.5690 -10.5690 -10.5689 -10.5689 -1.4159 -1.4159 -1.4159 -1.4159 -0.3731 -0.3731 -0.3730 -0.3730 0.0137 0.0137 0.0137 0.0137 0.2666 0.2666 0.2666 0.2666 0.3819 0.3819 0.3819 0.3819 1.9046 1.9046 1.9047 1.9047 2.6520 2.6520 2.6520 2.6520 2.7340 2.7340 2.7341 2.7341 3.9650 3.9650 3.9651 3.9651 4.1614 4.1614 4.1614 4.1614 5.7197 5.7197 5.7197 5.7197 9.1496 9.1496 9.1497 9.1497 10.4397 10.4397 k = 0.4574 0.4385 0.1520 ( 5024 PWs) bands (ev): -10.6654 -10.6654 -10.6654 -10.6654 -10.5746 -10.5746 -10.5745 -10.5745 -1.3984 -1.3984 -1.3984 -1.3984 -0.4183 -0.4183 -0.4183 -0.4183 0.0424 0.0424 0.0424 0.0424 0.2973 0.2973 0.2973 0.2973 0.3591 0.3591 0.3591 0.3591 1.8785 1.8785 1.8785 1.8785 2.6766 2.6766 2.6767 2.6767 2.7508 2.7508 2.7508 2.7508 3.9542 3.9542 3.9542 3.9542 4.1575 4.1575 4.1576 4.1576 5.7096 5.7096 5.7097 5.7097 9.1646 9.1646 9.1647 9.1647 10.4569 10.4569 k = 0.4468 0.4385 0.1520 ( 5032 PWs) bands (ev): -10.6652 -10.6652 -10.6651 -10.6651 -10.5817 -10.5817 -10.5816 -10.5816 -1.3760 -1.3760 -1.3760 -1.3760 -0.4651 -0.4651 -0.4651 -0.4651 0.0663 0.0663 0.0664 0.0664 0.3235 0.3235 0.3236 0.3236 0.3451 0.3451 0.3452 0.3452 1.8473 1.8473 1.8474 1.8474 2.7053 2.7053 2.7054 2.7054 2.7720 2.7720 2.7721 2.7721 3.9403 3.9403 3.9403 3.9403 4.1528 4.1528 4.1529 4.1529 5.6967 5.6967 5.6968 5.6968 9.1838 9.1838 9.1838 9.1838 10.4789 10.4789 k = 0.4362 0.4385 0.1520 ( 5040 PWs) bands (ev): -10.6649 -10.6649 -10.6648 -10.6648 -10.5903 -10.5903 -10.5902 -10.5902 -1.3488 -1.3488 -1.3487 -1.3487 -0.5120 -0.5120 -0.5119 -0.5119 0.0854 0.0854 0.0854 0.0854 0.2929 0.2929 0.2929 0.2929 0.3916 0.3916 0.3917 0.3917 1.8122 1.8122 1.8122 1.8122 2.7363 2.7363 2.7364 2.7364 2.7980 2.7980 2.7981 2.7981 3.9235 3.9235 3.9235 3.9235 4.1475 4.1475 4.1475 4.1475 5.6811 5.6811 5.6812 5.6812 9.2071 9.2071 9.2071 9.2071 10.5056 10.5056 k = 0.4255 0.4385 0.1520 ( 5040 PWs) bands (ev): -10.6645 -10.6645 -10.6645 -10.6645 -10.6003 -10.6003 -10.6003 -10.6003 -1.3168 -1.3168 -1.3167 -1.3167 -0.5581 -0.5581 -0.5580 -0.5580 0.1005 0.1005 0.1006 0.1006 0.2539 0.2539 0.2540 0.2540 0.4485 0.4485 0.4486 0.4486 1.7740 1.7740 1.7741 1.7741 2.7679 2.7679 2.7680 2.7680 2.8288 2.8288 2.8289 2.8289 3.9038 3.9038 3.9039 3.9039 4.1416 4.1416 4.1416 4.1416 5.6630 5.6630 5.6630 5.6630 9.2344 9.2344 9.2344 9.2344 10.5370 10.5371 k = 0.4149 0.4385 0.1520 ( 5044 PWs) bands (ev): -10.6642 -10.6642 -10.6641 -10.6641 -10.6117 -10.6117 -10.6117 -10.6117 -1.2801 -1.2801 -1.2800 -1.2800 -0.6029 -0.6029 -0.6028 -0.6028 0.1127 0.1127 0.1128 0.1128 0.2110 0.2110 0.2110 0.2110 0.5106 0.5106 0.5106 0.5106 1.7336 1.7336 1.7336 1.7336 2.7988 2.7988 2.7989 2.7989 2.8645 2.8645 2.8645 2.8645 3.8816 3.8816 3.8817 3.8817 4.1352 4.1352 4.1353 4.1353 5.6424 5.6424 5.6424 5.6424 9.2656 9.2656 9.2656 9.2656 10.5730 10.5731 k = 0.4043 0.4385 0.1520 ( 5056 PWs) bands (ev): -10.6638 -10.6638 -10.6638 -10.6638 -10.6244 -10.6244 -10.6243 -10.6243 -1.2389 -1.2389 -1.2388 -1.2388 -0.6461 -0.6461 -0.6460 -0.6460 0.1208 0.1208 0.1208 0.1208 0.1669 0.1669 0.1670 0.1670 0.5762 0.5762 0.5762 0.5762 1.6915 1.6915 1.6916 1.6916 2.8284 2.8284 2.8285 2.8285 2.9042 2.9042 2.9043 2.9043 3.8570 3.8570 3.8571 3.8571 4.1285 4.1285 4.1286 4.1286 5.6195 5.6195 5.6196 5.6196 9.3004 9.3004 9.3005 9.3005 10.6135 10.6135 k = 0.3936 0.4385 0.1520 ( 5052 PWs) bands (ev): -10.6635 -10.6635 -10.6635 -10.6635 -10.6381 -10.6381 -10.6381 -10.6381 -1.1932 -1.1932 -1.1932 -1.1932 -0.6875 -0.6875 -0.6874 -0.6874 0.1030 0.1030 0.1031 0.1031 0.1446 0.1446 0.1447 0.1447 0.6441 0.6441 0.6441 0.6441 1.6483 1.6483 1.6483 1.6483 2.8568 2.8568 2.8569 2.8569 2.9471 2.9471 2.9471 2.9471 3.8304 3.8304 3.8304 3.8304 4.1216 4.1216 4.1217 4.1217 5.5946 5.5946 5.5947 5.5947 9.3388 9.3388 9.3389 9.3389 10.6582 10.6582 k = 0.3830 0.4385 0.1520 ( 5048 PWs) bands (ev): -10.6639 -10.6639 -10.6638 -10.6638 -10.6523 -10.6523 -10.6523 -10.6523 -1.1433 -1.1433 -1.1433 -1.1433 -0.7268 -0.7268 -0.7268 -0.7268 0.0542 0.0542 0.0542 0.0542 0.1505 0.1505 0.1505 0.1505 0.7135 0.7135 0.7136 0.7136 1.6043 1.6043 1.6043 1.6043 2.8839 2.8839 2.8840 2.8840 2.9920 2.9920 2.9920 2.9920 3.8020 3.8020 3.8020 3.8020 4.1145 4.1145 4.1145 4.1145 5.5679 5.5679 5.5680 5.5680 9.3804 9.3804 9.3804 9.3804 10.7070 10.7070 k = 0.3723 0.4385 0.1520 ( 5052 PWs) bands (ev): -10.6716 -10.6716 -10.6715 -10.6715 -10.6603 -10.6603 -10.6602 -10.6602 -1.0894 -1.0894 -1.0893 -1.0893 -0.7641 -0.7641 -0.7640 -0.7640 -0.0001 -0.0001 -0.0001 -0.0001 0.1595 0.1595 0.1596 0.1596 0.7838 0.7838 0.7839 0.7839 1.5599 1.5599 1.5600 1.5600 2.9098 2.9098 2.9098 2.9098 3.0380 3.0380 3.0381 3.0381 3.7722 3.7722 3.7723 3.7723 4.1072 4.1072 4.1073 4.1073 5.5398 5.5398 5.5398 5.5398 9.4249 9.4249 9.4250 9.4250 10.7597 10.7597 k = 0.3617 0.4385 0.1520 ( 5052 PWs) bands (ev): -10.6878 -10.6878 -10.6877 -10.6877 -10.6606 -10.6606 -10.6606 -10.6606 -1.0317 -1.0317 -1.0316 -1.0316 -0.7989 -0.7989 -0.7989 -0.7989 -0.0565 -0.0565 -0.0565 -0.0565 0.1692 0.1692 0.1692 0.1692 0.8544 0.8544 0.8544 0.8544 1.5154 1.5154 1.5154 1.5154 2.9341 2.9341 2.9342 2.9342 3.0845 3.0845 3.0846 3.0846 3.7415 3.7415 3.7416 3.7416 4.0999 4.0999 4.0999 4.0999 5.5105 5.5105 5.5106 5.5106 9.4721 9.4721 9.4721 9.4721 10.8160 10.8160 k = 0.3511 0.4385 0.1520 ( 5044 PWs) bands (ev): -10.7056 -10.7056 -10.7055 -10.7055 -10.6602 -10.6602 -10.6602 -10.6602 -0.9708 -0.9708 -0.9707 -0.9707 -0.8311 -0.8311 -0.8310 -0.8310 -0.1141 -0.1141 -0.1141 -0.1141 0.1791 0.1791 0.1791 0.1791 0.9247 0.9247 0.9247 0.9247 1.4710 1.4710 1.4711 1.4711 2.9569 2.9569 2.9569 2.9569 3.1310 3.1310 3.1310 3.1310 3.7103 3.7103 3.7104 3.7104 4.0926 4.0926 4.0926 4.0926 5.4806 5.4806 5.4807 5.4807 9.5215 9.5215 9.5216 9.5216 10.8756 10.8756 k = 0.3404 0.4385 0.1520 ( 5048 PWs) bands (ev): -10.7243 -10.7243 -10.7243 -10.7243 -10.6597 -10.6597 -10.6596 -10.6596 -0.9103 -0.9103 -0.9102 -0.9102 -0.8572 -0.8572 -0.8571 -0.8571 -0.1723 -0.1723 -0.1723 -0.1723 0.1892 0.1892 0.1892 0.1892 0.9942 0.9942 0.9942 0.9942 1.4270 1.4270 1.4271 1.4271 2.9778 2.9778 2.9778 2.9778 3.1766 3.1766 3.1766 3.1766 3.6791 3.6791 3.6792 3.6792 4.0853 4.0853 4.0854 4.0854 5.4504 5.4504 5.4505 5.4505 9.5728 9.5728 9.5728 9.5728 10.9381 10.9381 k = 0.3298 0.4385 0.1520 ( 5036 PWs) bands (ev): -10.7437 -10.7437 -10.7437 -10.7437 -10.6590 -10.6590 -10.6590 -10.6590 -0.8981 -0.8981 -0.8980 -0.8980 -0.8298 -0.8298 -0.8297 -0.8297 -0.2304 -0.2304 -0.2304 -0.2304 0.1994 0.1994 0.1995 0.1995 1.0623 1.0623 1.0624 1.0624 1.3838 1.3838 1.3838 1.3838 2.9967 2.9967 2.9967 2.9967 3.2206 3.2206 3.2207 3.2207 3.6487 3.6487 3.6488 3.6488 4.0782 4.0782 4.0783 4.0783 5.4204 5.4204 5.4205 5.4205 9.6255 9.6255 9.6256 9.6256 11.0031 11.0031 k = 0.3191 0.4385 0.1520 ( 5036 PWs) bands (ev): -10.7638 -10.7638 -10.7637 -10.7637 -10.6584 -10.6584 -10.6583 -10.6583 -0.9213 -0.9213 -0.9212 -0.9212 -0.7624 -0.7624 -0.7624 -0.7624 -0.2875 -0.2875 -0.2874 -0.2874 0.2098 0.2098 0.2098 0.2098 1.1282 1.1282 1.1282 1.1282 1.3420 1.3420 1.3420 1.3420 3.0133 3.0133 3.0134 3.0134 3.2621 3.2621 3.2621 3.2621 3.6201 3.6201 3.6201 3.6201 4.0714 4.0714 4.0714 4.0714 5.3911 5.3911 5.3912 5.3912 9.6792 9.6792 9.6793 9.6793 11.0699 11.0699 k = 0.3085 0.4385 0.1520 ( 5024 PWs) bands (ev): -10.7843 -10.7843 -10.7842 -10.7842 -10.6577 -10.6577 -10.6576 -10.6576 -0.9445 -0.9445 -0.9445 -0.9445 -0.6922 -0.6922 -0.6922 -0.6922 -0.3417 -0.3417 -0.3417 -0.3417 0.2202 0.2202 0.2203 0.2203 1.1889 1.1889 1.1889 1.1889 1.3041 1.3041 1.3041 1.3041 3.0276 3.0276 3.0277 3.0277 3.2994 3.2994 3.2995 3.2995 3.5947 3.5947 3.5948 3.5948 4.0649 4.0649 4.0650 4.0650 5.3630 5.3630 5.3631 5.3631 9.7334 9.7334 9.7335 9.7335 11.1381 11.1381 k = 0.2979 0.4385 0.1520 ( 5032 PWs) bands (ev): -10.8052 -10.8052 -10.8051 -10.8051 -10.6570 -10.6570 -10.6570 -10.6570 -0.9660 -0.9660 -0.9659 -0.9659 -0.6259 -0.6259 -0.6258 -0.6258 -0.3883 -0.3883 -0.3882 -0.3882 0.2307 0.2307 0.2307 0.2307 1.2242 1.2242 1.2242 1.2242 1.2900 1.2900 1.2901 1.2901 3.0393 3.0393 3.0393 3.0393 3.3300 3.3300 3.3300 3.3300 3.5751 3.5751 3.5752 3.5752 4.0588 4.0588 4.0589 4.0589 5.3366 5.3366 5.3367 5.3367 9.7877 9.7877 9.7877 9.7877 11.2068 11.2068 k = 0.2872 0.4385 0.1520 ( 5028 PWs) bands (ev): -10.8264 -10.8264 -10.8263 -10.8263 -10.6563 -10.6563 -10.6563 -10.6563 -0.9854 -0.9854 -0.9853 -0.9853 -0.5807 -0.5807 -0.5807 -0.5807 -0.4099 -0.4099 -0.4099 -0.4099 0.2412 0.2412 0.2412 0.2412 1.2018 1.2018 1.2019 1.2019 1.3319 1.3319 1.3319 1.3319 3.0483 3.0483 3.0484 3.0484 3.3500 3.3500 3.3500 3.3500 3.5651 3.5651 3.5652 3.5652 4.0534 4.0534 4.0535 4.0535 5.3125 5.3125 5.3126 5.3126 9.8415 9.8415 9.8415 9.8415 11.2751 11.2751 k = 0.2766 0.4385 0.1520 ( 5020 PWs) bands (ev): -10.8477 -10.8477 -10.8477 -10.8477 -10.6556 -10.6556 -10.6556 -10.6556 -1.0026 -1.0026 -1.0025 -1.0025 -0.5856 -0.5856 -0.5855 -0.5855 -0.3780 -0.3780 -0.3779 -0.3779 0.2515 0.2515 0.2516 0.2516 1.1653 1.1653 1.1653 1.1653 1.3858 1.3858 1.3859 1.3859 3.0546 3.0546 3.0546 3.0546 3.3560 3.3560 3.3561 3.3561 3.5679 3.5679 3.5680 3.5680 4.0487 4.0487 4.0488 4.0488 5.2912 5.2912 5.2913 5.2913 9.8943 9.8943 9.8943 9.8943 11.3421 11.3421 k = 0.2660 0.4385 0.1520 ( 5028 PWs) bands (ev): -10.8691 -10.8691 -10.8691 -10.8691 -10.6549 -10.6549 -10.6549 -10.6549 -1.0178 -1.0178 -1.0177 -1.0177 -0.6243 -0.6243 -0.6243 -0.6243 -0.3086 -0.3086 -0.3085 -0.3085 0.2617 0.2617 0.2617 0.2617 1.1274 1.1274 1.1275 1.1275 1.4388 1.4388 1.4388 1.4388 3.0580 3.0580 3.0580 3.0580 3.3486 3.3486 3.3487 3.3487 3.5828 3.5828 3.5829 3.5829 4.0450 4.0450 4.0450 4.0450 5.2732 5.2732 5.2733 5.2733 9.9456 9.9456 9.9456 9.9456 11.4065 11.4065 k = 0.2553 0.4385 0.1520 ( 5012 PWs) bands (ev): -10.8905 -10.8905 -10.8905 -10.8905 -10.6542 -10.6542 -10.6542 -10.6542 -1.0308 -1.0308 -1.0308 -1.0308 -0.6729 -0.6729 -0.6729 -0.6729 -0.2257 -0.2257 -0.2257 -0.2257 0.2717 0.2717 0.2717 0.2717 1.0900 1.0900 1.0901 1.0901 1.4887 1.4887 1.4888 1.4888 3.0585 3.0585 3.0585 3.0585 3.3319 3.3319 3.3319 3.3319 3.6057 3.6057 3.6058 3.6058 4.0423 4.0423 4.0424 4.0424 5.2591 5.2591 5.2591 5.2591 9.9950 9.9950 9.9950 9.9950 11.4670 11.4670 k = 0.2447 0.4385 0.1520 ( 5016 PWs) bands (ev): -10.9118 -10.9118 -10.9117 -10.9117 -10.6536 -10.6536 -10.6535 -10.6535 -1.0420 -1.0420 -1.0419 -1.0419 -0.7239 -0.7239 -0.7239 -0.7239 -0.1370 -0.1370 -0.1369 -0.1369 0.2814 0.2814 0.2814 0.2814 1.0535 1.0535 1.0535 1.0535 1.5351 1.5351 1.5352 1.5352 3.0560 3.0560 3.0560 3.0560 3.3096 3.3096 3.3097 3.3097 3.6322 3.6322 3.6323 3.6323 4.0409 4.0409 4.0410 4.0410 5.2492 5.2492 5.2492 5.2492 10.0420 10.0420 10.0420 10.0420 11.5222 11.5222 k = 0.2340 0.4385 0.1520 ( 5016 PWs) bands (ev): -10.9329 -10.9329 -10.9328 -10.9328 -10.6529 -10.6529 -10.6528 -10.6528 -1.0513 -1.0513 -1.0512 -1.0512 -0.7750 -0.7750 -0.7750 -0.7750 -0.0447 -0.0447 -0.0447 -0.0447 0.2907 0.2907 0.2908 0.2908 1.0180 1.0180 1.0181 1.0181 1.5776 1.5776 1.5777 1.5777 3.0506 3.0506 3.0506 3.0506 3.2845 3.2845 3.2846 3.2846 3.6596 3.6596 3.6597 3.6597 4.0410 4.0410 4.0411 4.0411 5.2438 5.2438 5.2439 5.2439 10.0862 10.0862 10.0862 10.0862 11.5707 11.5707 k = 0.2234 0.4385 0.1520 ( 5008 PWs) bands (ev): -10.9536 -10.9536 -10.9536 -10.9536 -10.6522 -10.6522 -10.6522 -10.6522 -1.0588 -1.0588 -1.0587 -1.0587 -0.8252 -0.8252 -0.8251 -0.8251 0.0499 0.0499 0.0500 0.0500 0.2997 0.2997 0.2998 0.2998 0.9838 0.9838 0.9839 0.9839 1.6160 1.6160 1.6161 1.6161 3.0422 3.0422 3.0423 3.0423 3.2578 3.2578 3.2579 3.2579 3.6862 3.6862 3.6862 3.6862 4.0428 4.0428 4.0428 4.0428 5.2435 5.2435 5.2435 5.2435 10.1272 10.1272 10.1272 10.1272 11.6111 11.6111 k = 0.2128 0.4385 0.1520 ( 4992 PWs) bands (ev): -10.9740 -10.9740 -10.9740 -10.9740 -10.6516 -10.6516 -10.6516 -10.6516 -1.0648 -1.0648 -1.0647 -1.0647 -0.8737 -0.8737 -0.8737 -0.8737 0.1461 0.1461 0.1461 0.1461 0.3086 0.3086 0.3086 0.3086 0.9510 0.9510 0.9510 0.9510 1.6503 1.6503 1.6504 1.6504 3.0310 3.0310 3.0311 3.0311 3.2302 3.2302 3.2302 3.2302 3.7109 3.7109 3.7110 3.7110 4.0464 4.0464 4.0465 4.0465 5.2482 5.2482 5.2482 5.2482 10.1647 10.1647 10.1647 10.1647 11.6421 11.6421 k = 0.2021 0.4385 0.1520 ( 5000 PWs) bands (ev): -10.9939 -10.9939 -10.9939 -10.9939 -10.6510 -10.6510 -10.6510 -10.6510 -1.0697 -1.0697 -1.0696 -1.0696 -0.9202 -0.9202 -0.9202 -0.9202 0.2419 0.2419 0.2420 0.2420 0.3185 0.3185 0.3186 0.3186 0.9196 0.9196 0.9196 0.9196 1.6806 1.6806 1.6806 1.6806 3.0169 3.0169 3.0170 3.0170 3.2018 3.2018 3.2019 3.2019 3.7332 3.7332 3.7333 3.7333 4.0520 4.0520 4.0521 4.0521 5.2580 5.2580 5.2580 5.2580 10.1984 10.1984 10.1985 10.1985 11.6631 11.6631 k = 0.1915 0.4385 0.1520 ( 4992 PWs) bands (ev): -11.0133 -11.0133 -11.0132 -11.0132 -10.6504 -10.6504 -10.6504 -10.6504 -1.0741 -1.0741 -1.0741 -1.0741 -0.9637 -0.9637 -0.9637 -0.9637 0.3113 0.3113 0.3113 0.3113 0.3554 0.3554 0.3554 0.3554 0.8898 0.8898 0.8898 0.8898 1.7070 1.7070 1.7070 1.7070 3.0000 3.0000 3.0001 3.0001 3.1731 3.1731 3.1731 3.1731 3.7528 3.7528 3.7529 3.7529 4.0596 4.0596 4.0597 4.0597 5.2729 5.2729 5.2730 5.2730 10.2282 10.2282 10.2283 10.2283 11.6737 11.6738 k = 0.1809 0.4385 0.1520 ( 4992 PWs) bands (ev): -11.0320 -11.0320 -11.0320 -11.0320 -10.6499 -10.6499 -10.6499 -10.6499 -1.0801 -1.0801 -1.0800 -1.0800 -1.0024 -1.0024 -1.0023 -1.0023 0.3240 0.3240 0.3240 0.3240 0.4486 0.4486 0.4486 0.4486 0.8619 0.8619 0.8619 0.8619 1.7297 1.7297 1.7297 1.7297 2.9803 2.9803 2.9803 2.9803 3.1439 3.1439 3.1440 3.1440 3.7695 3.7695 3.7696 3.7696 4.0691 4.0691 4.0692 4.0692 5.2928 5.2928 5.2929 5.2929 10.2540 10.2540 10.2541 10.2541 11.6742 11.6742 k = 0.1702 0.4385 0.1520 ( 4992 PWs) bands (ev): -11.0501 -11.0501 -11.0501 -11.0501 -10.6494 -10.6494 -10.6493 -10.6493 -1.0926 -1.0926 -1.0926 -1.0926 -1.0310 -1.0310 -1.0310 -1.0310 0.3304 0.3304 0.3304 0.3304 0.5471 0.5471 0.5471 0.5471 0.8364 0.8364 0.8364 0.8364 1.7490 1.7490 1.7490 1.7490 2.9576 2.9576 2.9577 2.9577 3.1146 3.1146 3.1146 3.1146 3.7835 3.7835 3.7835 3.7835 4.0803 4.0803 4.0804 4.0804 5.3173 5.3173 5.3174 5.3174 10.2757 10.2757 10.2758 10.2758 11.6653 11.6653 k = 0.1596 0.4385 0.1520 ( 4992 PWs) bands (ev): -11.0674 -11.0674 -11.0674 -11.0674 -10.6489 -10.6489 -10.6488 -10.6488 -1.1170 -1.1170 -1.1170 -1.1170 -1.0445 -1.0445 -1.0444 -1.0444 0.3352 0.3352 0.3352 0.3352 0.6435 0.6435 0.6436 0.6436 0.8156 0.8156 0.8157 0.8157 1.7653 1.7653 1.7653 1.7653 2.9320 2.9320 2.9320 2.9320 3.0852 3.0852 3.0853 3.0853 3.7948 3.7948 3.7949 3.7949 4.0928 4.0928 4.0929 4.0929 5.3460 5.3460 5.3461 5.3461 10.2934 10.2934 10.2935 10.2935 11.6481 11.6481 k = 0.1489 0.4385 0.1520 ( 4988 PWs) bands (ev): -11.0839 -11.0839 -11.0838 -11.0838 -10.6484 -10.6484 -10.6484 -10.6484 -1.1484 -1.1484 -1.1484 -1.1484 -1.0476 -1.0476 -1.0475 -1.0475 0.3389 0.3389 0.3390 0.3390 0.7229 0.7229 0.7230 0.7230 0.8138 0.8138 0.8139 0.8139 1.7789 1.7789 1.7789 1.7789 2.9032 2.9032 2.9033 2.9033 3.0561 3.0561 3.0561 3.0561 3.8039 3.8039 3.8039 3.8039 4.1063 4.1063 4.1064 4.1064 5.3783 5.3783 5.3784 5.3784 10.3072 10.3072 10.3073 10.3073 11.6239 11.6239 k = 0.1383 0.4385 0.1520 ( 4980 PWs) bands (ev): -11.0995 -11.0995 -11.0994 -11.0994 -10.6480 -10.6480 -10.6479 -10.6479 -1.1810 -1.1810 -1.1810 -1.1810 -1.0462 -1.0462 -1.0462 -1.0462 0.3417 0.3417 0.3418 0.3418 0.7396 0.7396 0.7396 0.7396 0.8763 0.8763 0.8763 0.8763 1.7902 1.7902 1.7902 1.7902 2.8710 2.8710 2.8711 2.8711 3.0275 3.0275 3.0275 3.0275 3.8110 3.8110 3.8111 3.8111 4.1203 4.1203 4.1204 4.1204 5.4137 5.4137 5.4138 5.4138 10.3174 10.3174 10.3174 10.3174 11.5943 11.5943 k = 0.1277 0.4385 0.1520 ( 4980 PWs) bands (ev): -11.1141 -11.1141 -11.1141 -11.1141 -10.6476 -10.6476 -10.6476 -10.6476 -1.2126 -1.2126 -1.2126 -1.2126 -1.0428 -1.0428 -1.0428 -1.0428 0.3437 0.3437 0.3437 0.3437 0.7261 0.7261 0.7262 0.7262 0.9701 0.9701 0.9702 0.9702 1.7995 1.7995 1.7995 1.7995 2.8353 2.8353 2.8354 2.8354 2.9998 2.9998 2.9999 2.9999 3.8166 3.8166 3.8167 3.8167 4.1345 4.1345 4.1345 4.1345 5.4513 5.4513 5.4514 5.4514 10.3241 10.3241 10.3241 10.3241 11.5608 11.5608 k = 0.1170 0.4385 0.1520 ( 4976 PWs) bands (ev): -11.1278 -11.1278 -11.1278 -11.1278 -10.6472 -10.6472 -10.6472 -10.6472 -1.2424 -1.2424 -1.2423 -1.2423 -1.0382 -1.0382 -1.0381 -1.0381 0.3448 0.3448 0.3448 0.3448 0.7091 0.7091 0.7091 0.7091 1.0686 1.0686 1.0686 1.0686 1.8073 1.8073 1.8073 1.8073 2.7959 2.7959 2.7960 2.7960 2.9733 2.9733 2.9734 2.9734 3.8209 3.8209 3.8210 3.8210 4.1484 4.1484 4.1485 4.1485 5.4904 5.4904 5.4905 5.4905 10.3277 10.3277 10.3278 10.3278 11.5248 11.5248 k = 0.1064 0.4385 0.1520 ( 4976 PWs) bands (ev): -11.1405 -11.1405 -11.1404 -11.1404 -10.6469 -10.6469 -10.6468 -10.6468 -1.2700 -1.2700 -1.2700 -1.2700 -1.0328 -1.0328 -1.0328 -1.0328 0.3453 0.3453 0.3453 0.3453 0.6923 0.6923 0.6924 0.6924 1.1674 1.1674 1.1675 1.1675 1.8138 1.8138 1.8139 1.8139 2.7527 2.7527 2.7528 2.7528 2.9483 2.9483 2.9484 2.9484 3.8242 3.8242 3.8242 3.8242 4.1618 4.1618 4.1618 4.1618 5.5302 5.5302 5.5302 5.5302 10.3286 10.3286 10.3287 10.3287 11.4876 11.4876 k = 0.0957 0.4385 0.1520 ( 4976 PWs) bands (ev): -11.1520 -11.1520 -11.1520 -11.1520 -10.6466 -10.6466 -10.6465 -10.6465 -1.2953 -1.2953 -1.2952 -1.2952 -1.0271 -1.0271 -1.0270 -1.0270 0.3451 0.3451 0.3451 0.3451 0.6766 0.6766 0.6767 0.6767 1.2655 1.2655 1.2656 1.2656 1.8194 1.8194 1.8194 1.8194 2.7058 2.7058 2.7058 2.7058 2.9251 2.9251 2.9251 2.9251 3.8267 3.8267 3.8267 3.8267 4.1744 4.1744 4.1745 4.1745 5.5696 5.5696 5.5697 5.5697 10.3273 10.3273 10.3274 10.3274 11.4504 11.4504 k = 0.0851 0.4385 0.1520 ( 4992 PWs) bands (ev): -11.1625 -11.1625 -11.1624 -11.1624 -10.6463 -10.6463 -10.6463 -10.6463 -1.3181 -1.3181 -1.3180 -1.3180 -1.0213 -1.0213 -1.0212 -1.0212 0.3444 0.3444 0.3444 0.3444 0.6624 0.6624 0.6624 0.6624 1.3623 1.3623 1.3623 1.3623 1.8244 1.8244 1.8244 1.8244 2.6552 2.6552 2.6553 2.6553 2.9036 2.9036 2.9037 2.9037 3.8286 3.8286 3.8286 3.8286 4.1861 4.1861 4.1861 4.1861 5.6080 5.6080 5.6080 5.6080 10.3242 10.3242 10.3242 10.3242 11.4144 11.4144 k = 0.0745 0.4385 0.1520 ( 5000 PWs) bands (ev): -11.1718 -11.1718 -11.1717 -11.1717 -10.6461 -10.6461 -10.6460 -10.6460 -1.3383 -1.3383 -1.3383 -1.3383 -1.0155 -1.0155 -1.0154 -1.0154 0.3434 0.3434 0.3434 0.3434 0.6496 0.6496 0.6496 0.6496 1.4570 1.4570 1.4570 1.4570 1.8290 1.8290 1.8291 1.8291 2.6012 2.6012 2.6013 2.6013 2.8842 2.8842 2.8843 2.8843 3.8300 3.8300 3.8300 3.8300 4.1967 4.1967 4.1967 4.1967 5.6443 5.6443 5.6444 5.6444 10.3198 10.3198 10.3198 10.3198 11.3805 11.3805 k = 0.0638 0.4385 0.1520 ( 4992 PWs) bands (ev): -11.1799 -11.1799 -11.1799 -11.1799 -10.6459 -10.6459 -10.6458 -10.6458 -1.3559 -1.3559 -1.3559 -1.3559 -1.0100 -1.0100 -1.0100 -1.0100 0.3421 0.3421 0.3421 0.3421 0.6385 0.6385 0.6385 0.6385 1.5488 1.5488 1.5489 1.5489 1.8340 1.8340 1.8340 1.8340 2.5440 2.5440 2.5441 2.5441 2.8671 2.8671 2.8671 2.8671 3.8310 3.8310 3.8311 3.8311 4.2060 4.2060 4.2061 4.2061 5.6778 5.6778 5.6779 5.6779 10.3145 10.3145 10.3146 10.3146 11.3495 11.3496 k = 0.0532 0.4385 0.1520 ( 4996 PWs) bands (ev): -11.1868 -11.1868 -11.1868 -11.1868 -10.6457 -10.6457 -10.6457 -10.6457 -1.3709 -1.3709 -1.3709 -1.3709 -1.0051 -1.0051 -1.0050 -1.0050 0.3407 0.3407 0.3408 0.3408 0.6290 0.6290 0.6290 0.6290 1.6362 1.6362 1.6363 1.6363 1.8403 1.8403 1.8403 1.8403 2.4839 2.4839 2.4840 2.4840 2.8522 2.8522 2.8523 2.8523 3.8318 3.8318 3.8319 3.8319 4.2140 4.2140 4.2141 4.2141 5.7077 5.7077 5.7078 5.7078 10.3091 10.3091 10.3091 10.3091 11.3222 11.3222 k = 0.0426 0.4385 0.1520 ( 4996 PWs) bands (ev): -11.1925 -11.1925 -11.1925 -11.1925 -10.6456 -10.6456 -10.6455 -10.6455 -1.3832 -1.3832 -1.3832 -1.3832 -1.0008 -1.0008 -1.0007 -1.0007 0.3394 0.3394 0.3394 0.3394 0.6212 0.6212 0.6213 0.6213 1.7151 1.7151 1.7152 1.7152 1.8515 1.8515 1.8515 1.8515 2.4216 2.4216 2.4216 2.4216 2.8398 2.8398 2.8399 2.8399 3.8323 3.8323 3.8324 3.8324 4.2207 4.2207 4.2207 4.2207 5.7332 5.7332 5.7333 5.7333 10.3038 10.3038 10.3038 10.3038 11.2990 11.2991 k = 0.0319 0.4385 0.1520 ( 4996 PWs) bands (ev): -11.1970 -11.1970 -11.1969 -11.1969 -10.6455 -10.6455 -10.6454 -10.6454 -1.3928 -1.3928 -1.3928 -1.3928 -0.9973 -0.9973 -0.9972 -0.9972 0.3382 0.3382 0.3383 0.3383 0.6151 0.6151 0.6152 0.6152 1.7741 1.7741 1.7741 1.7741 1.8777 1.8777 1.8778 1.8778 2.3580 2.3580 2.3581 2.3581 2.8300 2.8300 2.8301 2.8301 3.8327 3.8327 3.8328 3.8328 4.2259 4.2259 4.2259 4.2259 5.7538 5.7538 5.7538 5.7538 10.2992 10.2992 10.2992 10.2992 11.2805 11.2806 k = 0.0213 0.4385 0.1520 ( 5000 PWs) bands (ev): -11.2002 -11.2002 -11.2001 -11.2001 -10.6454 -10.6454 -10.6453 -10.6453 -1.3997 -1.3997 -1.3997 -1.3997 -0.9947 -0.9947 -0.9946 -0.9946 0.3373 0.3373 0.3373 0.3373 0.6108 0.6108 0.6108 0.6108 1.8018 1.8018 1.8018 1.8018 1.9278 1.9278 1.9278 1.9278 2.2957 2.2957 2.2958 2.2958 2.8229 2.8229 2.8230 2.8230 3.8330 3.8330 3.8330 3.8330 4.2296 4.2296 4.2297 4.2297 5.7688 5.7688 5.7689 5.7689 10.2956 10.2956 10.2956 10.2956 11.2671 11.2671 k = 0.0106 0.4385 0.1520 ( 5000 PWs) bands (ev): -11.2021 -11.2021 -11.2020 -11.2020 -10.6453 -10.6453 -10.6453 -10.6453 -1.4038 -1.4038 -1.4038 -1.4038 -0.9931 -0.9931 -0.9930 -0.9930 0.3367 0.3367 0.3368 0.3368 0.6082 0.6082 0.6082 0.6082 1.8112 1.8112 1.8112 1.8112 1.9814 1.9814 1.9815 1.9815 2.2421 2.2421 2.2421 2.2421 2.8186 2.8186 2.8187 2.8187 3.8331 3.8331 3.8332 3.8332 4.2319 4.2319 4.2319 4.2319 5.7780 5.7780 5.7781 5.7781 10.2933 10.2933 10.2934 10.2934 11.2589 11.2590 k = 0.0000 0.4385 0.1520 ( 5012 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4052 -1.4052 -1.4052 -1.4052 -0.9926 -0.9926 -0.9925 -0.9925 0.3365 0.3365 0.3365 0.3365 0.6073 0.6073 0.6073 0.6073 1.8135 1.8135 1.8135 1.8135 2.0068 2.0068 2.0069 2.0069 2.2174 2.2174 2.2175 2.2175 2.8172 2.8172 2.8173 2.8173 3.8331 3.8331 3.8332 3.8332 4.2326 4.2326 4.2327 4.2327 5.7811 5.7811 5.7812 5.7812 10.2925 10.2925 10.2926 10.2926 11.2562 11.2562 k = 0.0000 0.4385 0.1520 ( 5012 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4052 -1.4052 -1.4052 -1.4052 -0.9926 -0.9926 -0.9925 -0.9925 0.3365 0.3365 0.3365 0.3365 0.6073 0.6073 0.6073 0.6073 1.8135 1.8135 1.8135 1.8135 2.0068 2.0068 2.0069 2.0069 2.2174 2.2174 2.2175 2.2175 2.8172 2.8172 2.8173 2.8173 3.8331 3.8331 3.8332 3.8332 4.2326 4.2326 4.2327 4.2327 5.7811 5.7811 5.7812 5.7812 10.2925 10.2925 10.2926 10.2926 11.2562 11.2562 k = 0.0000 0.4280 0.1520 ( 5008 PWs) bands (ev): -11.2030 -11.2030 -11.2030 -11.2030 -10.6453 -10.6453 -10.6453 -10.6453 -1.4051 -1.4051 -1.4050 -1.4050 -0.9926 -0.9926 -0.9925 -0.9925 0.3378 0.3378 0.3378 0.3378 0.6076 0.6076 0.6076 0.6076 1.8138 1.8138 1.8139 1.8139 2.0067 2.0067 2.0067 2.0067 2.2175 2.2175 2.2176 2.2176 2.8174 2.8174 2.8175 2.8175 3.8328 3.8328 3.8329 3.8329 4.2321 4.2321 4.2321 4.2321 5.7810 5.7810 5.7811 5.7811 10.2913 10.2913 10.2913 10.2913 11.2585 11.2585 k = 0.0000 0.4176 0.1520 ( 5006 PWs) bands (ev): -11.2039 -11.2039 -11.2039 -11.2039 -10.6454 -10.6454 -10.6453 -10.6453 -1.4046 -1.4046 -1.4045 -1.4045 -0.9926 -0.9926 -0.9925 -0.9925 0.3415 0.3415 0.3415 0.3415 0.6084 0.6084 0.6085 0.6085 1.8148 1.8148 1.8148 1.8148 2.0062 2.0062 2.0062 2.0062 2.2176 2.2176 2.2177 2.2177 2.8180 2.8180 2.8181 2.8181 3.8318 3.8318 3.8319 3.8319 4.2303 4.2303 4.2304 4.2304 5.7809 5.7809 5.7810 5.7810 10.2876 10.2876 10.2876 10.2876 11.2653 11.2653 k = 0.0000 0.4072 0.1520 ( 5002 PWs) bands (ev): -11.2054 -11.2054 -11.2054 -11.2054 -10.6455 -10.6455 -10.6454 -10.6454 -1.4038 -1.4038 -1.4037 -1.4037 -0.9926 -0.9926 -0.9925 -0.9925 0.3477 0.3477 0.3477 0.3477 0.6098 0.6098 0.6099 0.6099 1.8164 1.8164 1.8165 1.8165 2.0053 2.0053 2.0054 2.0054 2.2179 2.2179 2.2180 2.2180 2.8191 2.8191 2.8191 2.8191 3.8301 3.8301 3.8302 3.8302 4.2275 4.2275 4.2275 4.2275 5.7807 5.7807 5.7808 5.7808 10.2814 10.2814 10.2814 10.2814 11.2765 11.2765 k = 0.0000 0.3967 0.1520 ( 5004 PWs) bands (ev): -11.2075 -11.2075 -11.2075 -11.2075 -10.6456 -10.6456 -10.6455 -10.6455 -1.4027 -1.4027 -1.4026 -1.4026 -0.9926 -0.9926 -0.9926 -0.9926 0.3562 0.3562 0.3563 0.3563 0.6119 0.6119 0.6120 0.6120 1.8187 1.8187 1.8187 1.8187 2.0042 2.0042 2.0043 2.0043 2.2183 2.2183 2.2184 2.2184 2.8205 2.8205 2.8206 2.8206 3.8277 3.8277 3.8278 3.8278 4.2236 4.2236 4.2236 4.2236 5.7805 5.7805 5.7805 5.7805 10.2729 10.2729 10.2729 10.2729 11.2919 11.2919 k = 0.0000 0.3863 0.1520 ( 5002 PWs) bands (ev): -11.2102 -11.2102 -11.2101 -11.2101 -10.6457 -10.6457 -10.6457 -10.6457 -1.4013 -1.4013 -1.4012 -1.4012 -0.9927 -0.9927 -0.9926 -0.9926 0.3670 0.3670 0.3671 0.3671 0.6148 0.6148 0.6148 0.6148 1.8215 1.8215 1.8215 1.8215 2.0028 2.0028 2.0029 2.0029 2.2188 2.2188 2.2189 2.2189 2.8223 2.8223 2.8223 2.8223 3.8246 3.8246 3.8247 3.8247 4.2187 4.2187 4.2188 4.2188 5.7801 5.7801 5.7802 5.7802 10.2621 10.2621 10.2622 10.2622 11.3112 11.3112 k = 0.0000 0.3758 0.1520 ( 5006 PWs) bands (ev): -11.2134 -11.2134 -11.2134 -11.2134 -10.6459 -10.6459 -10.6459 -10.6459 -1.3996 -1.3996 -1.3995 -1.3995 -0.9927 -0.9927 -0.9926 -0.9926 0.3799 0.3799 0.3800 0.3800 0.6185 0.6185 0.6186 0.6186 1.8248 1.8248 1.8248 1.8248 2.0012 2.0012 2.0012 2.0012 2.2194 2.2194 2.2195 2.2195 2.8244 2.8244 2.8245 2.8245 3.8208 3.8208 3.8209 3.8209 4.2129 4.2129 4.2130 4.2130 5.7797 5.7797 5.7798 5.7798 10.2492 10.2492 10.2492 10.2492 11.3340 11.3340 k = 0.0000 0.3654 0.1520 ( 5012 PWs) bands (ev): -11.2171 -11.2171 -11.2171 -11.2171 -10.6462 -10.6462 -10.6461 -10.6461 -1.3977 -1.3977 -1.3976 -1.3976 -0.9928 -0.9928 -0.9927 -0.9927 0.3948 0.3948 0.3948 0.3948 0.6233 0.6233 0.6234 0.6234 1.8286 1.8286 1.8286 1.8286 1.9993 1.9993 1.9994 1.9994 2.2201 2.2201 2.2201 2.2201 2.8269 2.8269 2.8269 2.8269 3.8163 3.8163 3.8163 3.8163 4.2063 4.2063 4.2064 4.2064 5.7792 5.7792 5.7793 5.7793 10.2343 10.2343 10.2343 10.2343 11.3599 11.3599 k = 0.0000 0.3550 0.1520 ( 5008 PWs) bands (ev): -11.2214 -11.2214 -11.2213 -11.2213 -10.6464 -10.6464 -10.6464 -10.6464 -1.3956 -1.3956 -1.3955 -1.3955 -0.9928 -0.9928 -0.9928 -0.9928 0.4112 0.4112 0.4112 0.4112 0.6294 0.6294 0.6295 0.6295 1.8328 1.8328 1.8328 1.8328 1.9973 1.9973 1.9974 1.9974 2.2209 2.2209 2.2210 2.2210 2.8297 2.8297 2.8298 2.8298 3.8109 3.8109 3.8110 3.8110 4.1991 4.1991 4.1992 4.1992 5.7787 5.7787 5.7787 5.7787 10.2174 10.2174 10.2175 10.2175 11.3882 11.3882 k = 0.0000 0.3445 0.1520 ( 5004 PWs) bands (ev): -11.2261 -11.2261 -11.2260 -11.2260 -10.6468 -10.6468 -10.6467 -10.6467 -1.3932 -1.3932 -1.3932 -1.3932 -0.9929 -0.9929 -0.9928 -0.9928 0.4289 0.4289 0.4289 0.4289 0.6372 0.6372 0.6372 0.6372 1.8373 1.8373 1.8373 1.8373 1.9952 1.9952 1.9952 1.9952 2.2218 2.2218 2.2219 2.2219 2.8328 2.8328 2.8328 2.8328 3.8048 3.8048 3.8048 3.8048 4.1914 4.1914 4.1914 4.1914 5.7781 5.7781 5.7781 5.7781 10.1988 10.1988 10.1988 10.1988 11.4182 11.4182 k = 0.0000 0.3341 0.1520 ( 5008 PWs) bands (ev): -11.2312 -11.2312 -11.2312 -11.2312 -10.6472 -10.6472 -10.6471 -10.6471 -1.3908 -1.3908 -1.3907 -1.3907 -0.9930 -0.9930 -0.9929 -0.9929 0.4474 0.4474 0.4475 0.4475 0.6469 0.6469 0.6470 0.6470 1.8421 1.8421 1.8421 1.8421 1.9930 1.9930 1.9931 1.9931 2.2228 2.2228 2.2229 2.2229 2.8361 2.8361 2.8361 2.8361 3.7978 3.7978 3.7978 3.7978 4.1832 4.1832 4.1833 4.1833 5.7774 5.7774 5.7775 5.7775 10.1784 10.1784 10.1785 10.1785 11.4492 11.4492 k = 0.0000 0.3236 0.1520 ( 5008 PWs) bands (ev): -11.2368 -11.2368 -11.2367 -11.2367 -10.6476 -10.6476 -10.6476 -10.6476 -1.3882 -1.3882 -1.3881 -1.3881 -0.9931 -0.9931 -0.9930 -0.9930 0.4662 0.4662 0.4663 0.4663 0.6592 0.6592 0.6592 0.6592 1.8469 1.8469 1.8470 1.8470 1.9909 1.9909 1.9910 1.9910 2.2239 2.2239 2.2240 2.2240 2.8396 2.8396 2.8397 2.8397 3.7899 3.7899 3.7900 3.7900 4.1748 4.1748 4.1749 4.1749 5.7767 5.7767 5.7768 5.7768 10.1565 10.1565 10.1566 10.1566 11.4801 11.4801 k = 0.0000 0.3132 0.1520 ( 5002 PWs) bands (ev): -11.2426 -11.2426 -11.2426 -11.2426 -10.6482 -10.6482 -10.6481 -10.6481 -1.3855 -1.3855 -1.3855 -1.3855 -0.9932 -0.9932 -0.9931 -0.9931 0.4848 0.4848 0.4848 0.4848 0.6744 0.6744 0.6744 0.6744 1.8519 1.8519 1.8519 1.8519 1.9889 1.9889 1.9890 1.9890 2.2251 2.2251 2.2252 2.2252 2.8434 2.8434 2.8435 2.8435 3.7811 3.7811 3.7812 3.7812 4.1664 4.1664 4.1664 4.1664 5.7759 5.7759 5.7760 5.7760 10.1331 10.1331 10.1331 10.1331 11.5096 11.5096 k = 0.0000 0.3028 0.1520 ( 5010 PWs) bands (ev): -11.2489 -11.2489 -11.2488 -11.2488 -10.6487 -10.6487 -10.6487 -10.6487 -1.3828 -1.3828 -1.3827 -1.3827 -0.9933 -0.9933 -0.9932 -0.9932 0.5024 0.5024 0.5025 0.5025 0.6931 0.6931 0.6932 0.6932 1.8567 1.8567 1.8567 1.8567 1.9871 1.9871 1.9872 1.9872 2.2264 2.2264 2.2265 2.2265 2.8473 2.8473 2.8474 2.8474 3.7714 3.7714 3.7715 3.7715 4.1580 4.1580 4.1580 4.1580 5.7752 5.7752 5.7752 5.7752 10.1082 10.1082 10.1083 10.1083 11.5361 11.5361 k = 0.0000 0.2923 0.1520 ( 5006 PWs) bands (ev): -11.2553 -11.2553 -11.2553 -11.2553 -10.6494 -10.6494 -10.6494 -10.6494 -1.3800 -1.3800 -1.3800 -1.3800 -0.9934 -0.9934 -0.9934 -0.9934 0.5188 0.5188 0.5189 0.5189 0.7157 0.7157 0.7157 0.7157 1.8613 1.8613 1.8613 1.8613 1.9856 1.9856 1.9857 1.9857 2.2279 2.2279 2.2279 2.2279 2.8513 2.8513 2.8514 2.8514 3.7607 3.7607 3.7608 3.7608 4.1499 4.1499 4.1499 4.1499 5.7743 5.7743 5.7744 5.7744 10.0821 10.0821 10.0821 10.0821 11.5578 11.5578 k = 0.0000 0.2819 0.1520 ( 5010 PWs) bands (ev): -11.2621 -11.2621 -11.2620 -11.2620 -10.6501 -10.6501 -10.6501 -10.6501 -1.3773 -1.3773 -1.3773 -1.3773 -0.9936 -0.9936 -0.9935 -0.9935 0.5337 0.5337 0.5338 0.5338 0.7421 0.7421 0.7421 0.7421 1.8655 1.8655 1.8655 1.8655 1.9845 1.9845 1.9846 1.9846 2.2294 2.2294 2.2295 2.2295 2.8554 2.8554 2.8555 2.8555 3.7491 3.7491 3.7492 3.7492 4.1421 4.1421 4.1421 4.1421 5.7735 5.7735 5.7736 5.7736 10.0547 10.0547 10.0547 10.0547 11.5724 11.5724 k = 0.0000 0.2714 0.1520 ( 5006 PWs) bands (ev): -11.2690 -11.2690 -11.2689 -11.2689 -10.6509 -10.6509 -10.6509 -10.6509 -1.3746 -1.3746 -1.3746 -1.3746 -0.9937 -0.9937 -0.9936 -0.9936 0.5472 0.5472 0.5472 0.5472 0.7722 0.7722 0.7722 0.7722 1.8692 1.8692 1.8692 1.8692 1.9839 1.9839 1.9840 1.9840 2.2311 2.2311 2.2311 2.2311 2.8596 2.8596 2.8597 2.8597 3.7365 3.7365 3.7366 3.7366 4.1348 4.1348 4.1349 4.1349 5.7727 5.7727 5.7727 5.7727 10.0261 10.0261 10.0262 10.0262 11.5779 11.5779 k = 0.0000 0.2610 0.1520 ( 4998 PWs) bands (ev): -11.2761 -11.2761 -11.2760 -11.2760 -10.6518 -10.6518 -10.6517 -10.6517 -1.3720 -1.3720 -1.3720 -1.3720 -0.9938 -0.9938 -0.9938 -0.9938 0.5594 0.5594 0.5594 0.5594 0.8057 0.8057 0.8058 0.8058 1.8723 1.8723 1.8723 1.8723 1.9839 1.9839 1.9839 1.9839 2.2328 2.2328 2.2329 2.2329 2.8637 2.8637 2.8638 2.8638 3.7229 3.7229 3.7230 3.7230 4.1282 4.1282 4.1283 4.1283 5.7718 5.7718 5.7719 5.7719 9.9966 9.9966 9.9966 9.9966 11.5724 11.5724 k = 0.0000 0.2506 0.1520 ( 5012 PWs) bands (ev): -11.2833 -11.2833 -11.2832 -11.2832 -10.6527 -10.6527 -10.6526 -10.6526 -1.3695 -1.3695 -1.3695 -1.3695 -0.9940 -0.9940 -0.9939 -0.9939 0.5706 0.5706 0.5706 0.5706 0.8422 0.8422 0.8423 0.8423 1.8746 1.8746 1.8747 1.8747 1.9845 1.9845 1.9845 1.9845 2.2348 2.2348 2.2348 2.2348 2.8678 2.8678 2.8679 2.8679 3.7083 3.7083 3.7084 3.7084 4.1223 4.1223 4.1224 4.1224 5.7709 5.7709 5.7710 5.7710 9.9660 9.9660 9.9660 9.9660 11.5549 11.5549 k = 0.0000 0.2401 0.1520 ( 5010 PWs) bands (ev): -11.2905 -11.2905 -11.2905 -11.2905 -10.6536 -10.6536 -10.6536 -10.6536 -1.3672 -1.3672 -1.3671 -1.3671 -0.9942 -0.9942 -0.9941 -0.9941 0.5810 0.5810 0.5810 0.5810 0.8813 0.8813 0.8813 0.8813 1.8763 1.8763 1.8763 1.8763 1.9857 1.9857 1.9857 1.9857 2.2368 2.2368 2.2368 2.2368 2.8720 2.8720 2.8721 2.8721 3.6928 3.6928 3.6929 3.6929 4.1172 4.1172 4.1173 4.1173 5.7700 5.7700 5.7701 5.7701 9.9346 9.9346 9.9346 9.9346 11.5255 11.5255 k = 0.0000 0.2297 0.1520 ( 5006 PWs) bands (ev): -11.2978 -11.2978 -11.2977 -11.2977 -10.6547 -10.6547 -10.6546 -10.6546 -1.3650 -1.3650 -1.3649 -1.3649 -0.9943 -0.9943 -0.9943 -0.9943 0.5908 0.5908 0.5909 0.5909 0.9226 0.9226 0.9226 0.9226 1.8772 1.8772 1.8773 1.8773 1.9875 1.9875 1.9876 1.9876 2.2389 2.2389 2.2390 2.2390 2.8761 2.8761 2.8761 2.8761 3.6764 3.6764 3.6764 3.6764 4.1130 4.1130 4.1130 4.1130 5.7692 5.7692 5.7693 5.7693 9.9025 9.9025 9.9025 9.9025 11.4852 11.4853 k = 0.0000 0.2192 0.1520 ( 5012 PWs) bands (ev): -11.3051 -11.3051 -11.3050 -11.3050 -10.6557 -10.6557 -10.6557 -10.6557 -1.3629 -1.3629 -1.3629 -1.3629 -0.9945 -0.9945 -0.9944 -0.9944 0.6003 0.6003 0.6004 0.6004 0.9655 0.9655 0.9656 0.9656 1.8775 1.8775 1.8775 1.8775 1.9898 1.9898 1.9899 1.9899 2.2412 2.2412 2.2413 2.2413 2.8800 2.8800 2.8800 2.8800 3.6590 3.6590 3.6591 3.6591 4.1097 4.1097 4.1097 4.1097 5.7683 5.7683 5.7684 5.7684 9.8697 9.8697 9.8698 9.8698 11.4359 11.4359 k = 0.0000 0.2088 0.1520 ( 5008 PWs) bands (ev): -11.3123 -11.3123 -11.3122 -11.3122 -10.6568 -10.6568 -10.6568 -10.6568 -1.3610 -1.3610 -1.3610 -1.3610 -0.9947 -0.9947 -0.9946 -0.9946 0.6095 0.6095 0.6095 0.6095 1.0100 1.0100 1.0100 1.0100 1.8771 1.8771 1.8772 1.8772 1.9926 1.9926 1.9926 1.9926 2.2437 2.2437 2.2438 2.2438 2.8837 2.8837 2.8838 2.8838 3.6409 3.6409 3.6410 3.6410 4.1074 4.1074 4.1074 4.1074 5.7675 5.7675 5.7676 5.7676 9.8365 9.8365 9.8366 9.8366 11.3793 11.3794 k = 0.0000 0.1984 0.1520 ( 5006 PWs) bands (ev): -11.3194 -11.3194 -11.3193 -11.3193 -10.6580 -10.6580 -10.6579 -10.6579 -1.3593 -1.3593 -1.3593 -1.3593 -0.9949 -0.9949 -0.9948 -0.9948 0.6185 0.6185 0.6185 0.6185 1.0555 1.0555 1.0555 1.0555 1.8763 1.8763 1.8763 1.8763 1.9956 1.9956 1.9956 1.9956 2.2463 2.2463 2.2464 2.2464 2.8874 2.8874 2.8875 2.8875 3.6220 3.6220 3.6221 3.6221 4.1060 4.1060 4.1061 4.1061 5.7667 5.7667 5.7667 5.7667 9.8030 9.8030 9.8031 9.8031 11.3175 11.3175 k = 0.0000 0.1879 0.1520 ( 5000 PWs) bands (ev): -11.3264 -11.3264 -11.3263 -11.3263 -10.6591 -10.6591 -10.6591 -10.6591 -1.3578 -1.3578 -1.3578 -1.3578 -0.9951 -0.9951 -0.9950 -0.9950 0.6273 0.6273 0.6273 0.6273 1.1018 1.1018 1.1018 1.1018 1.8750 1.8750 1.8751 1.8751 1.9988 1.9988 1.9989 1.9989 2.2490 2.2490 2.2491 2.2491 2.8908 2.8908 2.8909 2.8909 3.6025 3.6025 3.6026 3.6026 4.1056 4.1056 4.1057 4.1057 5.7659 5.7659 5.7660 5.7660 9.7694 9.7694 9.7694 9.7694 11.2519 11.2520 k = 0.0000 0.1775 0.1520 ( 5004 PWs) bands (ev): -11.3332 -11.3332 -11.3332 -11.3332 -10.6603 -10.6603 -10.6603 -10.6603 -1.3565 -1.3565 -1.3564 -1.3564 -0.9953 -0.9953 -0.9952 -0.9952 0.6359 0.6359 0.6359 0.6359 1.1485 1.1485 1.1485 1.1485 1.8735 1.8735 1.8736 1.8736 2.0021 2.0021 2.0022 2.0022 2.2519 2.2519 2.2520 2.2520 2.8939 2.8939 2.8940 2.8940 3.5823 3.5823 3.5824 3.5824 4.1062 4.1062 4.1062 4.1062 5.7651 5.7651 5.7652 5.7652 9.7357 9.7357 9.7358 9.7358 11.1841 11.1842 k = 0.0000 0.1670 0.1520 ( 5002 PWs) bands (ev): -11.3398 -11.3398 -11.3398 -11.3398 -10.6615 -10.6615 -10.6614 -10.6614 -1.3553 -1.3553 -1.3553 -1.3553 -0.9954 -0.9954 -0.9954 -0.9954 0.6443 0.6443 0.6444 0.6444 1.1954 1.1954 1.1954 1.1954 1.8718 1.8718 1.8719 1.8719 2.0055 2.0055 2.0055 2.0055 2.2549 2.2549 2.2549 2.2549 2.8968 2.8968 2.8969 2.8969 3.5617 3.5617 3.5618 3.5618 4.1076 4.1076 4.1077 4.1077 5.7644 5.7644 5.7645 5.7645 9.7023 9.7023 9.7023 9.7023 11.1153 11.1153 k = 0.0000 0.1566 0.1520 ( 4994 PWs) bands (ev): -11.3462 -11.3462 -11.3462 -11.3462 -10.6627 -10.6627 -10.6626 -10.6626 -1.3544 -1.3544 -1.3543 -1.3543 -0.9956 -0.9956 -0.9955 -0.9955 0.6526 0.6526 0.6526 0.6526 1.2421 1.2421 1.2421 1.2421 1.8700 1.8700 1.8701 1.8701 2.0087 2.0087 2.0087 2.0087 2.2580 2.2580 2.2580 2.2580 2.8995 2.8995 2.8995 2.8995 3.5407 3.5407 3.5408 3.5408 4.1099 4.1099 4.1100 4.1100 5.7637 5.7637 5.7638 5.7638 9.6693 9.6693 9.6693 9.6693 11.0464 11.0464 k = 0.0000 0.1462 0.1520 ( 4998 PWs) bands (ev): -11.3524 -11.3524 -11.3523 -11.3523 -10.6638 -10.6638 -10.6638 -10.6638 -1.3536 -1.3536 -1.3535 -1.3535 -0.9958 -0.9958 -0.9957 -0.9957 0.6606 0.6606 0.6606 0.6606 1.2883 1.2883 1.2883 1.2883 1.8682 1.8682 1.8683 1.8683 2.0119 2.0119 2.0119 2.0119 2.2611 2.2611 2.2612 2.2612 2.9017 2.9017 2.9018 2.9018 3.5195 3.5195 3.5195 3.5195 4.1129 4.1129 4.1130 4.1130 5.7631 5.7631 5.7631 5.7631 9.6368 9.6368 9.6369 9.6369 10.9784 10.9784 k = 0.0000 0.1357 0.1520 ( 4998 PWs) bands (ev): -11.3582 -11.3582 -11.3582 -11.3582 -10.6649 -10.6649 -10.6649 -10.6649 -1.3529 -1.3529 -1.3529 -1.3529 -0.9960 -0.9960 -0.9959 -0.9959 0.6684 0.6684 0.6684 0.6684 1.3335 1.3335 1.3336 1.3336 1.8665 1.8665 1.8665 1.8665 2.0150 2.0150 2.0150 2.0150 2.2643 2.2643 2.2644 2.2644 2.9036 2.9036 2.9037 2.9037 3.4982 3.4982 3.4982 3.4982 4.1166 4.1166 4.1167 4.1167 5.7624 5.7624 5.7625 5.7625 9.6052 9.6052 9.6053 9.6053 10.9121 10.9121 k = 0.0000 0.1253 0.1520 ( 4998 PWs) bands (ev): -11.3637 -11.3637 -11.3637 -11.3637 -10.6660 -10.6660 -10.6660 -10.6660 -1.3524 -1.3524 -1.3523 -1.3523 -0.9962 -0.9962 -0.9961 -0.9961 0.6758 0.6758 0.6758 0.6758 1.3776 1.3776 1.3776 1.3776 1.8648 1.8648 1.8649 1.8649 2.0180 2.0180 2.0180 2.0180 2.2676 2.2676 2.2676 2.2676 2.9052 2.9052 2.9052 2.9052 3.4769 3.4769 3.4770 3.4770 4.1208 4.1208 4.1209 4.1209 5.7618 5.7618 5.7619 5.7619 9.5747 9.5747 9.5747 9.5747 10.8480 10.8481 k = 0.0000 0.1148 0.1520 ( 4998 PWs) bands (ev): -11.3689 -11.3689 -11.3689 -11.3689 -10.6671 -10.6671 -10.6670 -10.6670 -1.3520 -1.3520 -1.3520 -1.3520 -0.9964 -0.9964 -0.9963 -0.9963 0.6828 0.6828 0.6829 0.6829 1.4199 1.4199 1.4199 1.4199 1.8634 1.8634 1.8634 1.8634 2.0209 2.0209 2.0209 2.0209 2.2708 2.2708 2.2709 2.2709 2.9063 2.9063 2.9064 2.9064 3.4560 3.4560 3.4561 3.4561 4.1255 4.1255 4.1255 4.1255 5.7613 5.7613 5.7614 5.7614 9.5454 9.5454 9.5455 9.5455 10.7870 10.7870 k = 0.0000 0.1044 0.1520 ( 5004 PWs) bands (ev): -11.3737 -11.3737 -11.3737 -11.3737 -10.6681 -10.6681 -10.6680 -10.6680 -1.3517 -1.3517 -1.3517 -1.3517 -0.9965 -0.9965 -0.9964 -0.9964 0.6895 0.6895 0.6895 0.6895 1.4602 1.4602 1.4602 1.4602 1.8621 1.8621 1.8622 1.8622 2.0237 2.0237 2.0237 2.0237 2.2740 2.2740 2.2741 2.2741 2.9070 2.9070 2.9071 2.9071 3.4356 3.4356 3.4357 3.4357 4.1304 4.1304 4.1305 4.1305 5.7608 5.7608 5.7609 5.7609 9.5177 9.5177 9.5177 9.5177 10.7295 10.7295 k = 0.0000 0.0940 0.1520 ( 5000 PWs) bands (ev): -11.3781 -11.3781 -11.3781 -11.3781 -10.6690 -10.6690 -10.6689 -10.6689 -1.3515 -1.3515 -1.3515 -1.3515 -0.9967 -0.9967 -0.9966 -0.9966 0.6957 0.6957 0.6957 0.6957 1.4980 1.4980 1.4980 1.4980 1.8612 1.8612 1.8612 1.8612 2.0265 2.0265 2.0265 2.0265 2.2772 2.2772 2.2773 2.2773 2.9074 2.9074 2.9074 2.9074 3.4160 3.4160 3.4161 3.4161 4.1355 4.1355 4.1356 4.1356 5.7604 5.7604 5.7604 5.7604 9.4917 9.4917 9.4917 9.4917 10.6761 10.6761 k = 0.0000 0.0835 0.1520 ( 4992 PWs) bands (ev): -11.3822 -11.3822 -11.3821 -11.3821 -10.6698 -10.6698 -10.6698 -10.6698 -1.3514 -1.3514 -1.3514 -1.3514 -0.9968 -0.9968 -0.9967 -0.9967 0.7014 0.7014 0.7014 0.7014 1.5329 1.5329 1.5329 1.5329 1.8605 1.8605 1.8606 1.8606 2.0293 2.0293 2.0293 2.0293 2.2803 2.2803 2.2804 2.2804 2.9073 2.9073 2.9074 2.9074 3.3974 3.3974 3.3975 3.3975 4.1406 4.1406 4.1407 4.1407 5.7600 5.7600 5.7600 5.7600 9.4677 9.4677 9.4677 9.4677 10.6271 10.6271 k = 0.0000 0.0731 0.1520 ( 4992 PWs) bands (ev): -11.3857 -11.3857 -11.3857 -11.3857 -10.6706 -10.6706 -10.6705 -10.6705 -1.3513 -1.3513 -1.3513 -1.3513 -0.9969 -0.9969 -0.9969 -0.9969 0.7065 0.7065 0.7065 0.7065 1.5644 1.5644 1.5644 1.5644 1.8602 1.8602 1.8602 1.8602 2.0320 2.0320 2.0320 2.0320 2.2832 2.2832 2.2833 2.2833 2.9069 2.9069 2.9070 2.9070 3.3802 3.3802 3.3802 3.3802 4.1455 4.1455 4.1456 4.1456 5.7596 5.7596 5.7597 5.7597 9.4458 9.4458 9.4459 9.4459 10.5829 10.5829 k = 0.0000 0.0626 0.1520 ( 5000 PWs) bands (ev): -11.3889 -11.3889 -11.3888 -11.3888 -10.6713 -10.6713 -10.6712 -10.6712 -1.3513 -1.3513 -1.3513 -1.3513 -0.9971 -0.9971 -0.9970 -0.9970 0.7110 0.7110 0.7111 0.7111 1.5923 1.5923 1.5923 1.5923 1.8601 1.8601 1.8602 1.8602 2.0347 2.0347 2.0347 2.0347 2.2860 2.2860 2.2860 2.2860 2.9062 2.9062 2.9063 2.9063 3.3645 3.3645 3.3645 3.3645 4.1501 4.1501 4.1502 4.1502 5.7593 5.7593 5.7594 5.7594 9.4264 9.4264 9.4265 9.4265 10.5440 10.5440 k = 0.0000 0.0522 0.1520 ( 5006 PWs) bands (ev): -11.3915 -11.3915 -11.3915 -11.3915 -10.6719 -10.6719 -10.6718 -10.6718 -1.3513 -1.3513 -1.3513 -1.3513 -0.9972 -0.9972 -0.9971 -0.9971 0.7149 0.7149 0.7150 0.7150 1.6161 1.6161 1.6161 1.6161 1.8604 1.8604 1.8604 1.8604 2.0372 2.0372 2.0373 2.0373 2.2884 2.2884 2.2885 2.2885 2.9053 2.9053 2.9054 2.9054 3.3506 3.3506 3.3507 3.3507 4.1543 4.1543 4.1544 4.1544 5.7590 5.7590 5.7591 5.7591 9.4096 9.4096 9.4097 9.4097 10.5106 10.5106 k = 0.0000 0.0418 0.1520 ( 5002 PWs) bands (ev): -11.3937 -11.3937 -11.3937 -11.3937 -10.6724 -10.6724 -10.6723 -10.6723 -1.3514 -1.3514 -1.3513 -1.3513 -0.9973 -0.9973 -0.9972 -0.9972 0.7182 0.7182 0.7182 0.7182 1.6357 1.6357 1.6357 1.6357 1.8608 1.8608 1.8609 1.8609 2.0396 2.0396 2.0396 2.0396 2.2906 2.2906 2.2907 2.2907 2.9043 2.9043 2.9044 2.9044 3.3389 3.3389 3.3390 3.3390 4.1579 4.1579 4.1580 4.1580 5.7588 5.7588 5.7589 5.7589 9.3956 9.3956 9.3957 9.3957 10.4829 10.4829 k = 0.0000 0.0313 0.1520 ( 5000 PWs) bands (ev): -11.3955 -11.3955 -11.3954 -11.3954 -10.6727 -10.6727 -10.6727 -10.6727 -1.3514 -1.3514 -1.3513 -1.3513 -0.9973 -0.9973 -0.9973 -0.9973 0.7207 0.7207 0.7208 0.7208 1.6509 1.6509 1.6509 1.6509 1.8614 1.8614 1.8614 1.8614 2.0416 2.0416 2.0417 2.0417 2.2924 2.2924 2.2925 2.2925 2.9034 2.9034 2.9035 2.9035 3.3296 3.3296 3.3297 3.3297 4.1609 4.1609 4.1609 4.1609 5.7586 5.7586 5.7587 5.7587 9.3845 9.3845 9.3846 9.3846 10.4612 10.4612 k = 0.0000 0.0209 0.1520 ( 4988 PWs) bands (ev): -11.3967 -11.3967 -11.3967 -11.3967 -10.6730 -10.6730 -10.6730 -10.6730 -1.3514 -1.3514 -1.3514 -1.3514 -0.9974 -0.9974 -0.9973 -0.9973 0.7226 0.7226 0.7226 0.7226 1.6618 1.6618 1.6618 1.6618 1.8619 1.8619 1.8620 1.8620 2.0432 2.0432 2.0433 2.0433 2.2938 2.2938 2.2938 2.2938 2.9026 2.9026 2.9027 2.9027 3.3228 3.3228 3.3229 3.3229 4.1631 4.1631 4.1631 4.1631 5.7585 5.7585 5.7586 5.7586 9.3766 9.3766 9.3766 9.3766 10.4455 10.4455 k = 0.0000 0.0104 0.1520 ( 4976 PWs) bands (ev): -11.3974 -11.3974 -11.3974 -11.3974 -10.6732 -10.6732 -10.6731 -10.6731 -1.3514 -1.3514 -1.3514 -1.3514 -0.9974 -0.9974 -0.9973 -0.9973 0.7237 0.7237 0.7237 0.7237 1.6683 1.6683 1.6683 1.6683 1.8623 1.8623 1.8624 1.8624 2.0443 2.0443 2.0443 2.0443 2.2946 2.2946 2.2947 2.2947 2.9021 2.9021 2.9022 2.9022 3.3187 3.3187 3.3188 3.3188 4.1644 4.1644 4.1645 4.1645 5.7585 5.7585 5.7585 5.7585 9.3717 9.3717 9.3718 9.3718 10.4361 10.4361 k = 0.0000 0.0000 0.1520 ( 4972 PWs) bands (ev): -11.3977 -11.3977 -11.3976 -11.3976 -10.6732 -10.6732 -10.6732 -10.6732 -1.3514 -1.3514 -1.3514 -1.3514 -0.9974 -0.9974 -0.9973 -0.9973 0.7241 0.7241 0.7241 0.7241 1.6704 1.6704 1.6704 1.6704 1.8624 1.8624 1.8625 1.8625 2.0446 2.0446 2.0446 2.0446 2.2949 2.2949 2.2950 2.2950 2.9019 2.9019 2.9020 2.9020 3.3173 3.3173 3.3174 3.3174 4.1649 4.1649 4.1649 4.1649 5.7584 5.7584 5.7585 5.7585 9.3701 9.3701 9.3701 9.3701 10.4330 10.4330 k = 0.0000 0.4385-0.0000 ( 5004 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4085 -1.4085 -1.4085 -1.4085 -0.9926 -0.9926 -0.9925 -0.9925 0.3988 0.3988 0.3989 0.3989 0.5570 0.5570 0.5570 0.5570 1.7769 1.7769 1.7769 1.7769 2.0025 2.0025 2.0025 2.0025 2.2305 2.2305 2.2306 2.2306 2.8186 2.8186 2.8187 2.8187 3.8921 3.8921 3.8922 3.8922 4.1994 4.1994 4.1995 4.1995 5.7809 5.7809 5.7810 5.7810 10.1969 10.1969 10.1970 10.1970 11.3577 11.3577 k = 0.0000 0.4385 0.0101 ( 5016 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4085 -1.4085 -1.4085 -1.4085 -0.9926 -0.9926 -0.9925 -0.9925 0.3979 0.3979 0.3979 0.3979 0.5577 0.5577 0.5578 0.5578 1.7773 1.7773 1.7773 1.7773 2.0025 2.0025 2.0026 2.0026 2.2304 2.2304 2.2304 2.2304 2.8185 2.8185 2.8186 2.8186 3.8914 3.8914 3.8915 3.8915 4.1998 4.1998 4.1999 4.1999 5.7809 5.7809 5.7809 5.7809 10.1979 10.1979 10.1979 10.1979 11.3567 11.3567 k = 0.0000 0.4385 0.0203 ( 5006 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4084 -1.4084 -1.4084 -1.4084 -0.9926 -0.9926 -0.9925 -0.9925 0.3953 0.3953 0.3953 0.3953 0.5600 0.5600 0.5600 0.5600 1.7784 1.7784 1.7785 1.7785 2.0026 2.0026 2.0027 2.0027 2.2301 2.2301 2.2301 2.2301 2.8185 2.8185 2.8186 2.8186 3.8893 3.8893 3.8894 3.8894 4.2011 4.2011 4.2011 4.2011 5.7809 5.7809 5.7810 5.7810 10.2007 10.2007 10.2008 10.2008 11.3536 11.3536 k = 0.0000 0.4385 0.0304 ( 5004 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4082 -1.4082 -1.4082 -1.4082 -0.9926 -0.9926 -0.9925 -0.9925 0.3912 0.3912 0.3912 0.3912 0.5634 0.5634 0.5635 0.5635 1.7803 1.7803 1.7803 1.7803 2.0028 2.0028 2.0029 2.0029 2.2295 2.2295 2.2295 2.2295 2.8184 2.8184 2.8185 2.8185 3.8860 3.8860 3.8861 3.8861 4.2031 4.2031 4.2031 4.2031 5.7809 5.7809 5.7810 5.7810 10.2054 10.2054 10.2054 10.2054 11.3486 11.3486 k = 0.0000 0.4385 0.0405 ( 5000 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4080 -1.4080 -1.4080 -1.4080 -0.9926 -0.9926 -0.9925 -0.9925 0.3860 0.3860 0.3860 0.3860 0.5678 0.5678 0.5679 0.5679 1.7828 1.7828 1.7829 1.7829 2.0031 2.0031 2.0031 2.0031 2.2286 2.2286 2.2287 2.2287 2.8183 2.8183 2.8184 2.8184 3.8816 3.8816 3.8817 3.8817 4.2057 4.2057 4.2058 4.2058 5.7809 5.7809 5.7810 5.7810 10.2116 10.2116 10.2117 10.2117 11.3418 11.3418 k = 0.0000 0.4385 0.0507 ( 4996 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4077 -1.4077 -1.4077 -1.4077 -0.9926 -0.9926 -0.9925 -0.9925 0.3800 0.3800 0.3800 0.3800 0.5728 0.5728 0.5728 0.5728 1.7859 1.7859 1.7859 1.7859 2.0034 2.0034 2.0034 2.0034 2.2276 2.2276 2.2277 2.2277 2.8182 2.8182 2.8183 2.8183 3.8764 3.8764 3.8764 3.8764 4.2088 4.2088 4.2088 4.2088 5.7810 5.7810 5.7810 5.7810 10.2193 10.2193 10.2194 10.2194 11.3336 11.3336 k = 0.0000 0.4385 0.0608 ( 4992 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4074 -1.4074 -1.4073 -1.4073 -0.9926 -0.9926 -0.9925 -0.9925 0.3736 0.3736 0.3736 0.3736 0.5781 0.5781 0.5781 0.5781 1.7894 1.7894 1.7894 1.7894 2.0038 2.0038 2.0038 2.0038 2.2264 2.2264 2.2264 2.2264 2.8181 2.8181 2.8182 2.8182 3.8706 3.8706 3.8706 3.8706 4.2121 4.2121 4.2122 4.2122 5.7810 5.7810 5.7811 5.7811 10.2281 10.2281 10.2281 10.2281 11.3241 11.3242 k = 0.0000 0.4385 0.0709 ( 4996 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4071 -1.4071 -1.4070 -1.4070 -0.9926 -0.9926 -0.9925 -0.9925 0.3671 0.3671 0.3671 0.3671 0.5833 0.5833 0.5834 0.5834 1.7931 1.7931 1.7931 1.7931 2.0042 2.0042 2.0042 2.0042 2.2251 2.2251 2.2251 2.2251 2.8180 2.8180 2.8181 2.8181 3.8645 3.8645 3.8645 3.8645 4.2156 4.2156 4.2157 4.2157 5.7810 5.7810 5.7811 5.7811 10.2377 10.2377 10.2377 10.2377 11.3139 11.3140 k = 0.0000 0.4385 0.0811 ( 4992 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4067 -1.4067 -1.4067 -1.4067 -0.9925 -0.9925 -0.9925 -0.9925 0.3608 0.3608 0.3608 0.3608 0.5884 0.5884 0.5884 0.5884 1.7969 1.7969 1.7969 1.7969 2.0046 2.0046 2.0047 2.0047 2.2237 2.2237 2.2238 2.2238 2.8178 2.8178 2.8179 2.8179 3.8583 3.8583 3.8584 3.8584 4.2190 4.2190 4.2191 4.2191 5.7811 5.7811 5.7811 5.7811 10.2476 10.2476 10.2477 10.2477 11.3034 11.3034 k = 0.0000 0.4385 0.0912 ( 5002 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4064 -1.4064 -1.4063 -1.4063 -0.9926 -0.9926 -0.9925 -0.9925 0.3549 0.3549 0.3549 0.3549 0.5931 0.5931 0.5931 0.5931 1.8007 1.8007 1.8007 1.8007 2.0051 2.0051 2.0051 2.0051 2.2223 2.2223 2.2224 2.2224 2.8177 2.8177 2.8178 2.8178 3.8524 3.8524 3.8525 3.8525 4.2223 4.2223 4.2223 4.2223 5.7810 5.7810 5.7811 5.7811 10.2575 10.2575 10.2576 10.2576 11.2929 11.2929 k = 0.0000 0.4385 0.1013 ( 5006 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4060 -1.4060 -1.4060 -1.4060 -0.9926 -0.9926 -0.9925 -0.9925 0.3496 0.3496 0.3496 0.3496 0.5972 0.5972 0.5973 0.5973 1.8042 1.8042 1.8042 1.8042 2.0055 2.0055 2.0056 2.0056 2.2210 2.2210 2.2211 2.2211 2.8175 2.8175 2.8176 2.8176 3.8470 3.8470 3.8471 3.8471 4.2252 4.2252 4.2253 4.2253 5.7811 5.7811 5.7811 5.7811 10.2670 10.2670 10.2670 10.2670 11.2829 11.2830 k = 0.0000 0.4385 0.1115 ( 5008 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4058 -1.4058 -1.4057 -1.4057 -0.9926 -0.9926 -0.9925 -0.9925 0.3450 0.3450 0.3451 0.3451 0.6008 0.6008 0.6008 0.6008 1.8073 1.8073 1.8074 1.8074 2.0059 2.0059 2.0060 2.0060 2.2198 2.2198 2.2199 2.2199 2.8174 2.8174 2.8175 2.8175 3.8423 3.8423 3.8423 3.8423 4.2278 4.2278 4.2278 4.2278 5.7811 5.7811 5.7811 5.7811 10.2755 10.2755 10.2755 10.2755 11.2740 11.2740 k = 0.0000 0.4385 0.1216 ( 5006 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4055 -1.4055 -1.4055 -1.4055 -0.9926 -0.9926 -0.9925 -0.9925 0.3414 0.3414 0.3414 0.3414 0.6036 0.6036 0.6036 0.6036 1.8099 1.8099 1.8100 1.8100 2.0063 2.0063 2.0064 2.0064 2.2188 2.2188 2.2189 2.2189 2.8173 2.8173 2.8174 2.8174 3.8384 3.8384 3.8384 3.8384 4.2299 4.2299 4.2299 4.2299 5.7811 5.7811 5.7811 5.7811 10.2826 10.2826 10.2827 10.2827 11.2665 11.2665 k = 0.0000 0.4385 0.1317 ( 5008 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4054 -1.4054 -1.4053 -1.4053 -0.9926 -0.9926 -0.9925 -0.9925 0.3387 0.3387 0.3387 0.3387 0.6056 0.6056 0.6057 0.6057 1.8119 1.8119 1.8119 1.8119 2.0066 2.0066 2.0066 2.0066 2.2181 2.2181 2.2181 2.2181 2.8173 2.8173 2.8173 2.8173 3.8355 3.8355 3.8356 3.8356 4.2314 4.2314 4.2314 4.2314 5.7811 5.7811 5.7811 5.7811 10.2880 10.2880 10.2881 10.2881 11.2609 11.2609 k = 0.0000 0.4385 0.1419 ( 5004 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4052 -1.4052 -1.4052 -1.4052 -0.9926 -0.9926 -0.9925 -0.9925 0.3371 0.3371 0.3371 0.3371 0.6069 0.6069 0.6069 0.6069 1.8131 1.8131 1.8131 1.8131 2.0068 2.0068 2.0068 2.0068 2.2176 2.2176 2.2177 2.2177 2.8172 2.8172 2.8173 2.8173 3.8337 3.8337 3.8338 3.8338 4.2323 4.2323 4.2324 4.2324 5.7811 5.7811 5.7812 5.7812 10.2914 10.2914 10.2914 10.2914 11.2574 11.2574 k = 0.0000 0.4385 0.1520 ( 5012 PWs) bands (ev): -11.2027 -11.2027 -11.2027 -11.2027 -10.6453 -10.6453 -10.6453 -10.6453 -1.4052 -1.4052 -1.4052 -1.4052 -0.9926 -0.9926 -0.9925 -0.9925 0.3365 0.3365 0.3365 0.3365 0.6073 0.6073 0.6073 0.6073 1.8135 1.8135 1.8135 1.8135 2.0068 2.0068 2.0069 2.0069 2.2174 2.2174 2.2175 2.2175 2.8172 2.8172 2.8173 2.8173 3.8331 3.8331 3.8332 3.8332 4.2326 4.2326 4.2327 4.2327 5.7811 5.7811 5.7812 5.7812 10.2925 10.2925 10.2926 10.2926 11.2562 11.2562 k = 0.5000-0.0000 0.1520 ( 5020 PWs) bands (ev): -10.7163 -10.7163 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6279 -1.6279 -1.6255 -1.6255 -0.2189 -0.2189 -0.2108 -0.2108 -0.1653 -0.1653 -0.1572 -0.1572 0.6594 0.6594 0.6649 0.6649 1.0746 1.0746 1.0782 1.0782 2.2949 2.2949 2.3032 2.3032 2.4704 2.4704 2.4714 2.4714 2.6712 2.6712 2.6716 2.6716 3.4168 3.4168 3.4193 3.4193 4.0201 4.0201 4.0376 4.0376 5.8259 5.8259 5.8390 5.8390 10.2902 10.2902 10.2923 10.2923 11.7433 11.7433 k = 0.5000-0.0000 0.1419 ( 5028 PWs) bands (ev): -10.7163 -10.7163 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6278 -1.6278 -1.6254 -1.6254 -0.2310 -0.2310 -0.2231 -0.2231 -0.1522 -0.1522 -0.1438 -0.1438 0.6580 0.6580 0.6635 0.6635 1.0747 1.0747 1.0783 1.0783 2.2949 2.2949 2.3031 2.3031 2.4704 2.4704 2.4714 2.4714 2.6712 2.6712 2.6716 2.6716 3.4170 3.4170 3.4195 3.4195 4.0201 4.0201 4.0375 4.0375 5.8259 5.8259 5.8390 5.8390 10.2887 10.2887 10.2908 10.2908 11.7479 11.7479 k = 0.5000-0.0000 0.1317 ( 5020 PWs) bands (ev): -10.7163 -10.7163 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6276 -1.6276 -1.6252 -1.6252 -0.2535 -0.2535 -0.2460 -0.2460 -0.1264 -0.1264 -0.1178 -0.1178 0.6540 0.6540 0.6596 0.6596 1.0751 1.0751 1.0785 1.0785 2.2947 2.2947 2.3027 2.3027 2.4706 2.4706 2.4716 2.4716 2.6712 2.6712 2.6716 2.6716 3.4176 3.4176 3.4201 3.4201 4.0201 4.0201 4.0372 4.0372 5.8260 5.8260 5.8388 5.8388 10.2844 10.2844 10.2865 10.2865 11.7616 11.7616 k = 0.5000-0.0000 0.1216 ( 5026 PWs) bands (ev): -10.7163 -10.7163 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6272 -1.6272 -1.6248 -1.6248 -0.2774 -0.2774 -0.2703 -0.2703 -0.0972 -0.0972 -0.0884 -0.0884 0.6474 0.6474 0.6531 0.6531 1.0756 1.0756 1.0789 1.0789 2.2943 2.2943 2.3021 2.3021 2.4708 2.4708 2.4717 2.4717 2.6713 2.6713 2.6717 2.6717 3.4186 3.4186 3.4211 3.4211 4.0201 4.0201 4.0368 4.0368 5.8260 5.8260 5.8385 5.8385 10.2775 10.2775 10.2796 10.2796 11.7841 11.7841 k = 0.5000-0.0000 0.1115 ( 5030 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6266 -1.6266 -1.6243 -1.6243 -0.3007 -0.3007 -0.2940 -0.2940 -0.0665 -0.0665 -0.0576 -0.0576 0.6384 0.6384 0.6442 0.6442 1.0763 1.0763 1.0794 1.0794 2.2939 2.2939 2.3013 2.3013 2.4712 2.4712 2.4720 2.4720 2.6713 2.6713 2.6718 2.6718 3.4200 3.4200 3.4224 3.4224 4.0201 4.0201 4.0362 4.0362 5.8262 5.8262 5.8382 5.8382 10.2685 10.2685 10.2706 10.2706 11.8148 11.8148 k = 0.5000-0.0000 0.1013 ( 5024 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6259 -1.6259 -1.6238 -1.6238 -0.3227 -0.3227 -0.3165 -0.3165 -0.0351 -0.0351 -0.0261 -0.0261 0.6271 0.6271 0.6330 0.6330 1.0771 1.0771 1.0801 1.0801 2.2934 2.2934 2.3003 2.3003 2.4716 2.4716 2.4724 2.4724 2.6715 2.6715 2.6719 2.6719 3.4217 3.4217 3.4240 3.4240 4.0202 4.0202 4.0354 4.0354 5.8263 5.8263 5.8377 5.8377 10.2578 10.2578 10.2600 10.2600 11.8529 11.8529 k = 0.5000-0.0000 0.0912 ( 5018 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6251 -1.6251 -1.6231 -1.6231 -0.3431 -0.3431 -0.3375 -0.3375 -0.0034 -0.0034 0.0057 0.0057 0.6137 0.6137 0.6198 0.6198 1.0780 1.0780 1.0808 1.0808 2.2928 2.2928 2.2992 2.2992 2.4721 2.4721 2.4727 2.4727 2.6716 2.6716 2.6720 2.6720 3.4236 3.4236 3.4258 3.4258 4.0203 4.0203 4.0345 4.0345 5.8265 5.8265 5.8372 5.8372 10.2461 10.2461 10.2483 10.2483 11.8976 11.8976 k = 0.5000-0.0000 0.0811 ( 5014 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6243 -1.6243 -1.6225 -1.6225 -0.3617 -0.3617 -0.3567 -0.3567 0.0283 0.0283 0.0373 0.0373 0.5985 0.5985 0.6047 0.6047 1.0790 1.0790 1.0815 1.0815 2.2923 2.2923 2.2981 2.2981 2.4726 2.4726 2.4731 2.4731 2.6718 2.6718 2.6721 2.6721 3.4256 3.4256 3.4276 3.4276 4.0204 4.0204 4.0335 4.0335 5.8268 5.8268 5.8366 5.8366 10.2340 10.2340 10.2361 10.2361 11.9479 11.9479 k = 0.5000-0.0000 0.0709 ( 5010 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6234 -1.6234 -1.6218 -1.6218 -0.3785 -0.3785 -0.3740 -0.3740 0.0596 0.0596 0.0683 0.0683 0.5819 0.5819 0.5882 0.5882 1.0799 1.0799 1.0821 1.0821 2.2917 2.2917 2.2968 2.2968 2.4731 2.4731 2.4735 2.4735 2.6719 2.6719 2.6723 2.6723 3.4277 3.4277 3.4295 3.4295 4.0206 4.0206 4.0324 4.0324 5.8271 5.8271 5.8359 5.8359 10.2219 10.2219 10.2239 10.2239 12.0027 12.0027 k = 0.5000-0.0000 0.0608 ( 5018 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7072 -10.7072 -10.7071 -10.7071 -1.6226 -1.6226 -1.6211 -1.6211 -0.3932 -0.3932 -0.3893 -0.3893 0.0899 0.0899 0.0983 0.0983 0.5643 0.5643 0.5705 0.5705 1.0808 1.0808 1.0828 1.0828 2.2912 2.2912 2.2956 2.2956 2.4736 2.4736 2.4739 2.4739 2.6720 2.6720 2.6723 2.6723 3.4297 3.4297 3.4313 3.4313 4.0209 4.0209 4.0313 4.0313 5.8274 5.8274 5.8352 5.8352 10.2105 10.2105 10.2123 10.2123 12.0607 12.0607 k = 0.5000-0.0000 0.0507 ( 5018 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6218 -1.6218 -1.6205 -1.6205 -0.4058 -0.4058 -0.4025 -0.4025 0.1189 0.1189 0.1268 0.1268 0.5464 0.5464 0.5524 0.5524 1.0817 1.0817 1.0833 1.0833 2.2907 2.2907 2.2945 2.2945 2.4740 2.4740 2.4743 2.4743 2.6722 2.6722 2.6724 2.6724 3.4317 3.4317 3.4330 3.4330 4.0212 4.0212 4.0301 4.0301 5.8278 5.8278 5.8344 5.8344 10.2001 10.2001 10.2017 10.2017 12.1202 12.1202 k = 0.5000-0.0000 0.0405 ( 5026 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6210 -1.6210 -1.6200 -1.6200 -0.4161 -0.4161 -0.4134 -0.4134 0.1457 0.1457 0.1528 0.1528 0.5290 0.5290 0.5345 0.5345 1.0825 1.0825 1.0838 1.0838 2.2904 2.2904 2.2934 2.2934 2.4744 2.4744 2.4746 2.4746 2.6722 2.6722 2.6725 2.6725 3.4333 3.4333 3.4345 3.4345 4.0217 4.0217 4.0289 4.0289 5.8283 5.8283 5.8336 5.8336 10.1911 10.1911 10.1925 10.1925 12.1792 12.1792 k = 0.5000-0.0000 0.0304 ( 5030 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6204 -1.6204 -1.6196 -1.6196 -0.4242 -0.4242 -0.4221 -0.4221 0.1693 0.1693 0.1752 0.1752 0.5131 0.5131 0.5179 0.5179 1.0831 1.0831 1.0841 1.0841 2.2902 2.2902 2.2924 2.2924 2.4747 2.4747 2.4748 2.4748 2.6723 2.6723 2.6725 2.6725 3.4348 3.4348 3.4357 3.4357 4.0223 4.0223 4.0278 4.0278 5.8288 5.8288 5.8329 5.8329 10.1839 10.1839 10.1849 10.1849 12.2348 12.2348 k = 0.5000-0.0000 0.0203 ( 5024 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6198 -1.6198 -1.6193 -1.6193 -0.4298 -0.4298 -0.4285 -0.4285 0.1883 0.1883 0.1927 0.1927 0.5002 0.5002 0.5038 0.5038 1.0836 1.0836 1.0843 1.0843 2.2901 2.2901 2.2916 2.2916 2.4749 2.4749 2.4750 2.4750 2.6724 2.6724 2.6726 2.6726 3.4359 3.4359 3.4365 3.4365 4.0229 4.0229 4.0266 4.0266 5.8294 5.8294 5.8321 5.8321 10.1786 10.1786 10.1793 10.1793 12.2829 12.2829 k = 0.5000-0.0000 0.0101 ( 5026 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6195 -1.6195 -1.6192 -1.6192 -0.4331 -0.4331 -0.4324 -0.4324 0.2013 0.2013 0.2037 0.2037 0.4920 0.4920 0.4940 0.4940 1.0840 1.0840 1.0844 1.0844 2.2902 2.2902 2.2910 2.2910 2.4751 2.4751 2.4752 2.4752 2.6725 2.6725 2.6726 2.6726 3.4367 3.4367 3.4370 3.4370 4.0237 4.0237 4.0256 4.0256 5.8300 5.8300 5.8314 5.8314 10.1755 10.1755 10.1758 10.1758 12.3184 12.3184 k = 0.5000-0.0000-0.0000 ( 5034 PWs) bands (ev): -10.7164 -10.7164 -10.7163 -10.7163 -10.7071 -10.7071 -10.7071 -10.7071 -1.6193 -1.6193 -1.6192 -1.6192 -0.4340 -0.4340 -0.4340 -0.4340 0.2067 0.2067 0.2067 0.2067 0.4897 0.4897 0.4898 0.4898 1.0842 1.0842 1.0843 1.0843 2.2905 2.2905 2.2905 2.2905 2.4751 2.4751 2.4752 2.4752 2.6725 2.6725 2.6726 2.6726 3.4370 3.4370 3.4371 3.4371 4.0246 4.0246 4.0246 4.0246 5.8306 5.8306 5.8307 5.8307 10.1745 10.1745 10.1746 10.1746 12.3356 12.3356 k = 0.5000 0.4385-0.0000 ( 5036 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4432 -1.4432 -1.4417 -1.4417 -0.2367 -0.2367 -0.2365 -0.2365 -0.0190 -0.0190 -0.0113 -0.0113 0.0877 0.0877 0.0881 0.0881 0.4536 0.4536 0.4546 0.4546 1.9704 1.9704 1.9799 1.9799 2.6002 2.6002 2.6176 2.6176 2.7046 2.7046 2.7166 2.7166 3.9188 3.9188 3.9529 3.9529 4.1716 4.1716 4.2087 4.2087 5.7597 5.7597 5.7654 5.7654 9.0307 9.0307 9.0470 9.0470 10.3967 10.3967 k = 0.5000 0.4385 0.0101 ( 5032 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4432 -1.4432 -1.4416 -1.4416 -0.2373 -0.2373 -0.2372 -0.2372 -0.0200 -0.0200 -0.0125 -0.0125 0.0898 0.0898 0.0903 0.0903 0.4533 0.4533 0.4543 0.4543 1.9701 1.9701 1.9795 1.9795 2.6003 2.6003 2.6176 2.6176 2.7047 2.7047 2.7166 2.7166 3.9193 3.9193 3.9533 3.9533 4.1715 4.1715 4.2084 4.2084 5.7594 5.7594 5.7651 5.7651 9.0317 9.0317 9.0479 9.0479 10.3969 10.3969 k = 0.5000 0.4385 0.0203 ( 5032 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4431 -1.4431 -1.4415 -1.4415 -0.2392 -0.2392 -0.2391 -0.2391 -0.0227 -0.0227 -0.0158 -0.0158 0.0958 0.0958 0.0967 0.0967 0.4523 0.4523 0.4533 0.4533 1.9690 1.9690 1.9783 1.9783 2.6007 2.6007 2.6177 2.6177 2.7048 2.7048 2.7165 2.7165 3.9208 3.9208 3.9544 3.9544 4.1710 4.1710 4.2076 4.2076 5.7585 5.7585 5.7641 5.7641 9.0347 9.0347 9.0507 9.0507 10.3975 10.3975 k = 0.5000 0.4385 0.0304 ( 5032 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4428 -1.4428 -1.4414 -1.4414 -0.2421 -0.2421 -0.2421 -0.2421 -0.0265 -0.0265 -0.0203 -0.0203 0.1049 0.1049 0.1062 0.1062 0.4507 0.4507 0.4517 0.4517 1.9674 1.9674 1.9764 1.9764 2.6013 2.6013 2.6180 2.6180 2.7050 2.7050 2.7164 2.7164 3.9231 3.9231 3.9563 3.9563 4.1702 4.1702 4.2062 4.2062 5.7570 5.7570 5.7624 5.7624 9.0395 9.0395 9.0552 9.0552 10.3986 10.3986 k = 0.5000 0.4385 0.0405 ( 5048 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4425 -1.4425 -1.4411 -1.4411 -0.2461 -0.2461 -0.2460 -0.2460 -0.0308 -0.0308 -0.0253 -0.0253 0.1162 0.1162 0.1179 0.1179 0.4485 0.4485 0.4494 0.4494 1.9652 1.9652 1.9739 1.9739 2.6021 2.6021 2.6182 2.6182 2.7053 2.7053 2.7163 2.7163 3.9263 3.9263 3.9587 3.9587 4.1691 4.1691 4.2043 4.2043 5.7550 5.7550 5.7602 5.7602 9.0460 9.0460 9.0611 9.0611 10.4001 10.4001 k = 0.5000 0.4385 0.0507 ( 5056 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4422 -1.4422 -1.4408 -1.4408 -0.2509 -0.2509 -0.2506 -0.2506 -0.0350 -0.0350 -0.0302 -0.0302 0.1290 0.1290 0.1309 0.1309 0.4457 0.4457 0.4466 0.4466 1.9625 1.9625 1.9708 1.9708 2.6032 2.6032 2.6185 2.6185 2.7057 2.7057 2.7161 2.7161 3.9303 3.9303 3.9617 3.9617 4.1678 4.1678 4.2019 4.2019 5.7525 5.7525 5.7575 5.7575 9.0539 9.0539 9.0684 9.0684 10.4018 10.4018 k = 0.5000 0.4385 0.0608 ( 5060 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4418 -1.4418 -1.4405 -1.4405 -0.2562 -0.2562 -0.2558 -0.2558 -0.0388 -0.0388 -0.0348 -0.0348 0.1427 0.1427 0.1447 0.1447 0.4424 0.4424 0.4433 0.4433 1.9596 1.9596 1.9673 1.9673 2.6044 2.6044 2.6188 2.6188 2.7061 2.7061 2.7159 2.7159 3.9349 3.9349 3.9650 3.9650 4.1664 4.1664 4.1991 4.1991 5.7498 5.7498 5.7544 5.7544 9.0630 9.0630 9.0766 9.0766 10.4038 10.4038 k = 0.5000 0.4385 0.0709 ( 5056 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4413 -1.4413 -1.4401 -1.4401 -0.2617 -0.2617 -0.2612 -0.2612 -0.0422 -0.0422 -0.0388 -0.0388 0.1567 0.1567 0.1588 0.1588 0.4387 0.4387 0.4395 0.4395 1.9564 1.9564 1.9636 1.9636 2.6058 2.6058 2.6190 2.6190 2.7066 2.7066 2.7157 2.7157 3.9400 3.9400 3.9685 3.9685 4.1650 4.1650 4.1959 4.1959 5.7470 5.7470 5.7512 5.7512 9.0728 9.0728 9.0854 9.0854 10.4059 10.4059 k = 0.5000 0.4385 0.0811 ( 5048 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4408 -1.4408 -1.4398 -1.4398 -0.2671 -0.2671 -0.2666 -0.2666 -0.0451 -0.0451 -0.0422 -0.0422 0.1706 0.1706 0.1726 0.1726 0.4346 0.4346 0.4353 0.4353 1.9532 1.9532 1.9597 1.9597 2.6073 2.6073 2.6193 2.6193 2.7072 2.7072 2.7154 2.7154 3.9455 3.9455 3.9720 3.9720 4.1637 4.1637 4.1923 4.1923 5.7441 5.7441 5.7479 5.7479 9.0829 9.0829 9.0943 9.0943 10.4081 10.4081 k = 0.5000 0.4385 0.0912 ( 5040 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4404 -1.4404 -1.4394 -1.4394 -0.2724 -0.2724 -0.2719 -0.2719 -0.0474 -0.0474 -0.0451 -0.0451 0.1840 0.1840 0.1859 0.1859 0.4303 0.4303 0.4309 0.4309 1.9501 1.9501 1.9558 1.9558 2.6088 2.6088 2.6194 2.6194 2.7079 2.7079 2.7151 2.7151 3.9512 3.9512 3.9753 3.9753 4.1626 4.1626 4.1885 4.1885 5.7413 5.7413 5.7446 5.7446 9.0930 9.0930 9.1031 9.1031 10.4102 10.4102 k = 0.5000 0.4385 0.1013 ( 5036 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5616 -10.5616 -1.4399 -1.4399 -1.4391 -1.4391 -0.2772 -0.2772 -0.2767 -0.2767 -0.0493 -0.0493 -0.0474 -0.0474 0.1964 0.1964 0.1981 0.1981 0.4260 0.4260 0.4265 0.4265 1.9473 1.9473 1.9522 1.9522 2.6103 2.6103 2.6194 2.6194 2.7085 2.7085 2.7147 2.7147 3.9570 3.9570 3.9781 3.9781 4.1618 4.1618 4.1846 4.1846 5.7387 5.7387 5.7415 5.7415 9.1025 9.1025 9.1112 9.1112 10.4122 10.4122 k = 0.5000 0.4385 0.1115 ( 5040 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5617 -10.5617 -1.4395 -1.4395 -1.4389 -1.4389 -0.2813 -0.2813 -0.2809 -0.2809 -0.0507 -0.0507 -0.0492 -0.0492 0.2075 0.2075 0.2089 0.2089 0.4218 0.4218 0.4223 0.4223 1.9449 1.9449 1.9489 1.9489 2.6118 2.6118 2.6192 2.6192 2.7092 2.7092 2.7143 2.7143 3.9625 3.9625 3.9802 3.9802 4.1615 4.1615 4.1805 4.1805 5.7364 5.7364 5.7387 5.7387 9.1112 9.1112 9.1183 9.1183 10.4140 10.4140 k = 0.5000 0.4385 0.1216 ( 5036 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5618 -10.5618 -10.5617 -10.5617 -1.4391 -1.4391 -1.4387 -1.4387 -0.2847 -0.2847 -0.2844 -0.2844 -0.0517 -0.0517 -0.0506 -0.0506 0.2168 0.2168 0.2179 0.2179 0.4182 0.4182 0.4185 0.4185 1.9430 1.9430 1.9460 1.9460 2.6133 2.6133 2.6189 2.6189 2.7099 2.7099 2.7138 2.7138 3.9676 3.9676 3.9814 3.9814 4.1618 4.1618 4.1766 4.1766 5.7346 5.7346 5.7364 5.7364 9.1186 9.1186 9.1240 9.1240 10.4155 10.4155 k = 0.5000 0.4385 0.1317 ( 5040 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5617 -10.5617 -10.5617 -10.5617 -1.4389 -1.4389 -1.4385 -1.4385 -0.2872 -0.2872 -0.2869 -0.2869 -0.0524 -0.0524 -0.0517 -0.0517 0.2239 0.2239 0.2247 0.2247 0.4152 0.4152 0.4154 0.4154 1.9417 1.9417 1.9438 1.9438 2.6146 2.6146 2.6184 2.6184 2.7106 2.7106 2.7132 2.7132 3.9722 3.9722 3.9817 3.9817 4.1627 4.1627 4.1729 4.1729 5.7334 5.7334 5.7345 5.7345 9.1244 9.1244 9.1280 9.1280 10.4166 10.4166 k = 0.5000 0.4385 0.1419 ( 5036 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5617 -10.5617 -10.5617 -10.5617 -1.4387 -1.4387 -1.4385 -1.4385 -0.2887 -0.2887 -0.2885 -0.2885 -0.0527 -0.0527 -0.0523 -0.0523 0.2284 0.2284 0.2288 0.2288 0.4133 0.4133 0.4134 0.4134 1.9411 1.9411 1.9422 1.9422 2.6158 2.6158 2.6177 2.6177 2.7113 2.7113 2.7126 2.7126 3.9760 3.9760 3.9809 3.9809 4.1643 4.1643 4.1695 4.1695 5.7327 5.7327 5.7333 5.7333 9.1283 9.1283 9.1302 9.1302 10.4173 10.4173 k = 0.5000 0.4385 0.1520 ( 5024 PWs) bands (ev): -10.6659 -10.6659 -10.6658 -10.6658 -10.5617 -10.5617 -10.5617 -10.5617 -1.4385 -1.4385 -1.4385 -1.4385 -0.2891 -0.2891 -0.2891 -0.2891 -0.0527 -0.0527 -0.0527 -0.0527 0.2301 0.2301 0.2301 0.2301 0.4127 0.4127 0.4127 0.4127 1.9413 1.9413 1.9413 1.9413 2.6169 2.6169 2.6170 2.6170 2.7120 2.7120 2.7120 2.7120 3.9789 3.9789 3.9790 3.9790 4.1666 4.1666 4.1667 4.1667 5.7327 5.7327 5.7327 5.7327 9.1303 9.1303 9.1303 9.1303 10.4176 10.4176 Writing output data file PdCl2.save init_run : 0.73s CPU 1.01s WALL ( 1 calls) electrons : 553.01s CPU 557.83s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.05s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 553.01s CPU 557.82s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.03s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.02s WALL ( 1 calls) newd : 0.38s CPU 0.38s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.07s WALL ( 428 calls) cegterg : 521.57s CPU 525.76s WALL ( 995 calls) Called by sum_band: Called by *egterg: h_psi : 285.87s CPU 295.93s WALL ( 17221 calls) s_psi : 36.71s CPU 37.18s WALL ( 17221 calls) g_psi : 0.75s CPU 0.75s WALL ( 15798 calls) cdiaghg : 149.31s CPU 143.18s WALL ( 16226 calls) cegterg:over : 29.42s CPU 27.19s WALL ( 15798 calls) cegterg:upda : 9.59s CPU 14.27s WALL ( 15798 calls) cegterg:last : 8.44s CPU 9.44s WALL ( 2279 calls) Called by h_psi: h_psi:vloc : 243.78s CPU 246.98s WALL ( 17221 calls) h_psi:vnl : 41.92s CPU 48.43s WALL ( 17221 calls) add_vuspsi : 22.48s CPU 26.48s WALL ( 17221 calls) General routines calbec : 19.43s CPU 21.90s WALL ( 17221 calls) fft : 0.04s CPU 0.07s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 241.75s CPU 233.59s WALL ( 1639800 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.04s CPU 0.23s WALL ( 856 calls) Parallel routines fft_scatter : 231.03s CPU 173.14s WALL ( 1639823 calls) PWSCF : 9m52.43s CPU 10m 9.56s WALL This run was terminated on: 16:47:55 16Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=