Program PWSCF v.5.1.1 starts on 16Jul2015 at 16:36:24 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: ./CoTe2.save/ file Co.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P 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 43 33 9 1693 1141 181 Max 44 34 10 1700 1162 188 Sum 1393 1073 319 54247 36835 5949 bravais-lattice index = 14 lattice parameter (alat) = 7.3359 a.u. unit-cell volume = 874.6061 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 42.00 number of Kohn-Sham states= 50 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.335916 celldm(2)= 1.365533 celldm(3)= 1.622360 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 1.365533 0.000000 ) a(3) = ( 0.000000 0.000000 1.622360 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.732315 -0.000000 ) b(3) = ( 0.000000 0.000000 0.616386 ) PseudoPot. # 1 for Co read from file: /home/autes/Pseudo/Co.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6e843fd57bb34a371311d5dc8eddf880 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1193 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 Te read from file: /home/autes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 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 Co 9.00 58.93320 Co( 1.00) Te 6.00 127.60000 Te( 1.00) 8 Sym. Ops., with inversion, found ( 4 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.6827666 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8111798 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.6827666 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.8111798 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 6) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.6827666 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.8111798 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.6827666 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8111798 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 C2' -C2' 3 -3 C2'' -C2'' 4 -4 i 5 s_v -s_v 6 -6 s_v'-s_v' 7 -7 s_v''-s_v' 8 -8 -E -1 -i -5 Cartesian axes number of k points= 396 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 2) = ( 0.0121951 -0.0000000 -0.0000000), wk = 0.0025253 k( 3) = ( 0.0243902 -0.0000000 -0.0000000), wk = 0.0025253 k( 4) = ( 0.0365854 -0.0000000 -0.0000000), wk = 0.0025253 k( 5) = ( 0.0487805 -0.0000000 -0.0000000), wk = 0.0025253 k( 6) = ( 0.0609756 -0.0000000 -0.0000000), wk = 0.0025253 k( 7) = ( 0.0731707 -0.0000000 -0.0000000), wk = 0.0025253 k( 8) = ( 0.0853658 -0.0000000 -0.0000000), wk = 0.0025253 k( 9) = ( 0.0975610 -0.0000000 -0.0000000), wk = 0.0025253 k( 10) = ( 0.1097561 -0.0000000 -0.0000000), wk = 0.0025253 k( 11) = ( 0.1219512 -0.0000000 -0.0000000), wk = 0.0025253 k( 12) = ( 0.1341463 -0.0000000 -0.0000000), wk = 0.0025253 k( 13) = ( 0.1463415 -0.0000000 -0.0000000), wk = 0.0025253 k( 14) = ( 0.1585366 -0.0000000 -0.0000000), wk = 0.0025253 k( 15) = ( 0.1707317 -0.0000000 -0.0000000), wk = 0.0025253 k( 16) = ( 0.1829268 -0.0000000 -0.0000000), wk = 0.0025253 k( 17) = ( 0.1951219 -0.0000000 -0.0000000), wk = 0.0025253 k( 18) = ( 0.2073171 -0.0000000 -0.0000000), wk = 0.0025253 k( 19) = ( 0.2195122 -0.0000000 -0.0000000), wk = 0.0025253 k( 20) = ( 0.2317073 -0.0000000 -0.0000000), wk = 0.0025253 k( 21) = ( 0.2439024 -0.0000000 -0.0000000), wk = 0.0025253 k( 22) = ( 0.2560976 -0.0000000 -0.0000000), wk = 0.0025253 k( 23) = ( 0.2682927 -0.0000000 -0.0000000), wk = 0.0025253 k( 24) = ( 0.2804878 -0.0000000 -0.0000000), wk = 0.0025253 k( 25) = ( 0.2926829 -0.0000000 -0.0000000), wk = 0.0025253 k( 26) = ( 0.3048781 -0.0000000 -0.0000000), wk = 0.0025253 k( 27) = ( 0.3170732 -0.0000000 -0.0000000), wk = 0.0025253 k( 28) = ( 0.3292683 -0.0000000 -0.0000000), wk = 0.0025253 k( 29) = ( 0.3414634 -0.0000000 -0.0000000), wk = 0.0025253 k( 30) = ( 0.3536585 -0.0000000 -0.0000000), wk = 0.0025253 k( 31) = ( 0.3658537 -0.0000000 -0.0000000), wk = 0.0025253 k( 32) = ( 0.3780488 -0.0000000 -0.0000000), wk = 0.0025253 k( 33) = ( 0.3902439 -0.0000000 -0.0000000), wk = 0.0025253 k( 34) = ( 0.4024390 -0.0000000 -0.0000000), wk = 0.0025253 k( 35) = ( 0.4146341 -0.0000000 -0.0000000), wk = 0.0025253 k( 36) = ( 0.4268293 -0.0000000 -0.0000000), wk = 0.0025253 k( 37) = ( 0.4390244 -0.0000000 -0.0000000), wk = 0.0025253 k( 38) = ( 0.4512195 -0.0000000 -0.0000000), wk = 0.0025253 k( 39) = ( 0.4634146 -0.0000000 -0.0000000), wk = 0.0025253 k( 40) = ( 0.4756098 -0.0000000 -0.0000000), wk = 0.0025253 k( 41) = ( 0.4878049 -0.0000000 -0.0000000), wk = 0.0025253 k( 42) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 43) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 44) = ( 0.5000000 0.0122052 -0.0000000), wk = 0.0025253 k( 45) = ( 0.5000000 0.0244105 -0.0000000), wk = 0.0025253 k( 46) = ( 0.5000000 0.0366157 -0.0000000), wk = 0.0025253 k( 47) = ( 0.5000000 0.0488210 -0.0000000), wk = 0.0025253 k( 48) = ( 0.5000000 0.0610262 -0.0000000), wk = 0.0025253 k( 49) = ( 0.5000000 0.0732315 -0.0000000), wk = 0.0025253 k( 50) = ( 0.5000000 0.0854367 -0.0000000), wk = 0.0025253 k( 51) = ( 0.5000000 0.0976420 -0.0000000), wk = 0.0025253 k( 52) = ( 0.5000000 0.1098472 -0.0000000), wk = 0.0025253 k( 53) = ( 0.5000000 0.1220524 -0.0000000), wk = 0.0025253 k( 54) = ( 0.5000000 0.1342577 -0.0000000), wk = 0.0025253 k( 55) = ( 0.5000000 0.1464629 -0.0000000), wk = 0.0025253 k( 56) = ( 0.5000000 0.1586682 -0.0000000), wk = 0.0025253 k( 57) = ( 0.5000000 0.1708734 -0.0000000), wk = 0.0025253 k( 58) = ( 0.5000000 0.1830787 -0.0000000), wk = 0.0025253 k( 59) = ( 0.5000000 0.1952839 -0.0000000), wk = 0.0025253 k( 60) = ( 0.5000000 0.2074892 -0.0000000), wk = 0.0025253 k( 61) = ( 0.5000000 0.2196944 -0.0000000), wk = 0.0025253 k( 62) = ( 0.5000000 0.2318996 -0.0000000), wk = 0.0025253 k( 63) = ( 0.5000000 0.2441049 -0.0000000), wk = 0.0025253 k( 64) = ( 0.5000000 0.2563101 -0.0000000), wk = 0.0025253 k( 65) = ( 0.5000000 0.2685154 -0.0000000), wk = 0.0025253 k( 66) = ( 0.5000000 0.2807206 -0.0000000), wk = 0.0025253 k( 67) = ( 0.5000000 0.2929259 -0.0000000), wk = 0.0025253 k( 68) = ( 0.5000000 0.3051311 -0.0000000), wk = 0.0025253 k( 69) = ( 0.5000000 0.3173363 -0.0000000), wk = 0.0025253 k( 70) = ( 0.5000000 0.3295416 -0.0000000), wk = 0.0025253 k( 71) = ( 0.5000000 0.3417468 -0.0000000), wk = 0.0025253 k( 72) = ( 0.5000000 0.3539521 -0.0000000), wk = 0.0025253 k( 73) = ( 0.5000000 0.3661573 -0.0000000), wk = 0.0025253 k( 74) = ( 0.5000000 0.3661573 -0.0000000), wk = 0.0025253 k( 75) = ( 0.4878049 0.3661573 -0.0000000), wk = 0.0025253 k( 76) = ( 0.4756098 0.3661573 -0.0000000), wk = 0.0025253 k( 77) = ( 0.4634146 0.3661573 -0.0000000), wk = 0.0025253 k( 78) = ( 0.4512195 0.3661573 -0.0000000), wk = 0.0025253 k( 79) = ( 0.4390244 0.3661573 -0.0000000), wk = 0.0025253 k( 80) = ( 0.4268293 0.3661573 -0.0000000), wk = 0.0025253 k( 81) = ( 0.4146341 0.3661573 -0.0000000), wk = 0.0025253 k( 82) = ( 0.4024390 0.3661573 -0.0000000), wk = 0.0025253 k( 83) = ( 0.3902439 0.3661573 -0.0000000), wk = 0.0025253 k( 84) = ( 0.3780488 0.3661573 -0.0000000), wk = 0.0025253 k( 85) = ( 0.3658537 0.3661573 -0.0000000), wk = 0.0025253 k( 86) = ( 0.3536585 0.3661573 -0.0000000), wk = 0.0025253 k( 87) = ( 0.3414634 0.3661573 -0.0000000), wk = 0.0025253 k( 88) = ( 0.3292683 0.3661573 -0.0000000), wk = 0.0025253 k( 89) = ( 0.3170732 0.3661573 -0.0000000), wk = 0.0025253 k( 90) = ( 0.3048781 0.3661573 -0.0000000), wk = 0.0025253 k( 91) = ( 0.2926829 0.3661573 -0.0000000), wk = 0.0025253 k( 92) = ( 0.2804878 0.3661573 -0.0000000), wk = 0.0025253 k( 93) = ( 0.2682927 0.3661573 -0.0000000), wk = 0.0025253 k( 94) = ( 0.2560976 0.3661573 -0.0000000), wk = 0.0025253 k( 95) = ( 0.2439024 0.3661573 -0.0000000), wk = 0.0025253 k( 96) = ( 0.2317073 0.3661573 -0.0000000), wk = 0.0025253 k( 97) = ( 0.2195122 0.3661573 -0.0000000), wk = 0.0025253 k( 98) = ( 0.2073171 0.3661573 -0.0000000), wk = 0.0025253 k( 99) = ( 0.1951219 0.3661573 -0.0000000), wk = 0.0025253 k( 100) = ( 0.1829268 0.3661573 -0.0000000), wk = 0.0025253 k( 101) = ( 0.1707317 0.3661573 -0.0000000), wk = 0.0025253 k( 102) = ( 0.1585366 0.3661573 -0.0000000), wk = 0.0025253 k( 103) = ( 0.1463415 0.3661573 -0.0000000), wk = 0.0025253 k( 104) = ( 0.1341463 0.3661573 -0.0000000), wk = 0.0025253 k( 105) = ( 0.1219512 0.3661573 -0.0000000), wk = 0.0025253 k( 106) = ( 0.1097561 0.3661573 -0.0000000), wk = 0.0025253 k( 107) = ( 0.0975610 0.3661573 -0.0000000), wk = 0.0025253 k( 108) = ( 0.0853658 0.3661573 -0.0000000), wk = 0.0025253 k( 109) = ( 0.0731707 0.3661573 -0.0000000), wk = 0.0025253 k( 110) = ( 0.0609756 0.3661573 -0.0000000), wk = 0.0025253 k( 111) = ( 0.0487805 0.3661573 -0.0000000), wk = 0.0025253 k( 112) = ( 0.0365854 0.3661573 -0.0000000), wk = 0.0025253 k( 113) = ( 0.0243902 0.3661573 -0.0000000), wk = 0.0025253 k( 114) = ( 0.0121951 0.3661573 -0.0000000), wk = 0.0025253 k( 115) = ( 0.0000000 0.3661573 -0.0000000), wk = 0.0025253 k( 116) = ( 0.0000000 0.3661573 -0.0000000), wk = 0.0025253 k( 117) = ( 0.0000000 0.3539521 -0.0000000), wk = 0.0025253 k( 118) = ( 0.0000000 0.3417468 -0.0000000), wk = 0.0025253 k( 119) = ( 0.0000000 0.3295416 -0.0000000), wk = 0.0025253 k( 120) = ( 0.0000000 0.3173363 -0.0000000), wk = 0.0025253 k( 121) = ( 0.0000000 0.3051311 -0.0000000), wk = 0.0025253 k( 122) = ( 0.0000000 0.2929259 -0.0000000), wk = 0.0025253 k( 123) = ( 0.0000000 0.2807206 -0.0000000), wk = 0.0025253 k( 124) = ( 0.0000000 0.2685154 -0.0000000), wk = 0.0025253 k( 125) = ( 0.0000000 0.2563101 -0.0000000), wk = 0.0025253 k( 126) = ( 0.0000000 0.2441049 -0.0000000), wk = 0.0025253 k( 127) = ( 0.0000000 0.2318996 -0.0000000), wk = 0.0025253 k( 128) = ( 0.0000000 0.2196944 -0.0000000), wk = 0.0025253 k( 129) = ( 0.0000000 0.2074892 -0.0000000), wk = 0.0025253 k( 130) = ( 0.0000000 0.1952839 -0.0000000), wk = 0.0025253 k( 131) = ( 0.0000000 0.1830787 -0.0000000), wk = 0.0025253 k( 132) = ( 0.0000000 0.1708734 -0.0000000), wk = 0.0025253 k( 133) = ( 0.0000000 0.1586682 -0.0000000), wk = 0.0025253 k( 134) = ( 0.0000000 0.1464629 -0.0000000), wk = 0.0025253 k( 135) = ( 0.0000000 0.1342577 -0.0000000), wk = 0.0025253 k( 136) = ( 0.0000000 0.1220524 -0.0000000), wk = 0.0025253 k( 137) = ( 0.0000000 0.1098472 -0.0000000), wk = 0.0025253 k( 138) = ( 0.0000000 0.0976420 -0.0000000), wk = 0.0025253 k( 139) = ( 0.0000000 0.0854367 -0.0000000), wk = 0.0025253 k( 140) = ( 0.0000000 0.0732315 -0.0000000), wk = 0.0025253 k( 141) = ( 0.0000000 0.0610262 -0.0000000), wk = 0.0025253 k( 142) = ( 0.0000000 0.0488210 -0.0000000), wk = 0.0025253 k( 143) = ( 0.0000000 0.0366157 -0.0000000), wk = 0.0025253 k( 144) = ( 0.0000000 0.0244105 -0.0000000), wk = 0.0025253 k( 145) = ( 0.0000000 0.0122052 -0.0000000), wk = 0.0025253 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 148) = ( 0.0000000 0.0000000 0.0123277), wk = 0.0025253 k( 149) = ( 0.0000000 0.0000000 0.0246554), wk = 0.0025253 k( 150) = ( 0.0000000 0.0000000 0.0369832), wk = 0.0025253 k( 151) = ( 0.0000000 0.0000000 0.0493109), wk = 0.0025253 k( 152) = ( 0.0000000 0.0000000 0.0616386), wk = 0.0025253 k( 153) = ( 0.0000000 0.0000000 0.0739663), wk = 0.0025253 k( 154) = ( 0.0000000 0.0000000 0.0862941), wk = 0.0025253 k( 155) = ( 0.0000000 0.0000000 0.0986218), wk = 0.0025253 k( 156) = ( 0.0000000 0.0000000 0.1109495), wk = 0.0025253 k( 157) = ( 0.0000000 0.0000000 0.1232772), wk = 0.0025253 k( 158) = ( 0.0000000 0.0000000 0.1356050), wk = 0.0025253 k( 159) = ( 0.0000000 0.0000000 0.1479327), wk = 0.0025253 k( 160) = ( 0.0000000 0.0000000 0.1602604), wk = 0.0025253 k( 161) = ( 0.0000000 0.0000000 0.1725881), wk = 0.0025253 k( 162) = ( 0.0000000 0.0000000 0.1849158), wk = 0.0025253 k( 163) = ( 0.0000000 0.0000000 0.1972436), wk = 0.0025253 k( 164) = ( 0.0000000 0.0000000 0.2095713), wk = 0.0025253 k( 165) = ( 0.0000000 0.0000000 0.2218990), wk = 0.0025253 k( 166) = ( 0.0000000 0.0000000 0.2342267), wk = 0.0025253 k( 167) = ( 0.0000000 0.0000000 0.2465545), wk = 0.0025253 k( 168) = ( 0.0000000 0.0000000 0.2588822), wk = 0.0025253 k( 169) = ( 0.0000000 0.0000000 0.2712099), wk = 0.0025253 k( 170) = ( 0.0000000 0.0000000 0.2835376), wk = 0.0025253 k( 171) = ( 0.0000000 0.0000000 0.2958654), wk = 0.0025253 k( 172) = ( 0.0000000 0.0000000 0.3081931), wk = 0.0025253 k( 173) = ( 0.0000000 0.0000000 0.3081931), wk = 0.0025253 k( 174) = ( 0.0121951 -0.0000000 0.3081931), wk = 0.0025253 k( 175) = ( 0.0243902 -0.0000000 0.3081931), wk = 0.0025253 k( 176) = ( 0.0365854 -0.0000000 0.3081931), wk = 0.0025253 k( 177) = ( 0.0487805 -0.0000000 0.3081931), wk = 0.0025253 k( 178) = ( 0.0609756 -0.0000000 0.3081931), wk = 0.0025253 k( 179) = ( 0.0731707 -0.0000000 0.3081931), wk = 0.0025253 k( 180) = ( 0.0853658 -0.0000000 0.3081931), wk = 0.0025253 k( 181) = ( 0.0975610 -0.0000000 0.3081931), wk = 0.0025253 k( 182) = ( 0.1097561 -0.0000000 0.3081931), wk = 0.0025253 k( 183) = ( 0.1219512 -0.0000000 0.3081931), wk = 0.0025253 k( 184) = ( 0.1341463 -0.0000000 0.3081931), wk = 0.0025253 k( 185) = ( 0.1463415 -0.0000000 0.3081931), wk = 0.0025253 k( 186) = ( 0.1585366 -0.0000000 0.3081931), wk = 0.0025253 k( 187) = ( 0.1707317 -0.0000000 0.3081931), wk = 0.0025253 k( 188) = ( 0.1829268 -0.0000000 0.3081931), wk = 0.0025253 k( 189) = ( 0.1951219 -0.0000000 0.3081931), wk = 0.0025253 k( 190) = ( 0.2073171 -0.0000000 0.3081931), wk = 0.0025253 k( 191) = ( 0.2195122 -0.0000000 0.3081931), wk = 0.0025253 k( 192) = ( 0.2317073 -0.0000000 0.3081931), wk = 0.0025253 k( 193) = ( 0.2439024 -0.0000000 0.3081931), wk = 0.0025253 k( 194) = ( 0.2560976 -0.0000000 0.3081931), wk = 0.0025253 k( 195) = ( 0.2682927 -0.0000000 0.3081931), wk = 0.0025253 k( 196) = ( 0.2804878 -0.0000000 0.3081931), wk = 0.0025253 k( 197) = ( 0.2926829 -0.0000000 0.3081931), wk = 0.0025253 k( 198) = ( 0.3048781 -0.0000000 0.3081931), wk = 0.0025253 k( 199) = ( 0.3170732 -0.0000000 0.3081931), wk = 0.0025253 k( 200) = ( 0.3292683 -0.0000000 0.3081931), wk = 0.0025253 k( 201) = ( 0.3414634 -0.0000000 0.3081931), wk = 0.0025253 k( 202) = ( 0.3536585 -0.0000000 0.3081931), wk = 0.0025253 k( 203) = ( 0.3658537 -0.0000000 0.3081931), wk = 0.0025253 k( 204) = ( 0.3780488 -0.0000000 0.3081931), wk = 0.0025253 k( 205) = ( 0.3902439 -0.0000000 0.3081931), wk = 0.0025253 k( 206) = ( 0.4024390 -0.0000000 0.3081931), wk = 0.0025253 k( 207) = ( 0.4146341 -0.0000000 0.3081931), wk = 0.0025253 k( 208) = ( 0.4268293 -0.0000000 0.3081931), wk = 0.0025253 k( 209) = ( 0.4390244 -0.0000000 0.3081931), wk = 0.0025253 k( 210) = ( 0.4512195 -0.0000000 0.3081931), wk = 0.0025253 k( 211) = ( 0.4634146 -0.0000000 0.3081931), wk = 0.0025253 k( 212) = ( 0.4756098 -0.0000000 0.3081931), wk = 0.0025253 k( 213) = ( 0.4878049 -0.0000000 0.3081931), wk = 0.0025253 k( 214) = ( 0.5000000 -0.0000000 0.3081931), wk = 0.0025253 k( 215) = ( 0.5000000 -0.0000000 0.3081931), wk = 0.0025253 k( 216) = ( 0.5000000 0.0122052 0.3081931), wk = 0.0025253 k( 217) = ( 0.5000000 0.0244105 0.3081931), wk = 0.0025253 k( 218) = ( 0.5000000 0.0366157 0.3081931), wk = 0.0025253 k( 219) = ( 0.5000000 0.0488210 0.3081931), wk = 0.0025253 k( 220) = ( 0.5000000 0.0610262 0.3081931), wk = 0.0025253 k( 221) = ( 0.5000000 0.0732315 0.3081931), wk = 0.0025253 k( 222) = ( 0.5000000 0.0854367 0.3081931), wk = 0.0025253 k( 223) = ( 0.5000000 0.0976420 0.3081931), wk = 0.0025253 k( 224) = ( 0.5000000 0.1098472 0.3081931), wk = 0.0025253 k( 225) = ( 0.5000000 0.1220524 0.3081931), wk = 0.0025253 k( 226) = ( 0.5000000 0.1342577 0.3081931), wk = 0.0025253 k( 227) = ( 0.5000000 0.1464629 0.3081931), wk = 0.0025253 k( 228) = ( 0.5000000 0.1586682 0.3081931), wk = 0.0025253 k( 229) = ( 0.5000000 0.1708734 0.3081931), wk = 0.0025253 k( 230) = ( 0.5000000 0.1830787 0.3081931), wk = 0.0025253 k( 231) = ( 0.5000000 0.1952839 0.3081931), wk = 0.0025253 k( 232) = ( 0.5000000 0.2074892 0.3081931), wk = 0.0025253 k( 233) = ( 0.5000000 0.2196944 0.3081931), wk = 0.0025253 k( 234) = ( 0.5000000 0.2318996 0.3081931), wk = 0.0025253 k( 235) = ( 0.5000000 0.2441049 0.3081931), wk = 0.0025253 k( 236) = ( 0.5000000 0.2563101 0.3081931), wk = 0.0025253 k( 237) = ( 0.5000000 0.2685154 0.3081931), wk = 0.0025253 k( 238) = ( 0.5000000 0.2807206 0.3081931), wk = 0.0025253 k( 239) = ( 0.5000000 0.2929259 0.3081931), wk = 0.0025253 k( 240) = ( 0.5000000 0.3051311 0.3081931), wk = 0.0025253 k( 241) = ( 0.5000000 0.3173363 0.3081931), wk = 0.0025253 k( 242) = ( 0.5000000 0.3295416 0.3081931), wk = 0.0025253 k( 243) = ( 0.5000000 0.3417468 0.3081931), wk = 0.0025253 k( 244) = ( 0.5000000 0.3539521 0.3081931), wk = 0.0025253 k( 245) = ( 0.5000000 0.3661573 0.3081931), wk = 0.0025253 k( 246) = ( 0.5000000 0.3661573 0.3081931), wk = 0.0025253 k( 247) = ( 0.4878049 0.3661573 0.3081931), wk = 0.0025253 k( 248) = ( 0.4756098 0.3661573 0.3081931), wk = 0.0025253 k( 249) = ( 0.4634146 0.3661573 0.3081931), wk = 0.0025253 k( 250) = ( 0.4512195 0.3661573 0.3081931), wk = 0.0025253 k( 251) = ( 0.4390244 0.3661573 0.3081931), wk = 0.0025253 k( 252) = ( 0.4268293 0.3661573 0.3081931), wk = 0.0025253 k( 253) = ( 0.4146341 0.3661573 0.3081931), wk = 0.0025253 k( 254) = ( 0.4024390 0.3661573 0.3081931), wk = 0.0025253 k( 255) = ( 0.3902439 0.3661573 0.3081931), wk = 0.0025253 k( 256) = ( 0.3780488 0.3661573 0.3081931), wk = 0.0025253 k( 257) = ( 0.3658537 0.3661573 0.3081931), wk = 0.0025253 k( 258) = ( 0.3536585 0.3661573 0.3081931), wk = 0.0025253 k( 259) = ( 0.3414634 0.3661573 0.3081931), wk = 0.0025253 k( 260) = ( 0.3292683 0.3661573 0.3081931), wk = 0.0025253 k( 261) = ( 0.3170732 0.3661573 0.3081931), wk = 0.0025253 k( 262) = ( 0.3048781 0.3661573 0.3081931), wk = 0.0025253 k( 263) = ( 0.2926829 0.3661573 0.3081931), wk = 0.0025253 k( 264) = ( 0.2804878 0.3661573 0.3081931), wk = 0.0025253 k( 265) = ( 0.2682927 0.3661573 0.3081931), wk = 0.0025253 k( 266) = ( 0.2560976 0.3661573 0.3081931), wk = 0.0025253 k( 267) = ( 0.2439024 0.3661573 0.3081931), wk = 0.0025253 k( 268) = ( 0.2317073 0.3661573 0.3081931), wk = 0.0025253 k( 269) = ( 0.2195122 0.3661573 0.3081931), wk = 0.0025253 k( 270) = ( 0.2073171 0.3661573 0.3081931), wk = 0.0025253 k( 271) = ( 0.1951219 0.3661573 0.3081931), wk = 0.0025253 k( 272) = ( 0.1829268 0.3661573 0.3081931), wk = 0.0025253 k( 273) = ( 0.1707317 0.3661573 0.3081931), wk = 0.0025253 k( 274) = ( 0.1585366 0.3661573 0.3081931), wk = 0.0025253 k( 275) = ( 0.1463415 0.3661573 0.3081931), wk = 0.0025253 k( 276) = ( 0.1341463 0.3661573 0.3081931), wk = 0.0025253 k( 277) = ( 0.1219512 0.3661573 0.3081931), wk = 0.0025253 k( 278) = ( 0.1097561 0.3661573 0.3081931), wk = 0.0025253 k( 279) = ( 0.0975610 0.3661573 0.3081931), wk = 0.0025253 k( 280) = ( 0.0853658 0.3661573 0.3081931), wk = 0.0025253 k( 281) = ( 0.0731707 0.3661573 0.3081931), wk = 0.0025253 k( 282) = ( 0.0609756 0.3661573 0.3081931), wk = 0.0025253 k( 283) = ( 0.0487805 0.3661573 0.3081931), wk = 0.0025253 k( 284) = ( 0.0365854 0.3661573 0.3081931), wk = 0.0025253 k( 285) = ( 0.0243902 0.3661573 0.3081931), wk = 0.0025253 k( 286) = ( 0.0121951 0.3661573 0.3081931), wk = 0.0025253 k( 287) = ( 0.0000000 0.3661573 0.3081931), wk = 0.0025253 k( 288) = ( 0.0000000 0.3661573 0.3081931), wk = 0.0025253 k( 289) = ( 0.0000000 0.3539521 0.3081931), wk = 0.0025253 k( 290) = ( 0.0000000 0.3417468 0.3081931), wk = 0.0025253 k( 291) = ( 0.0000000 0.3295416 0.3081931), wk = 0.0025253 k( 292) = ( 0.0000000 0.3173363 0.3081931), wk = 0.0025253 k( 293) = ( 0.0000000 0.3051311 0.3081931), wk = 0.0025253 k( 294) = ( 0.0000000 0.2929259 0.3081931), wk = 0.0025253 k( 295) = ( 0.0000000 0.2807206 0.3081931), wk = 0.0025253 k( 296) = ( 0.0000000 0.2685154 0.3081931), wk = 0.0025253 k( 297) = ( 0.0000000 0.2563101 0.3081931), wk = 0.0025253 k( 298) = ( 0.0000000 0.2441049 0.3081931), wk = 0.0025253 k( 299) = ( 0.0000000 0.2318996 0.3081931), wk = 0.0025253 k( 300) = ( 0.0000000 0.2196944 0.3081931), wk = 0.0025253 k( 301) = ( 0.0000000 0.2074892 0.3081931), wk = 0.0025253 k( 302) = ( 0.0000000 0.1952839 0.3081931), wk = 0.0025253 k( 303) = ( 0.0000000 0.1830787 0.3081931), wk = 0.0025253 k( 304) = ( 0.0000000 0.1708734 0.3081931), wk = 0.0025253 k( 305) = ( 0.0000000 0.1586682 0.3081931), wk = 0.0025253 k( 306) = ( 0.0000000 0.1464629 0.3081931), wk = 0.0025253 k( 307) = ( 0.0000000 0.1342577 0.3081931), wk = 0.0025253 k( 308) = ( 0.0000000 0.1220524 0.3081931), wk = 0.0025253 k( 309) = ( 0.0000000 0.1098472 0.3081931), wk = 0.0025253 k( 310) = ( 0.0000000 0.0976420 0.3081931), wk = 0.0025253 k( 311) = ( 0.0000000 0.0854367 0.3081931), wk = 0.0025253 k( 312) = ( 0.0000000 0.0732315 0.3081931), wk = 0.0025253 k( 313) = ( 0.0000000 0.0610262 0.3081931), wk = 0.0025253 k( 314) = ( 0.0000000 0.0488210 0.3081931), wk = 0.0025253 k( 315) = ( 0.0000000 0.0366157 0.3081931), wk = 0.0025253 k( 316) = ( 0.0000000 0.0244105 0.3081931), wk = 0.0025253 k( 317) = ( 0.0000000 0.0122052 0.3081931), wk = 0.0025253 k( 318) = ( 0.0000000 0.0000000 0.3081931), wk = 0.0025253 k( 319) = ( 0.0000000 0.3661573 -0.0000000), wk = 0.0025253 k( 320) = ( 0.0000000 0.3661573 0.0123277), wk = 0.0025253 k( 321) = ( 0.0000000 0.3661573 0.0246554), wk = 0.0025253 k( 322) = ( 0.0000000 0.3661573 0.0369832), wk = 0.0025253 k( 323) = ( 0.0000000 0.3661573 0.0493109), wk = 0.0025253 k( 324) = ( 0.0000000 0.3661573 0.0616386), wk = 0.0025253 k( 325) = ( 0.0000000 0.3661573 0.0739663), wk = 0.0025253 k( 326) = ( 0.0000000 0.3661573 0.0862941), wk = 0.0025253 k( 327) = ( 0.0000000 0.3661573 0.0986218), wk = 0.0025253 k( 328) = ( 0.0000000 0.3661573 0.1109495), wk = 0.0025253 k( 329) = ( 0.0000000 0.3661573 0.1232772), wk = 0.0025253 k( 330) = ( 0.0000000 0.3661573 0.1356050), wk = 0.0025253 k( 331) = ( 0.0000000 0.3661573 0.1479327), wk = 0.0025253 k( 332) = ( 0.0000000 0.3661573 0.1602604), wk = 0.0025253 k( 333) = ( 0.0000000 0.3661573 0.1725881), wk = 0.0025253 k( 334) = ( 0.0000000 0.3661573 0.1849158), wk = 0.0025253 k( 335) = ( 0.0000000 0.3661573 0.1972436), wk = 0.0025253 k( 336) = ( 0.0000000 0.3661573 0.2095713), wk = 0.0025253 k( 337) = ( 0.0000000 0.3661573 0.2218990), wk = 0.0025253 k( 338) = ( 0.0000000 0.3661573 0.2342267), wk = 0.0025253 k( 339) = ( 0.0000000 0.3661573 0.2465545), wk = 0.0025253 k( 340) = ( 0.0000000 0.3661573 0.2588822), wk = 0.0025253 k( 341) = ( 0.0000000 0.3661573 0.2712099), wk = 0.0025253 k( 342) = ( 0.0000000 0.3661573 0.2835376), wk = 0.0025253 k( 343) = ( 0.0000000 0.3661573 0.2958654), wk = 0.0025253 k( 344) = ( 0.0000000 0.3661573 0.3081931), wk = 0.0025253 k( 345) = ( 0.5000000 -0.0000000 0.3081931), wk = 0.0025253 k( 346) = ( 0.5000000 -0.0000000 0.2958654), wk = 0.0025253 k( 347) = ( 0.5000000 -0.0000000 0.2835376), wk = 0.0025253 k( 348) = ( 0.5000000 -0.0000000 0.2712099), wk = 0.0025253 k( 349) = ( 0.5000000 -0.0000000 0.2588822), wk = 0.0025253 k( 350) = ( 0.5000000 -0.0000000 0.2465545), wk = 0.0025253 k( 351) = ( 0.5000000 -0.0000000 0.2342267), wk = 0.0025253 k( 352) = ( 0.5000000 -0.0000000 0.2218990), wk = 0.0025253 k( 353) = ( 0.5000000 -0.0000000 0.2095713), wk = 0.0025253 k( 354) = ( 0.5000000 -0.0000000 0.1972436), wk = 0.0025253 k( 355) = ( 0.5000000 -0.0000000 0.1849158), wk = 0.0025253 k( 356) = ( 0.5000000 -0.0000000 0.1725881), wk = 0.0025253 k( 357) = ( 0.5000000 -0.0000000 0.1602604), wk = 0.0025253 k( 358) = ( 0.5000000 -0.0000000 0.1479327), wk = 0.0025253 k( 359) = ( 0.5000000 -0.0000000 0.1356050), wk = 0.0025253 k( 360) = ( 0.5000000 -0.0000000 0.1232772), wk = 0.0025253 k( 361) = ( 0.5000000 -0.0000000 0.1109495), wk = 0.0025253 k( 362) = ( 0.5000000 -0.0000000 0.0986218), wk = 0.0025253 k( 363) = ( 0.5000000 -0.0000000 0.0862941), wk = 0.0025253 k( 364) = ( 0.5000000 -0.0000000 0.0739663), wk = 0.0025253 k( 365) = ( 0.5000000 -0.0000000 0.0616386), wk = 0.0025253 k( 366) = ( 0.5000000 -0.0000000 0.0493109), wk = 0.0025253 k( 367) = ( 0.5000000 -0.0000000 0.0369832), wk = 0.0025253 k( 368) = ( 0.5000000 -0.0000000 0.0246554), wk = 0.0025253 k( 369) = ( 0.5000000 -0.0000000 0.0123277), wk = 0.0025253 k( 370) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 371) = ( 0.5000000 0.3661573 -0.0000000), wk = 0.0025253 k( 372) = ( 0.5000000 0.3661573 0.0123277), wk = 0.0025253 k( 373) = ( 0.5000000 0.3661573 0.0246554), wk = 0.0025253 k( 374) = ( 0.5000000 0.3661573 0.0369832), wk = 0.0025253 k( 375) = ( 0.5000000 0.3661573 0.0493109), wk = 0.0025253 k( 376) = ( 0.5000000 0.3661573 0.0616386), wk = 0.0025253 k( 377) = ( 0.5000000 0.3661573 0.0739663), wk = 0.0025253 k( 378) = ( 0.5000000 0.3661573 0.0862941), wk = 0.0025253 k( 379) = ( 0.5000000 0.3661573 0.0986218), wk = 0.0025253 k( 380) = ( 0.5000000 0.3661573 0.1109495), wk = 0.0025253 k( 381) = ( 0.5000000 0.3661573 0.1232772), wk = 0.0025253 k( 382) = ( 0.5000000 0.3661573 0.1356050), wk = 0.0025253 k( 383) = ( 0.5000000 0.3661573 0.1479327), wk = 0.0025253 k( 384) = ( 0.5000000 0.3661573 0.1602604), wk = 0.0025253 k( 385) = ( 0.5000000 0.3661573 0.1725881), wk = 0.0025253 k( 386) = ( 0.5000000 0.3661573 0.1849158), wk = 0.0025253 k( 387) = ( 0.5000000 0.3661573 0.1972436), wk = 0.0025253 k( 388) = ( 0.5000000 0.3661573 0.2095713), wk = 0.0025253 k( 389) = ( 0.5000000 0.3661573 0.2218990), wk = 0.0025253 k( 390) = ( 0.5000000 0.3661573 0.2342267), wk = 0.0025253 k( 391) = ( 0.5000000 0.3661573 0.2465545), wk = 0.0025253 k( 392) = ( 0.5000000 0.3661573 0.2588822), wk = 0.0025253 k( 393) = ( 0.5000000 0.3661573 0.2712099), wk = 0.0025253 k( 394) = ( 0.5000000 0.3661573 0.2835376), wk = 0.0025253 k( 395) = ( 0.5000000 0.3661573 0.2958654), wk = 0.0025253 k( 396) = ( 0.5000000 0.3661573 0.3081931), wk = 0.0025253 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 2) = ( 0.0121951 -0.0000000 0.0000000), wk = 0.0025253 k( 3) = ( 0.0243902 -0.0000000 0.0000000), wk = 0.0025253 k( 4) = ( 0.0365854 0.0000000 0.0000000), wk = 0.0025253 k( 5) = ( 0.0487805 -0.0000000 0.0000000), wk = 0.0025253 k( 6) = ( 0.0609756 0.0000000 0.0000000), wk = 0.0025253 k( 7) = ( 0.0731707 0.0000000 0.0000000), wk = 0.0025253 k( 8) = ( 0.0853658 -0.0000000 0.0000000), wk = 0.0025253 k( 9) = ( 0.0975610 -0.0000000 0.0000000), wk = 0.0025253 k( 10) = ( 0.1097561 0.0000000 0.0000000), wk = 0.0025253 k( 11) = ( 0.1219512 0.0000000 0.0000000), wk = 0.0025253 k( 12) = ( 0.1341463 0.0000000 0.0000000), wk = 0.0025253 k( 13) = ( 0.1463415 0.0000000 0.0000000), wk = 0.0025253 k( 14) = ( 0.1585366 -0.0000000 0.0000000), wk = 0.0025253 k( 15) = ( 0.1707317 0.0000000 0.0000000), wk = 0.0025253 k( 16) = ( 0.1829268 -0.0000000 0.0000000), wk = 0.0025253 k( 17) = ( 0.1951219 0.0000000 0.0000000), wk = 0.0025253 k( 18) = ( 0.2073171 0.0000000 0.0000000), wk = 0.0025253 k( 19) = ( 0.2195122 0.0000000 0.0000000), wk = 0.0025253 k( 20) = ( 0.2317073 0.0000000 0.0000000), wk = 0.0025253 k( 21) = ( 0.2439024 0.0000000 0.0000000), wk = 0.0025253 k( 22) = ( 0.2560976 0.0000000 0.0000000), wk = 0.0025253 k( 23) = ( 0.2682927 0.0000000 0.0000000), wk = 0.0025253 k( 24) = ( 0.2804878 0.0000000 0.0000000), wk = 0.0025253 k( 25) = ( 0.2926829 -0.0000000 -0.0000000), wk = 0.0025253 k( 26) = ( 0.3048781 0.0000000 0.0000000), wk = 0.0025253 k( 27) = ( 0.3170732 0.0000000 0.0000000), wk = 0.0025253 k( 28) = ( 0.3292683 0.0000000 0.0000000), wk = 0.0025253 k( 29) = ( 0.3414634 -0.0000000 0.0000000), wk = 0.0025253 k( 30) = ( 0.3536585 0.0000000 0.0000000), wk = 0.0025253 k( 31) = ( 0.3658537 -0.0000000 0.0000000), wk = 0.0025253 k( 32) = ( 0.3780488 0.0000000 0.0000000), wk = 0.0025253 k( 33) = ( 0.3902439 0.0000000 0.0000000), wk = 0.0025253 k( 34) = ( 0.4024390 0.0000000 0.0000000), wk = 0.0025253 k( 35) = ( 0.4146341 0.0000000 0.0000000), wk = 0.0025253 k( 36) = ( 0.4268293 0.0000000 0.0000000), wk = 0.0025253 k( 37) = ( 0.4390244 0.0000000 0.0000000), wk = 0.0025253 k( 38) = ( 0.4512195 0.0000000 0.0000000), wk = 0.0025253 k( 39) = ( 0.4634146 0.0000000 0.0000000), wk = 0.0025253 k( 40) = ( 0.4756098 0.0000000 0.0000000), wk = 0.0025253 k( 41) = ( 0.4878049 0.0000000 0.0000000), wk = 0.0025253 k( 42) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0025253 k( 43) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0025253 k( 44) = ( 0.5000000 0.0166667 0.0000000), wk = 0.0025253 k( 45) = ( 0.5000000 0.0333333 0.0000000), wk = 0.0025253 k( 46) = ( 0.5000000 0.0500000 0.0000000), wk = 0.0025253 k( 47) = ( 0.5000000 0.0666667 0.0000000), wk = 0.0025253 k( 48) = ( 0.5000000 0.0833333 0.0000000), wk = 0.0025253 k( 49) = ( 0.5000000 0.1000000 0.0000000), wk = 0.0025253 k( 50) = ( 0.5000000 0.1166667 0.0000000), wk = 0.0025253 k( 51) = ( 0.5000000 0.1333333 0.0000000), wk = 0.0025253 k( 52) = ( 0.5000000 0.1500000 0.0000000), wk = 0.0025253 k( 53) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0025253 k( 54) = ( 0.5000000 0.1833333 0.0000000), wk = 0.0025253 k( 55) = ( 0.5000000 0.2000000 0.0000000), wk = 0.0025253 k( 56) = ( 0.5000000 0.2166667 0.0000000), wk = 0.0025253 k( 57) = ( 0.5000000 0.2333333 -0.0000000), wk = 0.0025253 k( 58) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0025253 k( 59) = ( 0.5000000 0.2666667 0.0000000), wk = 0.0025253 k( 60) = ( 0.5000000 0.2833333 0.0000000), wk = 0.0025253 k( 61) = ( 0.5000000 0.3000000 0.0000000), wk = 0.0025253 k( 62) = ( 0.5000000 0.3166667 -0.0000000), wk = 0.0025253 k( 63) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0025253 k( 64) = ( 0.5000000 0.3500000 0.0000000), wk = 0.0025253 k( 65) = ( 0.5000000 0.3666667 0.0000000), wk = 0.0025253 k( 66) = ( 0.5000000 0.3833333 0.0000000), wk = 0.0025253 k( 67) = ( 0.5000000 0.4000000 0.0000000), wk = 0.0025253 k( 68) = ( 0.5000000 0.4166667 0.0000000), wk = 0.0025253 k( 69) = ( 0.5000000 0.4333333 0.0000000), wk = 0.0025253 k( 70) = ( 0.5000000 0.4500000 0.0000000), wk = 0.0025253 k( 71) = ( 0.5000000 0.4666667 0.0000000), wk = 0.0025253 k( 72) = ( 0.5000000 0.4833333 0.0000000), wk = 0.0025253 k( 73) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025253 k( 74) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025253 k( 75) = ( 0.4878049 0.5000000 -0.0000000), wk = 0.0025253 k( 76) = ( 0.4756098 0.5000000 0.0000000), wk = 0.0025253 k( 77) = ( 0.4634146 0.5000000 0.0000000), wk = 0.0025253 k( 78) = ( 0.4512195 0.5000000 0.0000000), wk = 0.0025253 k( 79) = ( 0.4390244 0.5000000 0.0000000), wk = 0.0025253 k( 80) = ( 0.4268293 0.5000000 0.0000000), wk = 0.0025253 k( 81) = ( 0.4146341 0.5000000 0.0000000), wk = 0.0025253 k( 82) = ( 0.4024390 0.5000000 0.0000000), wk = 0.0025253 k( 83) = ( 0.3902439 0.5000000 0.0000000), wk = 0.0025253 k( 84) = ( 0.3780488 0.5000000 0.0000000), wk = 0.0025253 k( 85) = ( 0.3658537 0.5000000 0.0000000), wk = 0.0025253 k( 86) = ( 0.3536585 0.5000000 0.0000000), wk = 0.0025253 k( 87) = ( 0.3414634 0.5000000 -0.0000000), wk = 0.0025253 k( 88) = ( 0.3292683 0.5000000 0.0000000), wk = 0.0025253 k( 89) = ( 0.3170732 0.5000000 0.0000000), wk = 0.0025253 k( 90) = ( 0.3048781 0.5000000 0.0000000), wk = 0.0025253 k( 91) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0025253 k( 92) = ( 0.2804878 0.5000000 0.0000000), wk = 0.0025253 k( 93) = ( 0.2682927 0.5000000 0.0000000), wk = 0.0025253 k( 94) = ( 0.2560976 0.5000000 0.0000000), wk = 0.0025253 k( 95) = ( 0.2439024 0.5000000 0.0000000), wk = 0.0025253 k( 96) = ( 0.2317073 0.5000000 0.0000000), wk = 0.0025253 k( 97) = ( 0.2195122 0.5000000 0.0000000), wk = 0.0025253 k( 98) = ( 0.2073171 0.5000000 0.0000000), wk = 0.0025253 k( 99) = ( 0.1951219 0.5000000 0.0000000), wk = 0.0025253 k( 100) = ( 0.1829268 0.5000000 0.0000000), wk = 0.0025253 k( 101) = ( 0.1707317 0.5000000 0.0000000), wk = 0.0025253 k( 102) = ( 0.1585366 0.5000000 0.0000000), wk = 0.0025253 k( 103) = ( 0.1463415 0.5000000 0.0000000), wk = 0.0025253 k( 104) = ( 0.1341463 0.5000000 0.0000000), wk = 0.0025253 k( 105) = ( 0.1219512 0.5000000 0.0000000), wk = 0.0025253 k( 106) = ( 0.1097561 0.5000000 0.0000000), wk = 0.0025253 k( 107) = ( 0.0975610 0.5000000 0.0000000), wk = 0.0025253 k( 108) = ( 0.0853658 0.5000000 0.0000000), wk = 0.0025253 k( 109) = ( 0.0731707 0.5000000 0.0000000), wk = 0.0025253 k( 110) = ( 0.0609756 0.5000000 0.0000000), wk = 0.0025253 k( 111) = ( 0.0487805 0.5000000 0.0000000), wk = 0.0025253 k( 112) = ( 0.0365854 0.5000000 0.0000000), wk = 0.0025253 k( 113) = ( 0.0243902 0.5000000 0.0000000), wk = 0.0025253 k( 114) = ( 0.0121951 0.5000000 0.0000000), wk = 0.0025253 k( 115) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025253 k( 116) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025253 k( 117) = ( 0.0000000 0.4833333 -0.0000000), wk = 0.0025253 k( 118) = ( 0.0000000 0.4666667 -0.0000000), wk = 0.0025253 k( 119) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0025253 k( 120) = ( 0.0000000 0.4333333 -0.0000000), wk = 0.0025253 k( 121) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0025253 k( 122) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0025253 k( 123) = ( 0.0000000 0.3833333 0.0000000), wk = 0.0025253 k( 124) = ( 0.0000000 0.3666667 0.0000000), wk = 0.0025253 k( 125) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0025253 k( 126) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0025253 k( 127) = ( 0.0000000 0.3166667 0.0000000), wk = 0.0025253 k( 128) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0025253 k( 129) = ( 0.0000000 0.2833333 -0.0000000), wk = 0.0025253 k( 130) = ( 0.0000000 0.2666667 0.0000000), wk = 0.0025253 k( 131) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0025253 k( 132) = ( 0.0000000 0.2333333 0.0000000), wk = 0.0025253 k( 133) = ( 0.0000000 0.2166667 0.0000000), wk = 0.0025253 k( 134) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0025253 k( 135) = ( 0.0000000 0.1833333 -0.0000000), wk = 0.0025253 k( 136) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0025253 k( 137) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0025253 k( 138) = ( 0.0000000 0.1333333 0.0000000), wk = 0.0025253 k( 139) = ( 0.0000000 0.1166667 0.0000000), wk = 0.0025253 k( 140) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0025253 k( 141) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0025253 k( 142) = ( 0.0000000 0.0666667 0.0000000), wk = 0.0025253 k( 143) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0025253 k( 144) = ( 0.0000000 0.0333333 0.0000000), wk = 0.0025253 k( 145) = ( 0.0000000 0.0166667 0.0000000), wk = 0.0025253 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 148) = ( 0.0000000 0.0000000 0.0200000), wk = 0.0025253 k( 149) = ( 0.0000000 0.0000000 0.0400000), wk = 0.0025253 k( 150) = ( 0.0000000 0.0000000 0.0600000), wk = 0.0025253 k( 151) = ( 0.0000000 0.0000000 0.0800000), wk = 0.0025253 k( 152) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0025253 k( 153) = ( 0.0000000 0.0000000 0.1200000), wk = 0.0025253 k( 154) = ( 0.0000000 0.0000000 0.1400000), wk = 0.0025253 k( 155) = ( 0.0000000 0.0000000 0.1600000), wk = 0.0025253 k( 156) = ( 0.0000000 0.0000000 0.1800000), wk = 0.0025253 k( 157) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0025253 k( 158) = ( 0.0000000 0.0000000 0.2200000), wk = 0.0025253 k( 159) = ( 0.0000000 0.0000000 0.2400000), wk = 0.0025253 k( 160) = ( 0.0000000 0.0000000 0.2600000), wk = 0.0025253 k( 161) = ( 0.0000000 0.0000000 0.2800000), wk = 0.0025253 k( 162) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0025253 k( 163) = ( 0.0000000 0.0000000 0.3200000), wk = 0.0025253 k( 164) = ( 0.0000000 0.0000000 0.3400000), wk = 0.0025253 k( 165) = ( 0.0000000 0.0000000 0.3600000), wk = 0.0025253 k( 166) = ( 0.0000000 0.0000000 0.3800000), wk = 0.0025253 k( 167) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0025253 k( 168) = ( 0.0000000 0.0000000 0.4200000), wk = 0.0025253 k( 169) = ( 0.0000000 0.0000000 0.4400000), wk = 0.0025253 k( 170) = ( 0.0000000 0.0000000 0.4600000), wk = 0.0025253 k( 171) = ( 0.0000000 0.0000000 0.4800000), wk = 0.0025253 k( 172) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025253 k( 173) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025253 k( 174) = ( 0.0121951 -0.0000000 0.5000000), wk = 0.0025253 k( 175) = ( 0.0243902 -0.0000000 0.5000000), wk = 0.0025253 k( 176) = ( 0.0365854 0.0000000 0.5000000), wk = 0.0025253 k( 177) = ( 0.0487805 -0.0000000 0.5000000), wk = 0.0025253 k( 178) = ( 0.0609756 0.0000000 0.5000000), wk = 0.0025253 k( 179) = ( 0.0731707 0.0000000 0.5000000), wk = 0.0025253 k( 180) = ( 0.0853658 -0.0000000 0.5000000), wk = 0.0025253 k( 181) = ( 0.0975610 -0.0000000 0.5000000), wk = 0.0025253 k( 182) = ( 0.1097561 0.0000000 0.5000000), wk = 0.0025253 k( 183) = ( 0.1219512 0.0000000 0.5000000), wk = 0.0025253 k( 184) = ( 0.1341463 0.0000000 0.5000000), wk = 0.0025253 k( 185) = ( 0.1463415 0.0000000 0.5000000), wk = 0.0025253 k( 186) = ( 0.1585366 -0.0000000 0.5000000), wk = 0.0025253 k( 187) = ( 0.1707317 0.0000000 0.5000000), wk = 0.0025253 k( 188) = ( 0.1829268 -0.0000000 0.5000000), wk = 0.0025253 k( 189) = ( 0.1951219 0.0000000 0.5000000), wk = 0.0025253 k( 190) = ( 0.2073171 0.0000000 0.5000000), wk = 0.0025253 k( 191) = ( 0.2195122 0.0000000 0.5000000), wk = 0.0025253 k( 192) = ( 0.2317073 0.0000000 0.5000000), wk = 0.0025253 k( 193) = ( 0.2439024 0.0000000 0.5000000), wk = 0.0025253 k( 194) = ( 0.2560976 0.0000000 0.5000000), wk = 0.0025253 k( 195) = ( 0.2682927 0.0000000 0.5000000), wk = 0.0025253 k( 196) = ( 0.2804878 0.0000000 0.5000000), wk = 0.0025253 k( 197) = ( 0.2926829 -0.0000000 0.5000000), wk = 0.0025253 k( 198) = ( 0.3048781 0.0000000 0.5000000), wk = 0.0025253 k( 199) = ( 0.3170732 0.0000000 0.5000000), wk = 0.0025253 k( 200) = ( 0.3292683 0.0000000 0.5000000), wk = 0.0025253 k( 201) = ( 0.3414634 -0.0000000 0.5000000), wk = 0.0025253 k( 202) = ( 0.3536585 0.0000000 0.5000000), wk = 0.0025253 k( 203) = ( 0.3658537 -0.0000000 0.5000000), wk = 0.0025253 k( 204) = ( 0.3780488 0.0000000 0.5000000), wk = 0.0025253 k( 205) = ( 0.3902439 0.0000000 0.5000000), wk = 0.0025253 k( 206) = ( 0.4024390 0.0000000 0.5000000), wk = 0.0025253 k( 207) = ( 0.4146341 0.0000000 0.5000000), wk = 0.0025253 k( 208) = ( 0.4268293 0.0000000 0.5000000), wk = 0.0025253 k( 209) = ( 0.4390244 0.0000000 0.5000000), wk = 0.0025253 k( 210) = ( 0.4512195 0.0000000 0.5000000), wk = 0.0025253 k( 211) = ( 0.4634146 0.0000000 0.5000000), wk = 0.0025253 k( 212) = ( 0.4756098 0.0000000 0.5000000), wk = 0.0025253 k( 213) = ( 0.4878049 0.0000000 0.5000000), wk = 0.0025253 k( 214) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025253 k( 215) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025253 k( 216) = ( 0.5000000 0.0166667 0.5000000), wk = 0.0025253 k( 217) = ( 0.5000000 0.0333333 0.5000000), wk = 0.0025253 k( 218) = ( 0.5000000 0.0500000 0.5000000), wk = 0.0025253 k( 219) = ( 0.5000000 0.0666667 0.5000000), wk = 0.0025253 k( 220) = ( 0.5000000 0.0833333 0.5000000), wk = 0.0025253 k( 221) = ( 0.5000000 0.1000000 0.5000000), wk = 0.0025253 k( 222) = ( 0.5000000 0.1166667 0.5000000), wk = 0.0025253 k( 223) = ( 0.5000000 0.1333333 0.5000000), wk = 0.0025253 k( 224) = ( 0.5000000 0.1500000 0.5000000), wk = 0.0025253 k( 225) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0025253 k( 226) = ( 0.5000000 0.1833333 0.5000000), wk = 0.0025253 k( 227) = ( 0.5000000 0.2000000 0.5000000), wk = 0.0025253 k( 228) = ( 0.5000000 0.2166667 0.5000000), wk = 0.0025253 k( 229) = ( 0.5000000 0.2333333 0.5000000), wk = 0.0025253 k( 230) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0025253 k( 231) = ( 0.5000000 0.2666667 0.5000000), wk = 0.0025253 k( 232) = ( 0.5000000 0.2833333 0.5000000), wk = 0.0025253 k( 233) = ( 0.5000000 0.3000000 0.5000000), wk = 0.0025253 k( 234) = ( 0.5000000 0.3166667 0.5000000), wk = 0.0025253 k( 235) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0025253 k( 236) = ( 0.5000000 0.3500000 0.5000000), wk = 0.0025253 k( 237) = ( 0.5000000 0.3666667 0.5000000), wk = 0.0025253 k( 238) = ( 0.5000000 0.3833333 0.5000000), wk = 0.0025253 k( 239) = ( 0.5000000 0.4000000 0.5000000), wk = 0.0025253 k( 240) = ( 0.5000000 0.4166667 0.5000000), wk = 0.0025253 k( 241) = ( 0.5000000 0.4333333 0.5000000), wk = 0.0025253 k( 242) = ( 0.5000000 0.4500000 0.5000000), wk = 0.0025253 k( 243) = ( 0.5000000 0.4666667 0.5000000), wk = 0.0025253 k( 244) = ( 0.5000000 0.4833333 0.5000000), wk = 0.0025253 k( 245) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025253 k( 246) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025253 k( 247) = ( 0.4878049 0.5000000 0.5000000), wk = 0.0025253 k( 248) = ( 0.4756098 0.5000000 0.5000000), wk = 0.0025253 k( 249) = ( 0.4634146 0.5000000 0.5000000), wk = 0.0025253 k( 250) = ( 0.4512195 0.5000000 0.5000000), wk = 0.0025253 k( 251) = ( 0.4390244 0.5000000 0.5000000), wk = 0.0025253 k( 252) = ( 0.4268293 0.5000000 0.5000000), wk = 0.0025253 k( 253) = ( 0.4146341 0.5000000 0.5000000), wk = 0.0025253 k( 254) = ( 0.4024390 0.5000000 0.5000000), wk = 0.0025253 k( 255) = ( 0.3902439 0.5000000 0.5000000), wk = 0.0025253 k( 256) = ( 0.3780488 0.5000000 0.5000000), wk = 0.0025253 k( 257) = ( 0.3658537 0.5000000 0.5000000), wk = 0.0025253 k( 258) = ( 0.3536585 0.5000000 0.5000000), wk = 0.0025253 k( 259) = ( 0.3414634 0.5000000 0.5000000), wk = 0.0025253 k( 260) = ( 0.3292683 0.5000000 0.5000000), wk = 0.0025253 k( 261) = ( 0.3170732 0.5000000 0.5000000), wk = 0.0025253 k( 262) = ( 0.3048781 0.5000000 0.5000000), wk = 0.0025253 k( 263) = ( 0.2926829 0.5000000 0.5000000), wk = 0.0025253 k( 264) = ( 0.2804878 0.5000000 0.5000000), wk = 0.0025253 k( 265) = ( 0.2682927 0.5000000 0.5000000), wk = 0.0025253 k( 266) = ( 0.2560976 0.5000000 0.5000000), wk = 0.0025253 k( 267) = ( 0.2439024 0.5000000 0.5000000), wk = 0.0025253 k( 268) = ( 0.2317073 0.5000000 0.5000000), wk = 0.0025253 k( 269) = ( 0.2195122 0.5000000 0.5000000), wk = 0.0025253 k( 270) = ( 0.2073171 0.5000000 0.5000000), wk = 0.0025253 k( 271) = ( 0.1951219 0.5000000 0.5000000), wk = 0.0025253 k( 272) = ( 0.1829268 0.5000000 0.5000000), wk = 0.0025253 k( 273) = ( 0.1707317 0.5000000 0.5000000), wk = 0.0025253 k( 274) = ( 0.1585366 0.5000000 0.5000000), wk = 0.0025253 k( 275) = ( 0.1463415 0.5000000 0.5000000), wk = 0.0025253 k( 276) = ( 0.1341463 0.5000000 0.5000000), wk = 0.0025253 k( 277) = ( 0.1219512 0.5000000 0.5000000), wk = 0.0025253 k( 278) = ( 0.1097561 0.5000000 0.5000000), wk = 0.0025253 k( 279) = ( 0.0975610 0.5000000 0.5000000), wk = 0.0025253 k( 280) = ( 0.0853658 0.5000000 0.5000000), wk = 0.0025253 k( 281) = ( 0.0731707 0.5000000 0.5000000), wk = 0.0025253 k( 282) = ( 0.0609756 0.5000000 0.5000000), wk = 0.0025253 k( 283) = ( 0.0487805 0.5000000 0.5000000), wk = 0.0025253 k( 284) = ( 0.0365854 0.5000000 0.5000000), wk = 0.0025253 k( 285) = ( 0.0243902 0.5000000 0.5000000), wk = 0.0025253 k( 286) = ( 0.0121951 0.5000000 0.5000000), wk = 0.0025253 k( 287) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025253 k( 288) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025253 k( 289) = ( 0.0000000 0.4833333 0.5000000), wk = 0.0025253 k( 290) = ( 0.0000000 0.4666667 0.5000000), wk = 0.0025253 k( 291) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0025253 k( 292) = ( 0.0000000 0.4333333 0.5000000), wk = 0.0025253 k( 293) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0025253 k( 294) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0025253 k( 295) = ( 0.0000000 0.3833333 0.5000000), wk = 0.0025253 k( 296) = ( 0.0000000 0.3666667 0.5000000), wk = 0.0025253 k( 297) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0025253 k( 298) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0025253 k( 299) = ( 0.0000000 0.3166667 0.5000000), wk = 0.0025253 k( 300) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0025253 k( 301) = ( 0.0000000 0.2833333 0.5000000), wk = 0.0025253 k( 302) = ( 0.0000000 0.2666667 0.5000000), wk = 0.0025253 k( 303) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0025253 k( 304) = ( 0.0000000 0.2333333 0.5000000), wk = 0.0025253 k( 305) = ( 0.0000000 0.2166667 0.5000000), wk = 0.0025253 k( 306) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0025253 k( 307) = ( 0.0000000 0.1833333 0.5000000), wk = 0.0025253 k( 308) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0025253 k( 309) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0025253 k( 310) = ( 0.0000000 0.1333333 0.5000000), wk = 0.0025253 k( 311) = ( 0.0000000 0.1166667 0.5000000), wk = 0.0025253 k( 312) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0025253 k( 313) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0025253 k( 314) = ( 0.0000000 0.0666667 0.5000000), wk = 0.0025253 k( 315) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0025253 k( 316) = ( 0.0000000 0.0333333 0.5000000), wk = 0.0025253 k( 317) = ( 0.0000000 0.0166667 0.5000000), wk = 0.0025253 k( 318) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025253 k( 319) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025253 k( 320) = ( 0.0000000 0.5000000 0.0200000), wk = 0.0025253 k( 321) = ( 0.0000000 0.5000000 0.0400000), wk = 0.0025253 k( 322) = ( 0.0000000 0.5000000 0.0600000), wk = 0.0025253 k( 323) = ( 0.0000000 0.5000000 0.0800000), wk = 0.0025253 k( 324) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0025253 k( 325) = ( 0.0000000 0.5000000 0.1200000), wk = 0.0025253 k( 326) = ( 0.0000000 0.5000000 0.1400000), wk = 0.0025253 k( 327) = ( 0.0000000 0.5000000 0.1600000), wk = 0.0025253 k( 328) = ( 0.0000000 0.5000000 0.1800000), wk = 0.0025253 k( 329) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0025253 k( 330) = ( 0.0000000 0.5000000 0.2200000), wk = 0.0025253 k( 331) = ( 0.0000000 0.5000000 0.2400000), wk = 0.0025253 k( 332) = ( 0.0000000 0.5000000 0.2600000), wk = 0.0025253 k( 333) = ( 0.0000000 0.5000000 0.2800000), wk = 0.0025253 k( 334) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0025253 k( 335) = ( 0.0000000 0.5000000 0.3200000), wk = 0.0025253 k( 336) = ( 0.0000000 0.5000000 0.3400000), wk = 0.0025253 k( 337) = ( 0.0000000 0.5000000 0.3600000), wk = 0.0025253 k( 338) = ( 0.0000000 0.5000000 0.3800000), wk = 0.0025253 k( 339) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0025253 k( 340) = ( 0.0000000 0.5000000 0.4200000), wk = 0.0025253 k( 341) = ( 0.0000000 0.5000000 0.4400000), wk = 0.0025253 k( 342) = ( 0.0000000 0.5000000 0.4600000), wk = 0.0025253 k( 343) = ( 0.0000000 0.5000000 0.4800000), wk = 0.0025253 k( 344) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025253 k( 345) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025253 k( 346) = ( 0.5000000 0.0000000 0.4800000), wk = 0.0025253 k( 347) = ( 0.5000000 0.0000000 0.4600000), wk = 0.0025253 k( 348) = ( 0.5000000 0.0000000 0.4400000), wk = 0.0025253 k( 349) = ( 0.5000000 0.0000000 0.4200000), wk = 0.0025253 k( 350) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0025253 k( 351) = ( 0.5000000 0.0000000 0.3800000), wk = 0.0025253 k( 352) = ( 0.5000000 0.0000000 0.3600000), wk = 0.0025253 k( 353) = ( 0.5000000 0.0000000 0.3400000), wk = 0.0025253 k( 354) = ( 0.5000000 0.0000000 0.3200000), wk = 0.0025253 k( 355) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0025253 k( 356) = ( 0.5000000 0.0000000 0.2800000), wk = 0.0025253 k( 357) = ( 0.5000000 0.0000000 0.2600000), wk = 0.0025253 k( 358) = ( 0.5000000 0.0000000 0.2400000), wk = 0.0025253 k( 359) = ( 0.5000000 0.0000000 0.2200000), wk = 0.0025253 k( 360) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0025253 k( 361) = ( 0.5000000 0.0000000 0.1800000), wk = 0.0025253 k( 362) = ( 0.5000000 0.0000000 0.1600000), wk = 0.0025253 k( 363) = ( 0.5000000 0.0000000 0.1400000), wk = 0.0025253 k( 364) = ( 0.5000000 0.0000000 0.1200000), wk = 0.0025253 k( 365) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0025253 k( 366) = ( 0.5000000 0.0000000 0.0800000), wk = 0.0025253 k( 367) = ( 0.5000000 0.0000000 0.0600000), wk = 0.0025253 k( 368) = ( 0.5000000 0.0000000 0.0400000), wk = 0.0025253 k( 369) = ( 0.5000000 0.0000000 0.0200000), wk = 0.0025253 k( 370) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0025253 k( 371) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025253 k( 372) = ( 0.5000000 0.5000000 0.0200000), wk = 0.0025253 k( 373) = ( 0.5000000 0.5000000 0.0400000), wk = 0.0025253 k( 374) = ( 0.5000000 0.5000000 0.0600000), wk = 0.0025253 k( 375) = ( 0.5000000 0.5000000 0.0800000), wk = 0.0025253 k( 376) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0025253 k( 377) = ( 0.5000000 0.5000000 0.1200000), wk = 0.0025253 k( 378) = ( 0.5000000 0.5000000 0.1400000), wk = 0.0025253 k( 379) = ( 0.5000000 0.5000000 0.1600000), wk = 0.0025253 k( 380) = ( 0.5000000 0.5000000 0.1800000), wk = 0.0025253 k( 381) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0025253 k( 382) = ( 0.5000000 0.5000000 0.2200000), wk = 0.0025253 k( 383) = ( 0.5000000 0.5000000 0.2400000), wk = 0.0025253 k( 384) = ( 0.5000000 0.5000000 0.2600000), wk = 0.0025253 k( 385) = ( 0.5000000 0.5000000 0.2800000), wk = 0.0025253 k( 386) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0025253 k( 387) = ( 0.5000000 0.5000000 0.3200000), wk = 0.0025253 k( 388) = ( 0.5000000 0.5000000 0.3400000), wk = 0.0025253 k( 389) = ( 0.5000000 0.5000000 0.3600000), wk = 0.0025253 k( 390) = ( 0.5000000 0.5000000 0.3800000), wk = 0.0025253 k( 391) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0025253 k( 392) = ( 0.5000000 0.5000000 0.4200000), wk = 0.0025253 k( 393) = ( 0.5000000 0.5000000 0.4400000), wk = 0.0025253 k( 394) = ( 0.5000000 0.5000000 0.4600000), wk = 0.0025253 k( 395) = ( 0.5000000 0.5000000 0.4800000), wk = 0.0025253 k( 396) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025253 Dense grid: 54247 G-vectors FFT dimensions: ( 40, 50, 60) Smooth grid: 36835 G-vectors FFT dimensions: ( 32, 45, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.22 Mb ( 288, 50) NL pseudopotentials 0.45 Mb ( 144, 204) Each V/rho on FFT grid 0.06 Mb ( 4000) Each G-vector array 0.01 Mb ( 1695) G-vector shells 0.01 Mb ( 797) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.88 Mb ( 288, 200) Each subspace H/S matrix 0.61 Mb ( 200, 200) Each matrix 0.31 Mb ( 204, 2, 50) The potential is recalculated from file : ./CoTe2.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 4.1 secs Computing kpt #: 2 total cpu time spent up to now is 5.1 secs Computing kpt #: 3 total cpu time spent up to now is 6.2 secs Computing kpt #: 4 total cpu time spent up to now is 7.2 secs Computing kpt #: 5 total cpu time spent up to now is 8.3 secs Computing kpt #: 6 total cpu time spent up to now is 9.3 secs Computing kpt #: 7 total cpu time spent up to now is 10.3 secs Computing kpt #: 8 total cpu time spent up to now is 11.3 secs Computing kpt #: 9 total cpu time spent up to now is 12.3 secs Computing kpt #: 10 total cpu time spent up to now is 13.4 secs Computing kpt #: 11 total cpu time spent up to now is 14.4 secs Computing kpt #: 12 total cpu time spent up to now is 15.4 secs Computing kpt #: 13 total cpu time spent up to now is 16.4 secs Computing kpt #: 14 total cpu time spent up to now is 17.4 secs Computing kpt #: 15 total cpu time spent up to now is 18.4 secs Computing kpt #: 16 total cpu time spent up to now is 19.4 secs Computing kpt #: 17 total cpu time spent up to now is 20.3 secs Computing kpt #: 18 total cpu time spent up to now is 21.3 secs Computing kpt #: 19 total cpu time spent up to now is 22.3 secs Computing kpt #: 20 total cpu time spent up to now is 23.3 secs Computing kpt #: 21 total cpu time spent up to now is 24.3 secs Computing kpt #: 22 total cpu time spent up to now is 25.4 secs Computing kpt #: 23 total cpu time spent up to now is 26.4 secs Computing kpt #: 24 total cpu time spent up to now is 27.4 secs Computing kpt #: 25 total cpu time spent up to now is 28.5 secs Computing kpt #: 26 total cpu time spent up to now is 29.5 secs Computing kpt #: 27 total cpu time spent up to now is 30.6 secs Computing kpt #: 28 total cpu time spent up to now is 31.6 secs Computing kpt #: 29 total cpu time spent up to now is 32.7 secs Computing kpt #: 30 total cpu time spent up to now is 33.7 secs Computing kpt #: 31 total cpu time spent up to now is 34.8 secs Computing kpt #: 32 total cpu time spent up to now is 35.9 secs Computing kpt #: 33 total cpu time spent up to now is 36.9 secs Computing kpt #: 34 total cpu time spent up to now is 38.0 secs Computing kpt #: 35 total cpu time spent up to now is 39.0 secs Computing kpt #: 36 total cpu time spent up to now is 40.1 secs Computing kpt #: 37 total cpu time spent up to now is 41.2 secs Computing kpt #: 38 total cpu time spent up to now is 42.3 secs Computing kpt #: 39 total cpu time spent up to now is 43.4 secs Computing kpt #: 40 total cpu time spent up to now is 44.6 secs Computing kpt #: 41 total cpu time spent up to now is 45.7 secs Computing kpt #: 42 total cpu time spent up to now is 46.8 secs Computing kpt #: 43 total cpu time spent up to now is 47.9 secs Computing kpt #: 44 total cpu time spent up to now is 49.1 secs Computing kpt #: 45 total cpu time spent up to now is 50.4 secs Computing kpt #: 46 total cpu time spent up to now is 51.6 secs Computing kpt #: 47 total cpu time spent up to now is 52.9 secs Computing kpt #: 48 total cpu time spent up to now is 54.2 secs Computing kpt #: 49 total cpu time spent up to now is 55.4 secs Computing kpt #: 50 total cpu time spent up to now is 56.6 secs Computing kpt #: 51 total cpu time spent up to now is 57.9 secs Computing kpt #: 52 total cpu time spent up to now is 59.1 secs Computing kpt #: 53 total cpu time spent up to now is 60.4 secs Computing kpt #: 54 total cpu time spent up to now is 61.6 secs Computing kpt #: 55 total cpu time spent up to now is 62.9 secs Computing kpt #: 56 total cpu time spent up to now is 64.1 secs Computing kpt #: 57 total cpu time spent up to now is 65.3 secs Computing kpt #: 58 total cpu time spent up to now is 66.5 secs Computing kpt #: 59 total cpu time spent up to now is 67.8 secs Computing kpt #: 60 total cpu time spent up to now is 69.0 secs Computing kpt #: 61 total cpu time spent up to now is 70.2 secs Computing kpt #: 62 total cpu time spent up to now is 71.5 secs Computing kpt #: 63 total cpu time spent up to now is 72.8 secs Computing kpt #: 64 total cpu time spent up to now is 74.0 secs Computing kpt #: 65 total cpu time spent up to now is 75.5 secs Computing kpt #: 66 total cpu time spent up to now is 76.7 secs Computing kpt #: 67 total cpu time spent up to now is 77.9 secs Computing kpt #: 68 total cpu time spent up to now is 79.0 secs Computing kpt #: 69 total cpu time spent up to now is 80.1 secs Computing kpt #: 70 total cpu time spent up to now is 81.3 secs Computing kpt #: 71 total cpu time spent up to now is 82.4 secs Computing kpt #: 72 total cpu time spent up to now is 83.5 secs Computing kpt #: 73 total cpu time spent up to now is 84.6 secs Computing kpt #: 74 total cpu time spent up to now is 85.8 secs Computing kpt #: 75 total cpu time spent up to now is 86.9 secs Computing kpt #: 76 total cpu time spent up to now is 88.0 secs Computing kpt #: 77 total cpu time spent up to now is 89.1 secs Computing kpt #: 78 total cpu time spent up to now is 90.3 secs Computing kpt #: 79 total cpu time spent up to now is 91.4 secs Computing kpt #: 80 total cpu time spent up to now is 92.5 secs Computing kpt #: 81 total cpu time spent up to now is 93.6 secs Computing kpt #: 82 total cpu time spent up to now is 94.7 secs Computing kpt #: 83 total cpu time spent up to now is 95.8 secs Computing kpt #: 84 total cpu time spent up to now is 96.9 secs Computing kpt #: 85 total cpu time spent up to now is 98.0 secs Computing kpt #: 86 total cpu time spent up to now is 99.1 secs Computing kpt #: 87 total cpu time spent up to now is 100.2 secs Computing kpt #: 88 total cpu time spent up to now is 101.2 secs Computing kpt #: 89 total cpu time spent up to now is 102.3 secs Computing kpt #: 90 total cpu time spent up to now is 103.4 secs Computing kpt #: 91 total cpu time spent up to now is 104.5 secs Computing kpt #: 92 total cpu time spent up to now is 105.6 secs Computing kpt #: 93 total cpu time spent up to now is 106.7 secs Computing kpt #: 94 total cpu time spent up to now is 107.8 secs Computing kpt #: 95 total cpu time spent up to now is 108.9 secs Computing kpt #: 96 total cpu time spent up to now is 110.0 secs Computing kpt #: 97 total cpu time spent up to now is 111.1 secs Computing kpt #: 98 total cpu time spent up to now is 112.2 secs Computing kpt #: 99 total cpu time spent up to now is 113.3 secs Computing kpt #: 100 total cpu time spent up to now is 114.5 secs Computing kpt #: 101 total cpu time spent up to now is 115.6 secs Computing kpt #: 102 total cpu time spent up to now is 116.7 secs Computing kpt #: 103 total cpu time spent up to now is 118.0 secs Computing kpt #: 104 total cpu time spent up to now is 119.2 secs Computing kpt #: 105 total cpu time spent up to now is 120.3 secs Computing kpt #: 106 total cpu time spent up to now is 121.6 secs Computing kpt #: 107 total cpu time spent up to now is 122.9 secs Computing kpt #: 108 total cpu time spent up to now is 124.3 secs Computing kpt #: 109 total cpu time spent up to now is 125.7 secs Computing kpt #: 110 total cpu time spent up to now is 127.1 secs Computing kpt #: 111 total cpu time spent up to now is 128.4 secs Computing kpt #: 112 total cpu time spent up to now is 129.8 secs Computing kpt #: 113 total cpu time spent up to now is 131.1 secs Computing kpt #: 114 total cpu time spent up to now is 132.5 secs Computing kpt #: 115 total cpu time spent up to now is 133.6 secs Computing kpt #: 116 total cpu time spent up to now is 134.7 secs Computing kpt #: 117 total cpu time spent up to now is 136.0 secs Computing kpt #: 118 total cpu time spent up to now is 137.1 secs Computing kpt #: 119 total cpu time spent up to now is 138.3 secs Computing kpt #: 120 total cpu time spent up to now is 139.5 secs Computing kpt #: 121 total cpu time spent up to now is 140.6 secs Computing kpt #: 122 total cpu time spent up to now is 141.7 secs Computing kpt #: 123 total cpu time spent up to now is 142.8 secs Computing kpt #: 124 total cpu time spent up to now is 143.9 secs Computing kpt #: 125 total cpu time spent up to now is 145.0 secs Computing kpt #: 126 total cpu time spent up to now is 146.0 secs Computing kpt #: 127 total cpu time spent up to now is 147.1 secs Computing kpt #: 128 total cpu time spent up to now is 148.1 secs Computing kpt #: 129 total cpu time spent up to now is 149.2 secs Computing kpt #: 130 total cpu time spent up to now is 150.2 secs Computing kpt #: 131 total cpu time spent up to now is 151.4 secs Computing kpt #: 132 total cpu time spent up to now is 152.5 secs Computing kpt #: 133 total cpu time spent up to now is 153.6 secs Computing kpt #: 134 total cpu time spent up to now is 154.8 secs Computing kpt #: 135 total cpu time spent up to now is 156.0 secs Computing kpt #: 136 total cpu time spent up to now is 157.4 secs Computing kpt #: 137 total cpu time spent up to now is 159.2 secs Computing kpt #: 138 total cpu time spent up to now is 160.5 secs Computing kpt #: 139 total cpu time spent up to now is 161.8 secs Computing kpt #: 140 total cpu time spent up to now is 162.9 secs Computing kpt #: 141 total cpu time spent up to now is 164.1 secs Computing kpt #: 142 total cpu time spent up to now is 165.2 secs Computing kpt #: 143 total cpu time spent up to now is 166.2 secs Computing kpt #: 144 total cpu time spent up to now is 167.3 secs Computing kpt #: 145 total cpu time spent up to now is 168.4 secs Computing kpt #: 146 total cpu time spent up to now is 169.4 secs Computing kpt #: 147 total cpu time spent up to now is 170.5 secs Computing kpt #: 148 total cpu time spent up to now is 171.5 secs Computing kpt #: 149 total cpu time spent up to now is 172.6 secs Computing kpt #: 150 total cpu time spent up to now is 173.7 secs Computing kpt #: 151 total cpu time spent up to now is 174.7 secs Computing kpt #: 152 total cpu time spent up to now is 175.7 secs Computing kpt #: 153 total cpu time spent up to now is 176.8 secs Computing kpt #: 154 total cpu time spent up to now is 177.8 secs Computing kpt #: 155 total cpu time spent up to now is 178.9 secs Computing kpt #: 156 total cpu time spent up to now is 179.9 secs Computing kpt #: 157 total cpu time spent up to now is 181.0 secs Computing kpt #: 158 total cpu time spent up to now is 182.1 secs Computing kpt #: 159 total cpu time spent up to now is 183.2 secs Computing kpt #: 160 total cpu time spent up to now is 184.3 secs Computing kpt #: 161 total cpu time spent up to now is 185.5 secs Computing kpt #: 162 total cpu time spent up to now is 186.8 secs Computing kpt #: 163 total cpu time spent up to now is 188.1 secs Computing kpt #: 164 total cpu time spent up to now is 189.8 secs Computing kpt #: 165 total cpu time spent up to now is 193.3 secs Computing kpt #: 166 total cpu time spent up to now is 194.9 secs Computing kpt #: 167 total cpu time spent up to now is 196.2 secs Computing kpt #: 168 total cpu time spent up to now is 197.6 secs Computing kpt #: 169 total cpu time spent up to now is 199.0 secs Computing kpt #: 170 total cpu time spent up to now is 200.4 secs Computing kpt #: 171 total cpu time spent up to now is 201.8 secs Computing kpt #: 172 total cpu time spent up to now is 202.9 secs Computing kpt #: 173 total cpu time spent up to now is 204.0 secs Computing kpt #: 174 total cpu time spent up to now is 205.2 secs Computing kpt #: 175 total cpu time spent up to now is 206.4 secs Computing kpt #: 176 total cpu time spent up to now is 207.5 secs Computing kpt #: 177 total cpu time spent up to now is 208.7 secs Computing kpt #: 178 total cpu time spent up to now is 209.8 secs Computing kpt #: 179 total cpu time spent up to now is 210.9 secs Computing kpt #: 180 total cpu time spent up to now is 212.1 secs Computing kpt #: 181 total cpu time spent up to now is 213.2 secs Computing kpt #: 182 total cpu time spent up to now is 214.3 secs Computing kpt #: 183 total cpu time spent up to now is 215.4 secs Computing kpt #: 184 total cpu time spent up to now is 216.5 secs Computing kpt #: 185 total cpu time spent up to now is 217.7 secs Computing kpt #: 186 total cpu time spent up to now is 218.8 secs Computing kpt #: 187 total cpu time spent up to now is 220.0 secs Computing kpt #: 188 total cpu time spent up to now is 221.2 secs Computing kpt #: 189 total cpu time spent up to now is 222.4 secs Computing kpt #: 190 total cpu time spent up to now is 223.7 secs Computing kpt #: 191 total cpu time spent up to now is 225.0 secs Computing kpt #: 192 total cpu time spent up to now is 226.2 secs Computing kpt #: 193 total cpu time spent up to now is 227.5 secs Computing kpt #: 194 total cpu time spent up to now is 228.7 secs Computing kpt #: 195 total cpu time spent up to now is 229.9 secs Computing kpt #: 196 total cpu time spent up to now is 231.1 secs Computing kpt #: 197 total cpu time spent up to now is 232.4 secs Computing kpt #: 198 total cpu time spent up to now is 233.6 secs Computing kpt #: 199 total cpu time spent up to now is 234.9 secs Computing kpt #: 200 total cpu time spent up to now is 236.0 secs Computing kpt #: 201 total cpu time spent up to now is 237.2 secs Computing kpt #: 202 total cpu time spent up to now is 238.5 secs Computing kpt #: 203 total cpu time spent up to now is 239.8 secs Computing kpt #: 204 total cpu time spent up to now is 241.0 secs Computing kpt #: 205 total cpu time spent up to now is 242.3 secs Computing kpt #: 206 total cpu time spent up to now is 243.3 secs Computing kpt #: 207 total cpu time spent up to now is 244.4 secs Computing kpt #: 208 total cpu time spent up to now is 245.7 secs Computing kpt #: 209 total cpu time spent up to now is 246.9 secs Computing kpt #: 210 total cpu time spent up to now is 248.2 secs Computing kpt #: 211 total cpu time spent up to now is 249.6 secs Computing kpt #: 212 total cpu time spent up to now is 250.8 secs Computing kpt #: 213 total cpu time spent up to now is 252.2 secs Computing kpt #: 214 total cpu time spent up to now is 253.4 secs Computing kpt #: 215 total cpu time spent up to now is 254.7 secs Computing kpt #: 216 total cpu time spent up to now is 256.0 secs Computing kpt #: 217 total cpu time spent up to now is 257.3 secs Computing kpt #: 218 total cpu time spent up to now is 258.5 secs Computing kpt #: 219 total cpu time spent up to now is 259.8 secs Computing kpt #: 220 total cpu time spent up to now is 261.1 secs Computing kpt #: 221 total cpu time spent up to now is 262.4 secs Computing kpt #: 222 total cpu time spent up to now is 263.5 secs Computing kpt #: 223 total cpu time spent up to now is 264.7 secs Computing kpt #: 224 total cpu time spent up to now is 265.8 secs Computing kpt #: 225 total cpu time spent up to now is 267.1 secs Computing kpt #: 226 total cpu time spent up to now is 268.2 secs Computing kpt #: 227 total cpu time spent up to now is 269.5 secs Computing kpt #: 228 total cpu time spent up to now is 270.8 secs Computing kpt #: 229 total cpu time spent up to now is 272.1 secs Computing kpt #: 230 total cpu time spent up to now is 273.6 secs Computing kpt #: 231 total cpu time spent up to now is 274.9 secs Computing kpt #: 232 total cpu time spent up to now is 276.0 secs Computing kpt #: 233 total cpu time spent up to now is 277.3 secs Computing kpt #: 234 total cpu time spent up to now is 278.5 secs Computing kpt #: 235 total cpu time spent up to now is 279.6 secs Computing kpt #: 236 total cpu time spent up to now is 280.8 secs Computing kpt #: 237 total cpu time spent up to now is 282.0 secs Computing kpt #: 238 total cpu time spent up to now is 283.2 secs Computing kpt #: 239 total cpu time spent up to now is 284.3 secs Computing kpt #: 240 total cpu time spent up to now is 285.5 secs Computing kpt #: 241 total cpu time spent up to now is 286.6 secs Computing kpt #: 242 total cpu time spent up to now is 287.8 secs Computing kpt #: 243 total cpu time spent up to now is 289.0 secs Computing kpt #: 244 total cpu time spent up to now is 290.3 secs Computing kpt #: 245 total cpu time spent up to now is 291.4 secs Computing kpt #: 246 total cpu time spent up to now is 292.5 secs Computing kpt #: 247 total cpu time spent up to now is 293.7 secs Computing kpt #: 248 total cpu time spent up to now is 294.8 secs Computing kpt #: 249 total cpu time spent up to now is 295.9 secs Computing kpt #: 250 total cpu time spent up to now is 297.0 secs Computing kpt #: 251 total cpu time spent up to now is 298.1 secs Computing kpt #: 252 total cpu time spent up to now is 299.2 secs Computing kpt #: 253 total cpu time spent up to now is 300.4 secs Computing kpt #: 254 total cpu time spent up to now is 301.5 secs Computing kpt #: 255 total cpu time spent up to now is 302.6 secs Computing kpt #: 256 total cpu time spent up to now is 303.7 secs Computing kpt #: 257 total cpu time spent up to now is 304.8 secs Computing kpt #: 258 total cpu time spent up to now is 305.8 secs Computing kpt #: 259 total cpu time spent up to now is 306.9 secs Computing kpt #: 260 total cpu time spent up to now is 307.9 secs Computing kpt #: 261 total cpu time spent up to now is 309.0 secs Computing kpt #: 262 total cpu time spent up to now is 310.0 secs Computing kpt #: 263 total cpu time spent up to now is 311.0 secs Computing kpt #: 264 total cpu time spent up to now is 312.0 secs Computing kpt #: 265 total cpu time spent up to now is 313.0 secs Computing kpt #: 266 total cpu time spent up to now is 314.0 secs Computing kpt #: 267 total cpu time spent up to now is 315.1 secs Computing kpt #: 268 total cpu time spent up to now is 316.1 secs Computing kpt #: 269 total cpu time spent up to now is 317.0 secs Computing kpt #: 270 total cpu time spent up to now is 318.0 secs Computing kpt #: 271 total cpu time spent up to now is 319.1 secs Computing kpt #: 272 total cpu time spent up to now is 320.1 secs Computing kpt #: 273 total cpu time spent up to now is 321.1 secs Computing kpt #: 274 total cpu time spent up to now is 322.1 secs Computing kpt #: 275 total cpu time spent up to now is 323.1 secs Computing kpt #: 276 total cpu time spent up to now is 324.1 secs Computing kpt #: 277 total cpu time spent up to now is 325.1 secs Computing kpt #: 278 total cpu time spent up to now is 326.1 secs Computing kpt #: 279 total cpu time spent up to now is 327.1 secs Computing kpt #: 280 total cpu time spent up to now is 328.1 secs Computing kpt #: 281 total cpu time spent up to now is 329.1 secs Computing kpt #: 282 total cpu time spent up to now is 330.1 secs Computing kpt #: 283 total cpu time spent up to now is 331.1 secs Computing kpt #: 284 total cpu time spent up to now is 332.1 secs Computing kpt #: 285 total cpu time spent up to now is 333.1 secs Computing kpt #: 286 total cpu time spent up to now is 334.1 secs Computing kpt #: 287 total cpu time spent up to now is 335.0 secs Computing kpt #: 288 total cpu time spent up to now is 336.0 secs Computing kpt #: 289 total cpu time spent up to now is 337.0 secs Computing kpt #: 290 total cpu time spent up to now is 338.0 secs Computing kpt #: 291 total cpu time spent up to now is 339.0 secs Computing kpt #: 292 total cpu time spent up to now is 340.0 secs Computing kpt #: 293 total cpu time spent up to now is 341.0 secs Computing kpt #: 294 total cpu time spent up to now is 342.0 secs Computing kpt #: 295 total cpu time spent up to now is 343.0 secs Computing kpt #: 296 total cpu time spent up to now is 343.9 secs Computing kpt #: 297 total cpu time spent up to now is 344.9 secs Computing kpt #: 298 total cpu time spent up to now is 345.9 secs Computing kpt #: 299 total cpu time spent up to now is 346.9 secs Computing kpt #: 300 total cpu time spent up to now is 347.9 secs Computing kpt #: 301 total cpu time spent up to now is 349.0 secs Computing kpt #: 302 total cpu time spent up to now is 350.0 secs Computing kpt #: 303 total cpu time spent up to now is 351.0 secs Computing kpt #: 304 total cpu time spent up to now is 352.1 secs Computing kpt #: 305 total cpu time spent up to now is 353.2 secs Computing kpt #: 306 total cpu time spent up to now is 354.5 secs Computing kpt #: 307 total cpu time spent up to now is 355.6 secs Computing kpt #: 308 total cpu time spent up to now is 356.7 secs Computing kpt #: 309 total cpu time spent up to now is 357.8 secs Computing kpt #: 310 total cpu time spent up to now is 359.0 secs Computing kpt #: 311 total cpu time spent up to now is 360.1 secs Computing kpt #: 312 total cpu time spent up to now is 361.2 secs Computing kpt #: 313 total cpu time spent up to now is 362.3 secs Computing kpt #: 314 total cpu time spent up to now is 363.4 secs Computing kpt #: 315 total cpu time spent up to now is 364.5 secs Computing kpt #: 316 total cpu time spent up to now is 365.6 secs Computing kpt #: 317 total cpu time spent up to now is 366.7 secs Computing kpt #: 318 total cpu time spent up to now is 367.7 secs Computing kpt #: 319 total cpu time spent up to now is 368.8 secs Computing kpt #: 320 total cpu time spent up to now is 369.9 secs Computing kpt #: 321 total cpu time spent up to now is 370.9 secs Computing kpt #: 322 total cpu time spent up to now is 372.0 secs Computing kpt #: 323 total cpu time spent up to now is 373.1 secs Computing kpt #: 324 total cpu time spent up to now is 374.2 secs Computing kpt #: 325 total cpu time spent up to now is 375.2 secs Computing kpt #: 326 total cpu time spent up to now is 376.3 secs Computing kpt #: 327 total cpu time spent up to now is 377.3 secs Computing kpt #: 328 total cpu time spent up to now is 378.4 secs Computing kpt #: 329 total cpu time spent up to now is 379.4 secs Computing kpt #: 330 total cpu time spent up to now is 380.5 secs Computing kpt #: 331 total cpu time spent up to now is 381.5 secs Computing kpt #: 332 total cpu time spent up to now is 382.5 secs Computing kpt #: 333 total cpu time spent up to now is 383.6 secs Computing kpt #: 334 total cpu time spent up to now is 384.6 secs Computing kpt #: 335 total cpu time spent up to now is 385.6 secs Computing kpt #: 336 total cpu time spent up to now is 386.6 secs Computing kpt #: 337 total cpu time spent up to now is 387.6 secs Computing kpt #: 338 total cpu time spent up to now is 388.6 secs Computing kpt #: 339 total cpu time spent up to now is 389.6 secs Computing kpt #: 340 total cpu time spent up to now is 390.6 secs Computing kpt #: 341 total cpu time spent up to now is 391.6 secs Computing kpt #: 342 total cpu time spent up to now is 392.6 secs Computing kpt #: 343 total cpu time spent up to now is 393.6 secs Computing kpt #: 344 total cpu time spent up to now is 394.6 secs Computing kpt #: 345 total cpu time spent up to now is 395.8 secs Computing kpt #: 346 total cpu time spent up to now is 397.1 secs Computing kpt #: 347 total cpu time spent up to now is 398.4 secs Computing kpt #: 348 total cpu time spent up to now is 399.7 secs Computing kpt #: 349 total cpu time spent up to now is 400.9 secs Computing kpt #: 350 total cpu time spent up to now is 402.2 secs Computing kpt #: 351 total cpu time spent up to now is 403.3 secs Computing kpt #: 352 total cpu time spent up to now is 404.4 secs Computing kpt #: 353 total cpu time spent up to now is 405.6 secs Computing kpt #: 354 total cpu time spent up to now is 406.7 secs Computing kpt #: 355 total cpu time spent up to now is 408.0 secs Computing kpt #: 356 total cpu time spent up to now is 409.0 secs Computing kpt #: 357 total cpu time spent up to now is 410.1 secs Computing kpt #: 358 total cpu time spent up to now is 411.3 secs Computing kpt #: 359 total cpu time spent up to now is 412.5 secs Computing kpt #: 360 total cpu time spent up to now is 413.6 secs Computing kpt #: 361 total cpu time spent up to now is 414.8 secs Computing kpt #: 362 total cpu time spent up to now is 416.0 secs Computing kpt #: 363 total cpu time spent up to now is 417.3 secs Computing kpt #: 364 total cpu time spent up to now is 418.5 secs Computing kpt #: 365 total cpu time spent up to now is 419.7 secs Computing kpt #: 366 total cpu time spent up to now is 421.0 secs Computing kpt #: 367 total cpu time spent up to now is 422.3 secs Computing kpt #: 368 total cpu time spent up to now is 423.5 secs Computing kpt #: 369 total cpu time spent up to now is 424.8 secs Computing kpt #: 370 total cpu time spent up to now is 425.8 secs Computing kpt #: 371 total cpu time spent up to now is 427.0 secs Computing kpt #: 372 total cpu time spent up to now is 428.1 secs Computing kpt #: 373 total cpu time spent up to now is 429.2 secs Computing kpt #: 374 total cpu time spent up to now is 430.3 secs Computing kpt #: 375 total cpu time spent up to now is 431.5 secs Computing kpt #: 376 total cpu time spent up to now is 432.6 secs Computing kpt #: 377 total cpu time spent up to now is 433.7 secs Computing kpt #: 378 total cpu time spent up to now is 434.9 secs Computing kpt #: 379 total cpu time spent up to now is 436.0 secs Computing kpt #: 380 total cpu time spent up to now is 437.1 secs Computing kpt #: 381 total cpu time spent up to now is 438.3 secs Computing kpt #: 382 total cpu time spent up to now is 439.4 secs Computing kpt #: 383 total cpu time spent up to now is 440.5 secs Computing kpt #: 384 total cpu time spent up to now is 441.6 secs Computing kpt #: 385 total cpu time spent up to now is 442.7 secs Computing kpt #: 386 total cpu time spent up to now is 443.8 secs Computing kpt #: 387 total cpu time spent up to now is 444.9 secs Computing kpt #: 388 total cpu time spent up to now is 446.0 secs Computing kpt #: 389 total cpu time spent up to now is 447.1 secs Computing kpt #: 390 total cpu time spent up to now is 448.3 secs Computing kpt #: 391 total cpu time spent up to now is 449.4 secs Computing kpt #: 392 total cpu time spent up to now is 450.5 secs Computing kpt #: 393 total cpu time spent up to now is 451.7 secs Computing kpt #: 394 total cpu time spent up to now is 453.0 secs Computing kpt #: 395 total cpu time spent up to now is 454.2 secs Computing kpt #: 396 total cpu time spent up to now is 455.3 secs ethr = 2.38E-11, avg # of iterations = 35.0 total cpu time spent up to now is 455.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4571 PWs) bands (ev): -4.5421 -4.5421 -2.0426 -2.0426 -1.6075 -1.6075 -0.9445 -0.9445 2.9282 2.9282 4.1543 4.1543 5.3914 5.3914 5.6272 5.6272 6.3078 6.3078 6.6136 6.6136 6.6879 6.6879 6.8681 6.8681 6.9966 6.9966 8.0232 8.0232 8.2776 8.2776 8.2922 8.2922 8.3691 8.3691 8.4815 8.4815 8.7224 8.7224 9.2944 9.2944 9.6351 9.6351 11.0002 11.0002 11.4992 11.4992 11.9370 11.9370 12.0417 12.0417 k = 0.0122-0.0000-0.0000 ( 4577 PWs) bands (ev): -4.5409 -4.5409 -2.0425 -2.0425 -1.6068 -1.6068 -0.9441 -0.9441 2.9295 2.9295 4.1544 4.1544 5.3906 5.3906 5.6276 5.6276 6.3034 6.3034 6.6123 6.6123 6.6847 6.6847 6.8678 6.8678 6.9974 6.9974 8.0270 8.0270 8.2765 8.2765 8.2919 8.2919 8.3684 8.3684 8.4750 8.4750 8.7235 8.7235 9.2941 9.2941 9.6360 9.6360 10.9884 10.9884 11.5061 11.5061 11.9296 11.9296 12.0345 12.0345 k = 0.0244-0.0000-0.0000 ( 4569 PWs) bands (ev): -4.5374 -4.5374 -2.0424 -2.0424 -1.6045 -1.6045 -0.9429 -0.9429 2.9335 2.9335 4.1544 4.1544 5.3882 5.3882 5.6289 5.6289 6.2903 6.2903 6.6082 6.6082 6.6760 6.6760 6.8670 6.8670 6.9998 6.9998 8.0379 8.0379 8.2732 8.2732 8.2910 8.2910 8.3661 8.3661 8.4558 8.4558 8.7270 8.7270 9.2930 9.2930 9.6390 9.6390 10.9555 10.9555 11.5246 11.5246 11.9052 11.9052 12.0162 12.0162 k = 0.0366-0.0000-0.0000 ( 4573 PWs) bands (ev): -4.5316 -4.5316 -2.0422 -2.0422 -1.6007 -1.6007 -0.9408 -0.9408 2.9401 2.9401 4.1545 4.1545 5.3843 5.3843 5.6310 5.6310 6.2679 6.2679 6.6009 6.6009 6.6642 6.6642 6.8652 6.8652 7.0038 7.0038 8.0545 8.0545 8.2675 8.2675 8.2899 8.2899 8.3611 8.3611 8.4254 8.4254 8.7326 8.7326 9.2911 9.2911 9.6438 9.6438 10.9069 10.9069 11.5494 11.5494 11.8600 11.8600 11.9933 11.9933 k = 0.0488-0.0000-0.0000 ( 4581 PWs) bands (ev): -4.5234 -4.5234 -2.0420 -2.0420 -1.5954 -1.5954 -0.9380 -0.9380 2.9494 2.9494 4.1543 4.1543 5.3788 5.3788 5.6340 5.6340 6.2361 6.2361 6.5898 6.5898 6.6522 6.6522 6.8622 6.8622 7.0096 7.0096 8.0750 8.0750 8.2595 8.2595 8.2885 8.2885 8.3484 8.3484 8.3901 8.3901 8.7404 8.7404 9.2882 9.2882 9.6504 9.6504 10.8480 10.8480 11.5756 11.5756 11.7936 11.7936 11.9698 11.9698 k = 0.0610-0.0000-0.0000 ( 4585 PWs) bands (ev): -4.5129 -4.5129 -2.0418 -2.0418 -1.5887 -1.5887 -0.9344 -0.9344 2.9612 2.9612 4.1540 4.1540 5.3717 5.3717 5.6376 5.6376 6.1949 6.1949 6.5757 6.5757 6.6416 6.6416 6.8576 6.8576 7.0171 7.0171 8.0970 8.0970 8.2491 8.2491 8.2871 8.2871 8.3100 8.3100 8.3691 8.3691 8.7501 8.7501 9.2841 9.2841 9.6588 9.6588 10.7829 10.7829 11.5991 11.5991 11.7103 11.7103 11.9458 11.9458 k = 0.0732-0.0000-0.0000 ( 4589 PWs) bands (ev): -4.5001 -4.5001 -2.0417 -2.0417 -1.5805 -1.5805 -0.9300 -0.9300 2.9757 2.9757 4.1531 4.1531 5.3629 5.3629 5.6418 5.6418 6.1456 6.1456 6.5594 6.5594 6.6328 6.6328 6.8509 6.8509 7.0266 7.0266 8.1179 8.1179 8.2345 8.2345 8.2521 8.2521 8.2864 8.2864 8.3600 8.3600 8.7615 8.7615 9.2786 9.2786 9.6688 9.6688 10.7148 10.7148 11.6038 11.6038 11.6282 11.6282 11.9202 11.9202 k = 0.0854-0.0000-0.0000 ( 4594 PWs) bands (ev): -4.4850 -4.4850 -2.0417 -2.0417 -1.5708 -1.5708 -0.9249 -0.9249 2.9927 2.9927 4.1515 4.1515 5.3525 5.3525 5.6466 5.6466 6.0899 6.0899 6.5421 6.5421 6.6253 6.6253 6.8416 6.8416 7.0380 7.0380 8.1320 8.1320 8.1797 8.1797 8.2266 8.2266 8.2859 8.2859 8.3531 8.3531 8.7743 8.7743 9.2716 9.2716 9.6803 9.6803 10.6458 10.6458 11.5053 11.5053 11.6343 11.6343 11.8923 11.8923 k = 0.0976-0.0000-0.0000 ( 4600 PWs) bands (ev): -4.4677 -4.4677 -2.0420 -2.0420 -1.5597 -1.5597 -0.9191 -0.9191 3.0123 3.0123 4.1490 4.1490 5.3404 5.3404 5.6516 5.6516 6.0300 6.0300 6.5240 6.5240 6.6186 6.6186 6.8295 6.8295 7.0512 7.0512 8.0883 8.0883 8.1568 8.1568 8.2140 8.2140 8.2866 8.2866 8.3466 8.3466 8.7879 8.7879 9.2630 9.2630 9.6931 9.6931 10.5775 10.5775 11.3937 11.3937 11.6405 11.6405 11.8620 11.8620 k = 0.1098-0.0000-0.0000 ( 4598 PWs) bands (ev): -4.4480 -4.4480 -2.0425 -2.0425 -1.5472 -1.5472 -0.9126 -0.9126 3.0344 3.0344 4.1451 4.1451 5.3265 5.3265 5.6569 5.6569 5.9684 5.9684 6.5046 6.5046 6.6128 6.6128 6.8139 6.8139 7.0663 7.0663 8.0051 8.0051 8.1575 8.1575 8.2054 8.2054 8.2890 8.2890 8.3401 8.3401 8.8019 8.8019 9.2527 9.2527 9.7071 9.7071 10.5111 10.5111 11.2781 11.2781 11.6398 11.6398 11.8288 11.8288 k = 0.1220-0.0000-0.0000 ( 4596 PWs) bands (ev): -4.4261 -4.4261 -2.0435 -2.0435 -1.5334 -1.5334 -0.9056 -0.9056 3.0590 3.0590 4.1395 4.1395 5.3109 5.3109 5.6621 5.6621 5.9073 5.9073 6.4834 6.4834 6.6078 6.6078 6.7943 6.7943 7.0831 7.0831 7.9159 7.9159 8.1493 8.1493 8.2012 8.2012 8.2932 8.2932 8.3338 8.3338 8.8158 8.8158 9.2406 9.2406 9.7221 9.7221 10.4477 10.4477 11.1605 11.1605 11.6317 11.6317 11.7930 11.7930 k = 0.1341-0.0000-0.0000 ( 4588 PWs) bands (ev): -4.4020 -4.4020 -2.0450 -2.0450 -1.5182 -1.5182 -0.8980 -0.8980 3.0860 3.0860 4.1320 4.1320 5.2938 5.2938 5.6667 5.6667 5.8489 5.8489 6.4597 6.4597 6.6038 6.6038 6.7701 6.7701 7.1013 7.1013 7.8240 7.8240 8.1349 8.1349 8.1976 8.1976 8.2983 8.2983 8.3286 8.3286 8.8291 8.8291 9.2269 9.2269 9.7378 9.7378 10.3878 10.3878 11.0425 11.0425 11.6162 11.6162 11.7546 11.7546 k = 0.1463-0.0000-0.0000 ( 4592 PWs) bands (ev): -4.3757 -4.3757 -2.0471 -2.0471 -1.5018 -1.5018 -0.8899 -0.8899 3.1154 3.1154 4.1221 4.1221 5.2752 5.2752 5.6697 5.6697 5.7955 5.7955 6.4328 6.4328 6.6009 6.6009 6.7405 6.7405 7.1208 7.1208 7.7315 7.7315 8.1181 8.1181 8.1918 8.1918 8.3016 8.3016 8.3262 8.3262 8.8413 8.8413 9.2113 9.2113 9.7540 9.7540 10.3320 10.3320 10.9254 10.9254 11.5930 11.5930 11.7140 11.7140 k = 0.1585-0.0000-0.0000 ( 4592 PWs) bands (ev): -4.3472 -4.3472 -2.0501 -2.0501 -1.4841 -1.4841 -0.8813 -0.8813 3.1470 3.1470 4.1095 4.1095 5.2557 5.2557 5.6686 5.6686 5.7506 5.7506 6.4024 6.4024 6.5991 6.5991 6.7048 6.7048 7.1415 7.1415 7.6403 7.6403 8.1005 8.1005 8.1831 8.1831 8.3002 8.3002 8.3290 8.3290 8.8522 8.8522 9.1941 9.1941 9.7706 9.7706 10.2806 10.2806 10.8104 10.8104 11.5617 11.5617 11.6720 11.6720 k = 0.1707-0.0000-0.0000 ( 4600 PWs) bands (ev): -4.3166 -4.3166 -2.0540 -2.0540 -1.4653 -1.4653 -0.8724 -0.8724 3.1807 3.1807 4.0941 4.0941 5.2357 5.2357 5.6567 5.6567 5.7214 5.7214 6.3681 6.3681 6.5985 6.5985 6.6620 6.6620 7.1630 7.1630 7.5522 7.5522 8.0833 8.0833 8.1718 8.1718 8.2953 8.2953 8.3351 8.3351 8.8615 8.8615 9.1752 9.1752 9.7872 9.7872 10.2338 10.2338 10.6984 10.6984 11.5224 11.5224 11.6293 11.6293 k = 0.1829-0.0000-0.0000 ( 4616 PWs) bands (ev): -4.2839 -4.2839 -2.0589 -2.0589 -1.4453 -1.4453 -0.8632 -0.8632 3.2166 3.2166 4.0758 4.0758 5.2158 5.2158 5.6312 5.6312 5.7107 5.7107 6.3297 6.3297 6.5984 6.5984 6.6120 6.6120 7.1851 7.1851 7.4689 7.4689 8.0669 8.0669 8.1579 8.1579 8.2892 8.2892 8.3421 8.3421 8.8690 8.8690 9.1547 9.1547 9.8037 9.8037 10.1918 10.1918 10.5901 10.5901 11.4754 11.4754 11.5860 11.5860 k = 0.1951-0.0000-0.0000 ( 4612 PWs) bands (ev): -4.2491 -4.2491 -2.0652 -2.0652 -1.4243 -1.4243 -0.8538 -0.8538 3.2542 3.2542 4.0548 4.0548 5.1968 5.1968 5.6020 5.6020 5.7082 5.7082 6.2871 6.2871 6.5522 6.5522 6.6012 6.6012 7.2074 7.2074 7.3920 7.3920 8.0520 8.0520 8.1419 8.1419 8.2828 8.2828 8.3492 8.3492 8.8746 8.8746 9.1328 9.1328 9.8201 9.8201 10.1547 10.1547 10.4865 10.4865 11.4221 11.4221 11.5417 11.5417 k = 0.2073-0.0000-0.0000 ( 4606 PWs) bands (ev): -4.2123 -4.2123 -2.0728 -2.0728 -1.4023 -1.4023 -0.8442 -0.8442 3.2936 3.2936 4.0315 4.0315 5.1793 5.1793 5.5751 5.5751 5.7075 5.7075 6.2403 6.2403 6.4856 6.4856 6.6039 6.6039 7.2284 7.2284 7.3233 7.3233 8.0385 8.0385 8.1239 8.1239 8.2766 8.2766 8.3560 8.3560 8.8784 8.8784 9.1095 9.1095 9.8362 9.8362 10.1223 10.1223 10.3882 10.3882 11.3637 11.3637 11.4960 11.4960 k = 0.2195-0.0000-0.0000 ( 4608 PWs) bands (ev): -4.1735 -4.1735 -2.0819 -2.0819 -1.3794 -1.3794 -0.8346 -0.8346 3.3342 3.3342 4.0067 4.0067 5.1637 5.1637 5.5521 5.5521 5.7058 5.7058 6.1893 6.1893 6.4120 6.4120 6.6079 6.6079 7.2352 7.2352 7.2756 7.2756 8.0267 8.0267 8.1040 8.1040 8.2707 8.2707 8.3623 8.3623 8.8803 8.8803 9.0850 9.0850 9.8519 9.8519 10.0944 10.0944 10.2959 10.2959 11.3017 11.3017 11.4482 11.4482 k = 0.2317-0.0000-0.0000 ( 4616 PWs) bands (ev): -4.1328 -4.1328 -2.0928 -2.0928 -1.3556 -1.3556 -0.8251 -0.8251 3.3758 3.3758 3.9813 3.9813 5.1500 5.1500 5.5333 5.5333 5.7020 5.7020 6.1341 6.1341 6.3332 6.3332 6.6129 6.6129 7.1920 7.1920 7.2839 7.2839 8.0166 8.0166 8.0826 8.0826 8.2655 8.2655 8.3682 8.3682 8.8802 8.8802 9.0596 9.0596 9.8670 9.8670 10.0706 10.0706 10.2107 10.2107 11.2373 11.2373 11.3981 11.3981 k = 0.2439-0.0000-0.0000 ( 4620 PWs) bands (ev): -4.0902 -4.0902 -2.1056 -2.1056 -1.3311 -1.3311 -0.8157 -0.8157 3.4176 3.4176 3.9566 3.9566 5.1383 5.1383 5.5183 5.5183 5.6949 5.6949 6.0749 6.0749 6.2518 6.2518 6.6189 6.6189 7.1415 7.1415 7.3040 7.3040 8.0082 8.0082 8.0598 8.0598 8.2610 8.2610 8.3737 8.3737 8.8782 8.8782 9.0333 9.0333 9.8814 9.8814 10.0490 10.0490 10.1347 10.1347 11.1716 11.1716 11.3455 11.3455 k = 0.2561-0.0000-0.0000 ( 4628 PWs) bands (ev): -4.0458 -4.0458 -2.1204 -2.1204 -1.3058 -1.3058 -0.8065 -0.8065 3.4589 3.4589 3.9344 3.9344 5.1281 5.1281 5.5068 5.5068 5.6826 5.6826 6.0127 6.0127 6.1707 6.1707 6.6261 6.6261 7.0938 7.0938 7.3243 7.3243 8.0014 8.0014 8.0361 8.0361 8.2574 8.2574 8.3791 8.3791 8.8743 8.8743 9.0065 9.0065 9.8947 9.8947 10.0220 10.0220 10.0762 10.0762 11.1054 11.1054 11.2906 11.2906 k = 0.2683-0.0000-0.0000 ( 4620 PWs) bands (ev): -3.9997 -3.9997 -2.1374 -2.1374 -1.2800 -1.2800 -0.7977 -0.7977 3.4981 3.4981 3.9168 3.9168 5.1191 5.1191 5.4975 5.4975 5.6631 5.6631 5.9498 5.9498 6.0925 6.0925 6.6342 6.6342 7.0488 7.0488 7.3433 7.3433 7.9959 7.9959 8.0121 8.0121 8.2549 8.2549 8.3842 8.3842 8.8685 8.8685 8.9795 8.9795 9.9049 9.9049 9.9779 9.9779 10.0494 10.0494 11.0394 11.0394 11.2334 11.2334 k = 0.2805-0.0000-0.0000 ( 4632 PWs) bands (ev): -3.9518 -3.9518 -2.1566 -2.1566 -1.2537 -1.2537 -0.7893 -0.7893 3.5335 3.5335 3.9065 3.9065 5.1107 5.1107 5.4877 5.4877 5.6344 5.6344 5.8910 5.8910 6.0185 6.0185 6.6434 6.6434 7.0057 7.0057 7.3601 7.3601 7.9867 7.9867 7.9934 7.9934 8.2535 8.2535 8.3890 8.3890 8.8606 8.8606 8.9525 8.9525 9.8975 9.8975 9.9448 9.9448 10.0405 10.0405 10.9742 10.9742 11.1740 11.1740 k = 0.2927-0.0000-0.0000 ( 4628 PWs) bands (ev): -3.9024 -3.9024 -2.1783 -2.1783 -1.2270 -1.2270 -0.7815 -0.7815 3.5629 3.5629 3.9062 3.9062 5.1026 5.1026 5.4699 5.4699 5.5994 5.5994 5.8417 5.8417 5.9494 5.9494 6.6537 6.6537 6.9637 6.9637 7.3739 7.3739 7.9642 7.9642 7.9898 7.9898 8.2538 8.2538 8.3938 8.3938 8.8505 8.8505 8.9262 8.9262 9.8590 9.8590 9.9468 9.9468 10.0391 10.0391 10.9104 10.9104 11.1127 11.1127 k = 0.3049-0.0000-0.0000 ( 4624 PWs) bands (ev): -3.8514 -3.8514 -2.2025 -2.2025 -1.2000 -1.2000 -0.7744 -0.7744 3.5845 3.5845 3.9184 3.9184 5.0943 5.0943 5.4296 5.4296 5.5721 5.5721 5.8039 5.8039 5.8848 5.8848 6.6650 6.6650 6.9222 6.9222 7.3840 7.3840 7.9427 7.9427 7.9879 7.9879 8.2556 8.2556 8.3984 8.3984 8.8380 8.8380 8.9010 8.9010 9.8182 9.8182 9.9575 9.9575 10.0430 10.0430 10.8482 10.8482 11.0496 11.0496 k = 0.3171-0.0000-0.0000 ( 4624 PWs) bands (ev): -3.7990 -3.7990 -2.2293 -2.2293 -1.1729 -1.1729 -0.7680 -0.7680 3.5984 3.5984 3.9435 3.9435 5.0855 5.0855 5.3616 5.3616 5.5607 5.5607 5.7748 5.7748 5.8257 5.8257 6.6773 6.6773 6.8808 6.8808 7.3894 7.3894 7.9236 7.9236 7.9869 7.9869 8.2591 8.2591 8.4029 8.4029 8.8226 8.8226 8.8775 8.8775 9.7829 9.7829 9.9694 9.9694 10.0516 10.0516 10.7881 10.7881 10.9852 10.9852 k = 0.3293-0.0000-0.0000 ( 4618 PWs) bands (ev): -3.7452 -3.7452 -2.2587 -2.2587 -1.1457 -1.1457 -0.7625 -0.7625 3.6066 3.6066 3.9799 3.9799 5.0757 5.0757 5.2769 5.2769 5.5571 5.5571 5.7450 5.7450 5.7796 5.7796 6.6905 6.6905 6.8393 6.8393 7.3895 7.3895 7.9079 7.9079 7.9864 7.9864 8.2644 8.2644 8.4075 8.4075 8.8043 8.8043 8.8560 8.8560 9.7543 9.7543 9.9816 9.9816 10.0646 10.0646 10.7302 10.7302 10.9197 10.9197 k = 0.3415-0.0000-0.0000 ( 4618 PWs) bands (ev): -3.6901 -3.6901 -2.2907 -2.2907 -1.1185 -1.1185 -0.7580 -0.7580 3.6119 3.6119 4.0250 4.0250 5.0635 5.0635 5.1863 5.1863 5.5523 5.5523 5.7007 5.7007 5.7605 5.7605 6.7042 6.7042 6.7978 6.7978 7.3838 7.3838 7.8962 7.8962 7.9863 7.9863 8.2716 8.2716 8.4121 8.4121 8.7838 8.7838 8.8363 8.8363 9.7328 9.7328 9.9939 9.9939 10.0818 10.0818 10.6746 10.6746 10.8533 10.8533 k = 0.3537-0.0000-0.0000 ( 4616 PWs) bands (ev): -3.6339 -3.6339 -2.3255 -2.3255 -1.0915 -1.0915 -0.7546 -0.7546 3.6170 3.6170 4.0763 4.0763 5.0391 5.0391 5.1044 5.1044 5.5402 5.5402 5.6534 5.6534 5.7591 5.7591 6.7158 6.7158 6.7589 6.7589 7.3722 7.3722 7.8887 7.8887 7.9863 7.9863 8.2806 8.2806 8.4167 8.4167 8.7619 8.7619 8.8176 8.8176 9.7183 9.7183 10.0063 10.0063 10.1029 10.1029 10.6213 10.6213 10.7867 10.7867 k = 0.3659-0.0000-0.0000 ( 4604 PWs) bands (ev): -3.5766 -3.5766 -2.3628 -2.3628 -1.0648 -1.0648 -0.7523 -0.7523 3.6238 3.6238 4.1315 4.1315 4.9701 4.9701 5.0665 5.0665 5.5179 5.5179 5.6094 5.6094 5.7697 5.7697 6.7009 6.7009 6.7469 6.7469 7.3549 7.3549 7.8853 7.8853 7.9864 7.9864 8.2914 8.2914 8.4215 8.4215 8.7397 8.7397 8.7993 8.7993 9.7106 9.7106 10.0190 10.0190 10.1278 10.1278 10.5704 10.5704 10.7201 10.7201 k = 0.3780-0.0000-0.0000 ( 4600 PWs) bands (ev): -3.5184 -3.5184 -2.4027 -2.4027 -1.0385 -1.0385 -0.7514 -0.7514 3.6339 3.6339 4.1890 4.1890 4.8792 4.8792 5.0518 5.0518 5.4869 5.4869 5.5685 5.5685 5.7900 5.7900 6.6602 6.6602 6.7614 6.7614 7.3328 7.3328 7.8855 7.8855 7.9863 7.9863 8.3040 8.3040 8.4262 8.4262 8.7178 8.7178 8.7808 8.7808 9.7096 9.7096 10.0321 10.0321 10.1563 10.1563 10.5215 10.5215 10.6542 10.6542 k = 0.3902-0.0000-0.0000 ( 4586 PWs) bands (ev): -3.4595 -3.4595 -2.4451 -2.4451 -1.0128 -1.0128 -0.7518 -0.7518 3.6480 3.6480 4.2467 4.2467 4.7881 4.7881 5.0410 5.0410 5.4511 5.4511 5.5290 5.5290 5.8174 5.8174 6.6158 6.6158 6.7800 6.7800 7.3066 7.3066 7.8888 7.8888 7.9860 7.9860 8.3181 8.3181 8.4312 8.4312 8.6967 8.6967 8.7621 8.7621 9.7149 9.7149 10.0455 10.0455 10.1880 10.1880 10.4741 10.4741 10.5900 10.5900 k = 0.4024-0.0000-0.0000 ( 4596 PWs) bands (ev): -3.3998 -3.3998 -2.4899 -2.4899 -0.9877 -0.9877 -0.7536 -0.7536 3.6667 3.6667 4.3015 4.3015 4.7024 4.7024 5.0310 5.0310 5.4141 5.4141 5.4892 5.4892 5.8500 5.8500 6.5703 6.5703 6.8004 6.8004 7.2773 7.2773 7.8941 7.8941 7.9852 7.9852 8.3335 8.3335 8.4361 8.4361 8.6768 8.6768 8.7428 8.7428 9.7264 9.7264 10.0595 10.0595 10.2226 10.2226 10.4274 10.4274 10.5290 10.5290 k = 0.4146-0.0000-0.0000 ( 4598 PWs) bands (ev): -3.3396 -3.3396 -2.5370 -2.5370 -0.9634 -0.9634 -0.7569 -0.7569 3.6905 3.6905 4.3462 4.3462 4.6302 4.6302 5.0211 5.0211 5.3782 5.3782 5.4486 5.4486 5.8865 5.8865 6.5241 6.5241 6.8223 6.8223 7.2458 7.2458 7.9010 7.9010 7.9839 7.9839 8.3501 8.3501 8.4411 8.4411 8.6583 8.6583 8.7232 8.7232 9.7437 9.7437 10.0741 10.0741 10.2591 10.2591 10.3797 10.3797 10.4737 10.4737 k = 0.4268-0.0000-0.0000 ( 4602 PWs) bands (ev): -3.2790 -3.2790 -2.5863 -2.5863 -0.9400 -0.9400 -0.7617 -0.7617 3.7194 3.7194 4.3623 4.3623 4.5898 4.5898 5.0103 5.0103 5.3448 5.3448 5.4077 5.4077 5.9258 5.9258 6.4774 6.4774 6.8456 6.8456 7.2128 7.2128 7.9089 7.9089 7.9820 7.9820 8.3674 8.3674 8.4460 8.4460 8.6415 8.6415 8.7034 8.7034 9.7665 9.7665 10.0894 10.0894 10.2944 10.2944 10.3293 10.3293 10.4293 10.4293 k = 0.4390-0.0000-0.0000 ( 4602 PWs) bands (ev): -3.2183 -3.2183 -2.6375 -2.6375 -0.9176 -0.9176 -0.7681 -0.7681 3.7537 3.7537 4.3318 4.3318 4.5992 4.5992 4.9976 4.9976 5.3149 5.3149 5.3676 5.3676 5.9673 5.9673 6.4303 6.4303 6.8703 6.8703 7.1790 7.1790 7.9172 7.9172 7.9795 7.9795 8.3851 8.3851 8.4506 8.4506 8.6269 8.6269 8.6837 8.6837 9.7945 9.7945 10.1057 10.1057 10.2753 10.2753 10.3166 10.3166 10.4084 10.4084 k = 0.4512-0.0000-0.0000 ( 4610 PWs) bands (ev): -3.1574 -3.1574 -2.6905 -2.6905 -0.8963 -0.8963 -0.7761 -0.7761 3.7934 3.7934 4.2720 4.2720 4.6408 4.6408 4.9816 4.9816 5.2890 5.2890 5.3302 5.3302 6.0105 6.0105 6.3830 6.3830 6.8962 6.8962 7.1449 7.1449 7.9257 7.9257 7.9763 7.9763 8.4025 8.4025 8.4548 8.4548 8.6148 8.6148 8.6643 8.6643 9.8274 9.8274 10.1228 10.1228 10.2193 10.2193 10.3068 10.3068 10.4287 10.4287 k = 0.4634-0.0000-0.0000 ( 4598 PWs) bands (ev): -3.0967 -3.0967 -2.7452 -2.7452 -0.8762 -0.8762 -0.7858 -0.7858 3.8383 3.8383 4.2033 4.2033 4.6935 4.6935 4.9605 4.9605 5.2682 5.2682 5.2977 5.2977 6.0550 6.0550 6.3356 6.3356 6.9236 6.9236 7.1110 7.1110 7.9341 7.9341 7.9724 7.9724 8.4190 8.4190 8.4580 8.4580 8.6060 8.6060 8.6460 8.6460 9.8648 9.8648 10.1404 10.1404 10.1635 10.1635 10.2817 10.2817 10.4719 10.4719 k = 0.4756-0.0000-0.0000 ( 4596 PWs) bands (ev): -3.0363 -3.0363 -2.8013 -2.8013 -0.8575 -0.8575 -0.7970 -0.7970 3.8883 3.8883 4.1339 4.1339 4.7488 4.7488 4.9323 4.9323 5.2533 5.2533 5.2721 5.2721 6.1005 6.1005 6.2881 6.2881 6.9521 6.9521 7.0775 7.0775 7.9420 7.9420 7.9678 7.9678 8.4336 8.4336 8.4594 8.4594 8.6010 8.6010 8.6295 8.6295 9.9065 9.9065 10.1062 10.1062 10.1615 10.1615 10.2549 10.2549 10.5231 10.5231 k = 0.4878-0.0000-0.0000 ( 4588 PWs) bands (ev): -2.9763 -2.9763 -2.8586 -2.8586 -0.8401 -0.8401 -0.8098 -0.8098 3.9432 3.9432 4.0666 4.0666 4.8026 4.8026 4.8961 4.8961 5.2456 5.2456 5.2546 5.2546 6.1467 6.1467 6.2407 6.2407 6.9819 6.9819 7.0447 7.0447 7.9495 7.9495 7.9624 7.9624 8.4455 8.4455 8.4583 8.4583 8.6008 8.6008 8.6158 8.6158 9.9519 9.9519 10.0523 10.0523 10.1824 10.1824 10.2291 10.2291 10.5786 10.5786 k = 0.5000-0.0000-0.0000 ( 4592 PWs) bands (ev): -2.9170 -2.9170 -2.9170 -2.9170 -0.8242 -0.8242 -0.8242 -0.8242 4.0028 4.0028 4.0028 4.0028 4.8524 4.8524 4.8524 4.8524 5.2458 5.2458 5.2458 5.2458 6.1935 6.1935 6.1935 6.1935 7.0128 7.0128 7.0128 7.0128 7.9563 7.9563 7.9563 7.9563 8.4538 8.4538 8.4538 8.4538 8.6059 8.6059 8.6059 8.6059 10.0006 10.0006 10.0006 10.0006 10.2049 10.2049 10.2049 10.2049 10.6372 10.6372 k = 0.5000-0.0000-0.0000 ( 4592 PWs) bands (ev): -2.9170 -2.9170 -2.9170 -2.9170 -0.8242 -0.8242 -0.8242 -0.8242 4.0028 4.0028 4.0028 4.0028 4.8524 4.8524 4.8524 4.8524 5.2458 5.2458 5.2458 5.2458 6.1935 6.1935 6.1935 6.1935 7.0128 7.0128 7.0128 7.0128 7.9563 7.9563 7.9563 7.9563 8.4538 8.4538 8.4538 8.4538 8.6059 8.6059 8.6059 8.6059 10.0006 10.0006 10.0006 10.0006 10.2049 10.2049 10.2049 10.2049 10.6372 10.6372 k = 0.5000 0.0122-0.0000 ( 4588 PWs) bands (ev): -2.9162 -2.9162 -2.9161 -2.9161 -0.8256 -0.8256 -0.8255 -0.8255 4.0014 4.0014 4.0063 4.0063 4.8279 4.8279 4.8452 4.8452 5.2498 5.2498 5.2781 5.2781 6.1844 6.1844 6.1948 6.1948 7.0123 7.0123 7.0149 7.0149 7.9497 7.9497 7.9590 7.9590 8.4522 8.4522 8.4556 8.4556 8.6053 8.6053 8.6068 8.6068 9.9976 9.9976 9.9992 9.9992 10.1861 10.1861 10.2128 10.2128 10.6365 10.6365 k = 0.5000 0.0244-0.0000 ( 4592 PWs) bands (ev): -2.9134 -2.9134 -2.9133 -2.9133 -0.8298 -0.8298 -0.8296 -0.8296 4.0021 4.0021 4.0119 4.0119 4.7820 4.7820 4.8093 4.8093 5.2866 5.2866 5.3365 5.3365 6.1675 6.1675 6.1885 6.1885 7.0133 7.0133 7.0184 7.0184 7.9394 7.9394 7.9579 7.9579 8.4508 8.4508 8.4576 8.4576 8.6051 8.6051 8.6081 8.6081 9.9902 9.9902 9.9931 9.9931 10.1604 10.1604 10.2086 10.2086 10.6586 10.6586 k = 0.5000 0.0366-0.0000 ( 4584 PWs) bands (ev): -2.9089 -2.9089 -2.9087 -2.9087 -0.8367 -0.8367 -0.8364 -0.8364 4.0048 4.0048 4.0195 4.0195 4.7258 4.7258 4.7571 4.7571 5.3433 5.3433 5.4097 5.4097 6.1433 6.1433 6.1755 6.1755 7.0152 7.0152 7.0227 7.0227 7.9261 7.9261 7.9533 7.9533 8.4498 8.4498 8.4598 8.4598 8.6053 8.6053 8.6096 8.6096 9.9787 9.9787 9.9824 9.9824 10.1327 10.1327 10.1951 10.1951 10.7006 10.7006 k = 0.5000 0.0488-0.0000 ( 4592 PWs) bands (ev): -2.9026 -2.9026 -2.9023 -2.9023 -0.8463 -0.8463 -0.8458 -0.8458 4.0094 4.0094 4.0291 4.0291 4.6662 4.6662 4.6983 4.6983 5.4091 5.4091 5.4907 5.4907 6.1125 6.1125 6.1573 6.1573 7.0170 7.0170 7.0271 7.0271 7.9106 7.9106 7.9458 7.9458 8.4490 8.4490 8.4621 8.4621 8.6057 8.6057 8.6112 8.6112 9.9634 9.9634 9.9668 9.9668 10.1066 10.1066 10.1768 10.1768 10.7579 10.7579 k = 0.5000 0.0610-0.0000 ( 4596 PWs) bands (ev): -2.8944 -2.8944 -2.8941 -2.8941 -0.8585 -0.8585 -0.8579 -0.8579 4.0158 4.0158 4.0405 4.0405 4.6066 4.6066 4.6383 4.6383 5.4774 5.4774 5.5755 5.5755 6.0765 6.0765 6.1359 6.1359 7.0175 7.0175 7.0304 7.0304 7.8940 7.8940 7.9362 7.9362 8.4485 8.4485 8.4646 8.4646 8.6065 8.6065 8.6130 8.6130 9.9450 9.9450 9.9466 9.9466 10.0848 10.0848 10.1573 10.1573 10.8267 10.8267 k = 0.5000 0.0732-0.0000 ( 4592 PWs) bands (ev): -2.8845 -2.8845 -2.8842 -2.8842 -0.8733 -0.8733 -0.8726 -0.8726 4.0238 4.0238 4.0536 4.0536 4.5490 4.5490 4.5798 4.5798 5.5427 5.5427 5.6608 5.6608 6.0370 6.0370 6.1144 6.1144 7.0155 7.0155 7.0316 7.0316 7.8776 7.8776 7.9257 7.9257 8.4483 8.4483 8.4673 8.4673 8.6076 8.6076 8.6148 8.6148 9.9227 9.9227 9.9243 9.9243 10.0682 10.0682 10.1389 10.1389 10.9041 10.9041 k = 0.5000 0.0854-0.0000 ( 4606 PWs) bands (ev): -2.8729 -2.8729 -2.8725 -2.8725 -0.8906 -0.8906 -0.8898 -0.8898 4.0332 4.0332 4.0680 4.0680 4.4948 4.4948 4.5246 4.5246 5.5995 5.5995 5.7420 5.7420 5.9979 5.9979 6.0974 6.0974 7.0094 7.0094 7.0295 7.0295 7.8629 7.8629 7.9155 7.9155 8.4485 8.4485 8.4701 8.4701 8.6089 8.6089 8.6166 8.6166 9.8966 9.8966 9.9020 9.9020 10.0571 10.0571 10.1231 10.1231 10.9881 10.9881 k = 0.5000 0.0976-0.0000 ( 4602 PWs) bands (ev): -2.8596 -2.8596 -2.8591 -2.8591 -0.9103 -0.9103 -0.9095 -0.9095 4.0436 4.0436 4.0834 4.0834 4.4449 4.4449 4.4739 4.4739 5.6412 5.6412 5.8057 5.8057 5.9722 5.9722 6.0908 6.0908 6.9979 6.9979 7.0232 7.0232 7.8516 7.8516 7.9071 7.9071 8.4490 8.4490 8.4732 8.4732 8.6105 8.6105 8.6185 8.6185 9.8698 9.8698 9.8792 9.8792 10.0510 10.0510 10.1107 10.1107 11.0774 11.0774 k = 0.5000 0.1098-0.0000 ( 4610 PWs) bands (ev): -2.8447 -2.8447 -2.8441 -2.8441 -0.9324 -0.9324 -0.9314 -0.9314 4.0544 4.0544 4.0990 4.0990 4.4002 4.4002 4.4290 4.4290 5.6615 5.6615 5.8177 5.8177 5.9935 5.9935 6.1006 6.1006 6.9799 6.9799 7.0117 7.0117 7.8449 7.8449 7.9016 7.9016 8.4498 8.4498 8.4763 8.4763 8.6121 8.6121 8.6203 8.6203 9.8436 9.8436 9.8564 9.8564 10.0497 10.0497 10.1020 10.1020 11.1705 11.1705 k = 0.5000 0.1221-0.0000 ( 4618 PWs) bands (ev): -2.8281 -2.8281 -2.8275 -2.8275 -0.9567 -0.9567 -0.9556 -0.9556 4.0650 4.0650 4.1136 4.1136 4.3616 4.3616 4.3912 4.3912 5.6585 5.6585 5.7824 5.7824 6.0573 6.0573 6.1283 6.1283 6.9548 6.9548 6.9943 6.9943 7.8440 7.8440 7.9005 7.9005 8.4510 8.4510 8.4797 8.4797 8.6138 8.6138 8.6220 8.6220 9.8187 9.8187 9.8346 9.8346 10.0533 10.0533 10.0975 10.0975 11.2666 11.2666 k = 0.5000 0.1343-0.0000 ( 4620 PWs) bands (ev): -2.8101 -2.8101 -2.8094 -2.8094 -0.9830 -0.9830 -0.9818 -0.9818 4.0742 4.0742 4.1256 4.1256 4.3304 4.3304 4.3623 4.3623 5.6360 5.6360 5.7313 5.7313 6.1316 6.1316 6.1698 6.1698 6.9224 6.9224 6.9709 6.9709 7.8495 7.8495 7.9043 7.9043 8.4525 8.4525 8.4832 8.4832 8.6156 8.6156 8.6237 8.6237 9.7959 9.7959 9.8143 9.8143 10.0619 10.0619 10.0975 10.0975 11.3645 11.3645 k = 0.5000 0.1465-0.0000 ( 4628 PWs) bands (ev): -2.7907 -2.7907 -2.7899 -2.7899 -1.0112 -1.0112 -1.0099 -1.0099 4.0809 4.0809 4.1327 4.1327 4.3075 4.3075 4.3445 4.3445 5.6003 5.6003 5.6748 5.6748 6.2055 6.2055 6.2184 6.2184 6.8833 6.8833 6.9416 6.9416 7.8614 7.8614 7.9137 7.9137 8.4543 8.4543 8.4868 8.4868 8.6175 8.6175 8.6254 8.6254 9.7753 9.7753 9.7959 9.7959 10.0758 10.0758 10.1021 10.1021 11.4631 11.4631 k = 0.5000 0.1587-0.0000 ( 4626 PWs) bands (ev): -2.7698 -2.7698 -2.7690 -2.7690 -1.0411 -1.0411 -1.0397 -1.0397 4.0839 4.0839 4.1335 4.1335 4.2942 4.2942 4.3391 4.3391 5.5565 5.5565 5.6162 5.6162 6.2685 6.2685 6.2753 6.2753 6.8388 6.8388 6.9073 6.9073 7.8792 7.8792 7.9287 7.9287 8.4564 8.4564 8.4907 8.4907 8.6195 8.6195 8.6271 8.6271 9.7572 9.7572 9.7797 9.7797 10.0955 10.0955 10.1119 10.1119 11.5614 11.5614 k = 0.5000 0.1709-0.0000 ( 4628 PWs) bands (ev): -2.7478 -2.7478 -2.7469 -2.7469 -1.0726 -1.0726 -1.0711 -1.0711 4.0829 4.0829 4.1286 4.1286 4.2902 4.2902 4.3454 4.3454 5.5082 5.5082 5.5569 5.5569 6.3154 6.3154 6.3388 6.3388 6.7910 6.7910 6.8694 6.8694 7.9021 7.9021 7.9486 7.9486 8.4589 8.4589 8.4947 8.4947 8.6217 8.6217 8.6288 8.6288 9.7414 9.7414 9.7657 9.7657 10.1214 10.1214 10.1272 10.1272 11.6582 11.6582 k = 0.5000 0.1831-0.0000 ( 4632 PWs) bands (ev): -2.7247 -2.7247 -2.7236 -2.7236 -1.1053 -1.1053 -1.1037 -1.1037 4.0790 4.0790 4.1204 4.1204 4.2944 4.2944 4.3604 4.3604 5.4579 5.4579 5.4980 5.4980 6.3549 6.3549 6.3939 6.3939 6.7431 6.7431 6.8300 6.8300 7.9291 7.9291 7.9729 7.9729 8.4617 8.4617 8.4988 8.4988 8.6238 8.6238 8.6304 8.6304 9.7280 9.7280 9.7540 9.7540 10.1484 10.1484 10.1541 10.1541 11.7521 11.7521 k = 0.5000 0.1953-0.0000 ( 4646 PWs) bands (ev): -2.7006 -2.7006 -2.6994 -2.6994 -1.1391 -1.1391 -1.1373 -1.1373 4.0739 4.0739 4.1116 4.1116 4.3044 4.3044 4.3809 4.3809 5.4075 5.4075 5.4402 5.4402 6.3812 6.3812 6.4373 6.4373 6.7006 6.7006 6.7927 6.7927 7.9588 7.9588 8.0005 8.0005 8.4648 8.4648 8.5031 8.5031 8.6262 8.6262 8.6322 8.6322 9.7168 9.7168 9.7444 9.7444 10.1760 10.1760 10.1938 10.1938 11.8418 11.8418 k = 0.5000 0.2075-0.0000 ( 4638 PWs) bands (ev): -2.6757 -2.6757 -2.6744 -2.6744 -1.1736 -1.1736 -1.1717 -1.1717 4.0692 4.0692 4.1040 4.1040 4.3181 4.3181 4.4043 4.4043 5.3585 5.3585 5.3845 5.3845 6.3868 6.3868 6.4648 6.4648 6.6714 6.6714 6.7629 6.7629 7.9902 7.9902 8.0303 8.0303 8.4683 8.4683 8.5075 8.5075 8.6286 8.6286 8.6340 8.6340 9.7076 9.7076 9.7368 9.7368 10.2105 10.2105 10.2413 10.2413 11.9258 11.9258 k = 0.5000 0.2197-0.0000 ( 4642 PWs) bands (ev): -2.6502 -2.6502 -2.6488 -2.6488 -1.2086 -1.2086 -1.2066 -1.2066 4.0663 4.0663 4.0989 4.0989 4.3334 4.3334 4.4285 4.4285 5.3126 5.3126 5.3315 5.3315 6.3662 6.3662 6.4709 6.4709 6.6617 6.6617 6.7468 6.7468 8.0221 8.0221 8.0611 8.0611 8.4721 8.4721 8.5118 8.5118 8.6312 8.6312 8.6359 8.6359 9.7000 9.7000 9.7309 9.7309 10.2520 10.2520 10.2965 10.2965 12.0023 12.0023 k = 0.5000 0.2319-0.0000 ( 4648 PWs) bands (ev): -2.6244 -2.6244 -2.6229 -2.6229 -1.2437 -1.2437 -1.2416 -1.2416 4.0658 4.0658 4.0969 4.0969 4.3487 4.3487 4.4515 4.4515 5.2713 5.2713 5.2822 5.2822 6.3230 6.3230 6.4542 6.4542 6.6684 6.6684 6.7470 6.7470 8.0533 8.0533 8.0916 8.0916 8.4761 8.4761 8.5162 8.5162 8.6339 8.6339 8.6378 8.6378 9.6940 9.6940 9.7265 9.7265 10.3006 10.3006 10.3595 10.3595 12.0700 12.0700 k = 0.5000 0.2441-0.0000 ( 4652 PWs) bands (ev): -2.5984 -2.5984 -2.5968 -2.5968 -1.2785 -1.2785 -1.2762 -1.2762 4.0682 4.0682 4.0981 4.0981 4.3626 4.3626 4.4715 4.4715 5.2364 5.2364 5.2374 5.2374 6.2657 6.2657 6.4206 6.4206 6.6839 6.6839 6.7589 6.7589 8.0831 8.0831 8.1209 8.1209 8.4803 8.4803 8.5205 8.5205 8.6367 8.6367 8.6398 8.6398 9.6892 9.6892 9.7231 9.7231 10.3561 10.3561 10.4302 10.4302 12.1270 12.1270 k = 0.5000 0.2563-0.0000 ( 4656 PWs) bands (ev): -2.5727 -2.5727 -2.5710 -2.5710 -1.3126 -1.3126 -1.3102 -1.3102 4.0737 4.0737 4.1028 4.1028 4.3736 4.3736 4.4869 4.4869 5.1980 5.1980 5.2097 5.2097 6.2011 6.2011 6.3774 6.3774 6.7024 6.7024 6.7761 6.7761 8.1107 8.1107 8.1482 8.1482 8.4847 8.4847 8.5247 8.5247 8.6395 8.6395 8.6419 8.6419 9.6855 9.6855 9.7208 9.7208 10.4179 10.4179 10.5079 10.5079 12.1722 12.1722 k = 0.5000 0.2685-0.0000 ( 4644 PWs) bands (ev): -2.5477 -2.5477 -2.5458 -2.5458 -1.3455 -1.3455 -1.3430 -1.3430 4.0824 4.0824 4.1108 4.1108 4.3808 4.3808 4.4959 4.4959 5.1647 5.1647 5.1927 5.1927 6.1330 6.1330 6.3304 6.3304 6.7210 6.7210 6.7947 6.7947 8.1357 8.1357 8.1729 8.1729 8.4891 8.4891 8.5286 8.5286 8.6425 8.6425 8.6440 8.6440 9.6826 9.6826 9.7192 9.7192 10.4851 10.4851 10.5919 10.5919 12.2029 12.2029 k = 0.5000 0.2807-0.0000 ( 4642 PWs) bands (ev): -2.5236 -2.5236 -2.5216 -2.5216 -1.3768 -1.3768 -1.3741 -1.3741 4.0940 4.0940 4.1219 4.1219 4.3832 4.3832 4.4976 4.4976 5.1381 5.1381 5.1863 5.1863 6.0639 6.0639 6.2828 6.2828 6.7382 6.7382 6.8123 6.8123 8.1577 8.1577 8.1946 8.1946 8.4934 8.4934 8.5323 8.5323 8.6454 8.6454 8.6460 8.6460 9.6804 9.6804 9.7181 9.7181 10.5561 10.5561 10.6807 10.6807 12.2069 12.2069 k = 0.5000 0.2929-0.0000 ( 4638 PWs) bands (ev): -2.5010 -2.5010 -2.4989 -2.4989 -1.4058 -1.4058 -1.4029 -1.4029 4.1084 4.1084 4.1358 4.1358 4.3803 4.3803 4.4919 4.4919 5.1182 5.1182 5.1907 5.1907 5.9955 5.9955 6.2371 6.2371 6.7534 6.7534 6.8280 6.8280 8.1766 8.1766 8.2130 8.2130 8.4974 8.4974 8.5355 8.5355 8.6480 8.6480 8.6482 8.6482 9.6787 9.6787 9.7174 9.7174 10.6289 10.6289 10.7725 10.7725 12.1960 12.1960 k = 0.5000 0.3051-0.0000 ( 4646 PWs) bands (ev): -2.4805 -2.4805 -2.4783 -2.4783 -1.4319 -1.4319 -1.4289 -1.4289 4.1252 4.1252 4.1520 4.1520 4.3723 4.3723 4.4796 4.4796 5.1046 5.1046 5.2045 5.2045 5.9295 5.9295 6.1950 6.1950 6.7663 6.7663 6.8415 6.8415 8.1924 8.1924 8.2282 8.2282 8.5010 8.5010 8.5383 8.5383 8.6497 8.6497 8.6507 8.6507 9.6775 9.6775 9.7169 9.7169 10.7009 10.7009 10.8648 10.8648 12.1718 12.1718 k = 0.5000 0.3173-0.0000 ( 4638 PWs) bands (ev): -2.4626 -2.4626 -2.4603 -2.4603 -1.4545 -1.4545 -1.4514 -1.4514 4.1439 4.1439 4.1698 4.1698 4.3596 4.3596 4.4627 4.4627 5.0964 5.0964 5.2254 5.2254 5.8677 5.8677 6.1581 6.1581 6.7768 6.7768 6.8525 6.8525 8.2051 8.2051 8.2404 8.2404 8.5042 8.5042 8.5408 8.5408 8.6513 8.6513 8.6530 8.6530 9.6766 9.6766 9.7167 9.7167 10.7687 10.7687 10.9541 10.9541 12.1376 12.1376 k = 0.5000 0.3295-0.0000 ( 4642 PWs) bands (ev): -2.4479 -2.4479 -2.4455 -2.4455 -1.4729 -1.4729 -1.4697 -1.4697 4.1636 4.1636 4.1880 4.1880 4.3438 4.3438 4.4434 4.4434 5.0922 5.0922 5.2502 5.2502 5.8124 5.8124 6.1276 6.1276 6.7850 6.7850 6.8610 6.8610 8.2149 8.2149 8.2496 8.2496 8.5068 8.5068 8.5426 8.5426 8.6525 8.6525 8.6548 8.6548 9.6760 9.6760 9.7165 9.7165 10.8285 10.8285 11.0359 11.0359 12.0980 12.0980 k = 0.5000 0.3417-0.0000 ( 4654 PWs) bands (ev): -2.4370 -2.4370 -2.4344 -2.4344 -1.4866 -1.4866 -1.4833 -1.4833 4.1827 4.1827 4.2047 4.2047 4.3268 4.3268 4.4250 4.4250 5.0906 5.0906 5.2745 5.2745 5.7671 5.7671 6.1049 6.1049 6.7907 6.7907 6.8670 6.8670 8.2217 8.2217 8.2560 8.2560 8.5086 8.5086 8.5439 8.5439 8.6535 8.6535 8.6562 8.6562 9.6755 9.6755 9.7164 9.7164 10.8759 10.8759 11.1036 11.1036 12.0599 12.0599 k = 0.5000 0.3540-0.0000 ( 4652 PWs) bands (ev): -2.4302 -2.4302 -2.4276 -2.4276 -1.4950 -1.4950 -1.4916 -1.4916 4.1981 4.1981 4.2171 4.2171 4.3124 4.3124 4.4113 4.4113 5.0902 5.0902 5.2927 5.2927 5.7366 5.7366 6.0908 6.0908 6.7942 6.7942 6.8706 6.8706 8.2258 8.2258 8.2598 8.2598 8.5098 8.5098 8.5448 8.5448 8.6541 8.6541 8.6571 8.6571 9.6753 9.6753 9.7164 9.7164 10.9065 10.9065 11.1493 11.1493 12.0317 12.0317 k = 0.5000 0.3662-0.0000 ( 4648 PWs) bands (ev): -2.4279 -2.4279 -2.4253 -2.4253 -1.4978 -1.4978 -1.4945 -1.4945 4.2045 4.2045 4.2218 4.2218 4.3063 4.3063 4.4060 4.4060 5.0902 5.0902 5.2996 5.2996 5.7256 5.7256 6.0861 6.0861 6.7953 6.7953 6.8718 6.8718 8.2272 8.2272 8.2611 8.2611 8.5102 8.5102 8.5451 8.5451 8.6543 8.6543 8.6574 8.6574 9.6752 9.6752 9.7163 9.7163 10.9171 10.9171 11.1657 11.1657 12.0212 12.0212 k = 0.5000 0.3662-0.0000 ( 4648 PWs) bands (ev): -2.4279 -2.4279 -2.4253 -2.4253 -1.4978 -1.4978 -1.4945 -1.4945 4.2045 4.2045 4.2218 4.2218 4.3063 4.3063 4.4060 4.4060 5.0902 5.0902 5.2996 5.2996 5.7256 5.7256 6.0861 6.0861 6.7953 6.7953 6.8718 6.8718 8.2272 8.2272 8.2611 8.2611 8.5102 8.5102 8.5451 8.5451 8.6543 8.6543 8.6574 8.6574 9.6752 9.6752 9.7163 9.7163 10.9171 10.9171 11.1657 11.1657 12.0212 12.0212 k = 0.4878 0.3662-0.0000 ( 4646 PWs) bands (ev): -2.4301 -2.4301 -2.4275 -2.4275 -1.4971 -1.4971 -1.4938 -1.4938 4.1740 4.1740 4.2554 4.2554 4.3001 4.3001 4.4150 4.4150 5.0840 5.0840 5.2952 5.2952 5.7344 5.7344 6.0921 6.0921 6.7977 6.7977 6.8734 6.8734 8.2270 8.2270 8.2609 8.2609 8.5103 8.5103 8.5451 8.5451 8.6544 8.6544 8.6575 8.6575 9.6750 9.6750 9.7160 9.7160 10.9164 10.9164 11.1647 11.1647 12.0211 12.0211 k = 0.4756 0.3662-0.0000 ( 4642 PWs) bands (ev): -2.4368 -2.4368 -2.4342 -2.4342 -1.4952 -1.4952 -1.4918 -1.4918 4.1390 4.1390 4.2856 4.2856 4.2995 4.2995 4.4374 4.4374 5.0670 5.0670 5.2825 5.2825 5.7596 5.7596 6.1093 6.1093 6.8050 6.8050 6.8780 6.8780 8.2266 8.2266 8.2605 8.2605 8.5108 8.5108 8.5452 8.5452 8.6547 8.6547 8.6577 8.6577 9.6742 9.6742 9.7151 9.7151 10.9143 10.9143 11.1618 11.1618 12.0211 12.0211 k = 0.4634 0.3662-0.0000 ( 4638 PWs) bands (ev): -2.4477 -2.4477 -2.4452 -2.4452 -1.4921 -1.4921 -1.4887 -1.4887 4.1064 4.1064 4.2684 4.2684 4.3472 4.3472 4.4671 4.4671 5.0427 5.0427 5.2632 5.2632 5.7980 5.7980 6.1360 6.1360 6.8174 6.8174 6.8858 6.8858 8.2260 8.2260 8.2597 8.2597 8.5117 8.5117 8.5454 8.5454 8.6551 8.6551 8.6581 8.6581 9.6729 9.6729 9.7134 9.7134 10.9109 10.9109 11.1571 11.1571 12.0210 12.0210 k = 0.4512 0.3662-0.0000 ( 4630 PWs) bands (ev): -2.4627 -2.4627 -2.4602 -2.4602 -1.4880 -1.4880 -1.4846 -1.4846 4.0760 4.0760 4.2507 4.2507 4.3983 4.3983 4.5006 4.5006 5.0157 5.0157 5.2399 5.2399 5.8459 5.8459 6.1697 6.1697 6.8349 6.8349 6.8967 6.8967 8.2252 8.2252 8.2587 8.2587 8.5128 8.5128 8.5457 8.5457 8.6560 8.6560 8.6589 8.6589 9.6712 9.6712 9.7112 9.7112 10.9063 10.9063 11.1508 11.1508 12.0207 12.0207 k = 0.4390 0.3662-0.0000 ( 4634 PWs) bands (ev): -2.4813 -2.4813 -2.4789 -2.4789 -1.4832 -1.4832 -1.4798 -1.4798 4.0474 4.0474 4.2327 4.2327 4.4526 4.4526 4.5361 4.5361 4.9907 4.9907 5.2147 5.2147 5.9003 5.9003 6.2080 6.2080 6.8580 6.8580 6.9109 6.9109 8.2240 8.2240 8.2572 8.2572 8.5143 8.5143 8.5459 8.5459 8.6574 8.6574 8.6600 8.6600 9.6689 9.6689 9.7084 9.7084 10.9005 10.9005 11.1430 11.1430 12.0203 12.0203 k = 0.4268 0.3662-0.0000 ( 4634 PWs) bands (ev): -2.5033 -2.5033 -2.5009 -2.5009 -1.4779 -1.4779 -1.4745 -1.4745 4.0200 4.0200 4.2137 4.2137 4.5101 4.5101 4.5718 4.5718 4.9719 4.9719 5.1901 5.1901 5.9584 5.9584 6.2485 6.2485 6.8868 6.8868 6.9285 6.9285 8.2226 8.2226 8.2554 8.2554 8.5160 8.5160 8.5463 8.5463 8.6596 8.6596 8.6617 8.6617 9.6662 9.6662 9.7049 9.7049 10.8938 10.8938 11.1342 11.1342 12.0196 12.0196 k = 0.4146 0.3662-0.0000 ( 4634 PWs) bands (ev): -2.5282 -2.5282 -2.5259 -2.5259 -1.4725 -1.4725 -1.4691 -1.4691 3.9934 3.9934 4.1928 4.1928 4.5706 4.5706 4.6062 4.6062 4.9634 4.9634 5.1679 5.1679 6.0185 6.0185 6.2894 6.2894 6.9214 6.9214 6.9496 6.9496 8.2210 8.2210 8.2533 8.2533 8.5180 8.5180 8.5465 8.5465 8.6627 8.6627 8.6641 8.6641 9.6630 9.6630 9.7010 9.7010 10.8862 10.8862 11.1244 11.1244 12.0185 12.0185 k = 0.4024 0.3662-0.0000 ( 4630 PWs) bands (ev): -2.5557 -2.5557 -2.5535 -2.5535 -1.4672 -1.4672 -1.4637 -1.4637 3.9670 3.9670 4.1687 4.1687 4.6340 4.6340 4.6382 4.6382 4.9683 4.9683 5.1499 5.1499 6.0790 6.0790 6.3291 6.3291 6.9618 6.9618 6.9743 6.9743 8.2192 8.2192 8.2509 8.2509 8.5202 8.5202 8.5468 8.5468 8.6671 8.6671 8.6675 8.6675 9.6596 9.6596 9.6966 9.6966 10.8781 10.8781 11.1142 11.1142 12.0170 12.0170 k = 0.3902 0.3662-0.0000 ( 4634 PWs) bands (ev): -2.5854 -2.5854 -2.5833 -2.5833 -1.4622 -1.4622 -1.4587 -1.4587 3.9402 3.9402 4.1407 4.1407 4.6681 4.6681 4.7001 4.7001 4.9879 4.9879 5.1374 5.1374 6.1387 6.1387 6.3669 6.3669 7.0026 7.0026 7.0075 7.0075 8.2172 8.2172 8.2481 8.2481 8.5226 8.5226 8.5471 8.5471 8.6721 8.6721 8.6730 8.6730 9.6559 9.6559 9.6919 9.6919 10.8697 10.8697 11.1037 11.1037 12.0148 12.0148 k = 0.3780 0.3662-0.0000 ( 4630 PWs) bands (ev): -2.6169 -2.6169 -2.6148 -2.6148 -1.4577 -1.4577 -1.4543 -1.4543 3.9124 3.9124 4.1083 4.1083 4.6975 4.6975 4.7687 4.7687 5.0211 5.0211 5.1316 5.1316 6.1967 6.1967 6.4023 6.4023 7.0345 7.0345 7.0577 7.0577 8.2153 8.2153 8.2452 8.2452 8.5251 8.5251 8.5474 8.5474 8.6780 8.6780 8.6807 8.6807 9.6519 9.6519 9.6869 9.6869 10.8611 10.8611 11.0934 11.0934 12.0121 12.0121 k = 0.3659 0.3662-0.0000 ( 4622 PWs) bands (ev): -2.6497 -2.6497 -2.6478 -2.6478 -1.4540 -1.4540 -1.4506 -1.4506 3.8834 3.8834 4.0714 4.0714 4.7288 4.7288 4.8395 4.8395 5.0657 5.0657 5.1331 5.1331 6.2523 6.2523 6.4351 6.4351 7.0698 7.0698 7.1114 7.1114 8.2135 8.2135 8.2421 8.2421 8.5278 8.5278 8.5479 8.5479 8.6855 8.6855 8.6904 8.6904 9.6478 9.6478 9.6817 9.6817 10.8526 10.8526 11.0836 11.0836 12.0086 12.0086 k = 0.3537 0.3662-0.0000 ( 4618 PWs) bands (ev): -2.6838 -2.6838 -2.6819 -2.6819 -1.4511 -1.4511 -1.4477 -1.4477 3.8529 3.8529 4.0305 4.0305 4.7641 4.7641 4.9123 4.9123 5.1189 5.1189 5.1428 5.1428 6.3049 6.3049 6.4653 6.4653 7.1082 7.1082 7.1675 7.1675 8.2121 8.2121 8.2390 8.2390 8.5306 8.5306 8.5487 8.5487 8.6947 8.6947 8.7024 8.7024 9.6436 9.6436 9.6764 9.6764 10.8445 10.8445 11.0747 11.0747 12.0042 12.0042 k = 0.3415 0.3662-0.0000 ( 4622 PWs) bands (ev): -2.7186 -2.7186 -2.7168 -2.7168 -1.4491 -1.4491 -1.4458 -1.4458 3.8208 3.8208 3.9865 3.9865 4.8048 4.8048 4.9863 4.9863 5.1610 5.1610 5.1785 5.1785 6.3544 6.3544 6.4935 6.4935 7.1492 7.1492 7.2244 7.2244 8.2111 8.2111 8.2360 8.2360 8.5336 8.5336 8.5498 8.5498 8.7058 8.7058 8.7170 8.7170 9.6393 9.6393 9.6711 9.6711 10.8370 10.8370 11.0669 11.0669 11.9989 11.9989 k = 0.3293 0.3662-0.0000 ( 4622 PWs) bands (ev): -2.7540 -2.7540 -2.7523 -2.7523 -1.4481 -1.4481 -1.4448 -1.4448 3.7870 3.7870 3.9401 3.9401 4.8513 4.8513 5.0609 5.0609 5.1885 5.1885 5.2430 5.2430 6.4006 6.4006 6.5197 6.5197 7.1922 7.1922 7.2807 7.2807 8.2108 8.2108 8.2334 8.2334 8.5368 8.5368 8.5513 8.5513 8.7190 8.7190 8.7345 8.7345 9.6353 9.6353 9.6661 9.6661 10.8303 10.8303 11.0606 11.0606 11.9926 11.9926 k = 0.3171 0.3662-0.0000 ( 4620 PWs) bands (ev): -2.7896 -2.7896 -2.7881 -2.7881 -1.4481 -1.4481 -1.4449 -1.4449 3.7518 3.7518 3.8922 3.8922 4.9037 4.9037 5.1341 5.1341 5.2267 5.2267 5.3112 5.3112 6.4434 6.4434 6.5444 6.5444 7.2364 7.2364 7.3351 7.3351 8.2117 8.2117 8.2312 8.2312 8.5401 8.5401 8.5533 8.5533 8.7343 8.7343 8.7552 8.7552 9.6317 9.6317 9.6614 9.6614 10.8248 10.8248 11.0560 11.0560 11.9853 11.9853 k = 0.3049 0.3662-0.0000 ( 4620 PWs) bands (ev): -2.8253 -2.8253 -2.8239 -2.8239 -1.4491 -1.4491 -1.4459 -1.4459 3.7154 3.7154 3.8434 3.8434 4.9616 4.9616 5.2026 5.2026 5.2783 5.2783 5.3821 5.3821 6.4831 6.4831 6.5677 6.5677 7.2807 7.2807 7.3860 7.3860 8.2139 8.2139 8.2299 8.2299 8.5438 8.5438 8.5557 8.5557 8.7519 8.7519 8.7794 8.7794 9.6287 9.6287 9.6574 9.6574 10.8206 10.8206 11.0534 11.0534 11.9767 11.9767 k = 0.2927 0.3662-0.0000 ( 4624 PWs) bands (ev): -2.8609 -2.8609 -2.8595 -2.8595 -1.4511 -1.4511 -1.4480 -1.4480 3.6780 3.6780 3.7943 3.7943 5.0248 5.0248 5.2642 5.2642 5.3448 5.3448 5.4552 5.4552 6.5198 6.5198 6.5900 6.5900 7.3243 7.3243 7.4324 7.4324 8.2176 8.2176 8.2297 8.2297 8.5476 8.5476 8.5587 8.5587 8.7717 8.7717 8.8073 8.8073 9.6265 9.6265 9.6543 9.6543 10.8180 10.8180 11.0531 11.0531 11.9670 11.9670 k = 0.2805 0.3662-0.0000 ( 4620 PWs) bands (ev): -2.8961 -2.8961 -2.8948 -2.8948 -1.4540 -1.4540 -1.4510 -1.4510 3.6401 3.6401 3.7454 3.7454 5.0926 5.0926 5.3225 5.3225 5.4216 5.4216 5.5300 5.5300 6.5538 6.5538 6.6113 6.6113 7.3661 7.3661 7.4732 7.4732 8.2232 8.2232 8.2309 8.2309 8.5517 8.5517 8.5620 8.5620 8.7937 8.7937 8.8389 8.8389 9.6258 9.6258 9.6524 9.6524 10.8170 10.8170 11.0552 11.0552 11.9560 11.9560 k = 0.2683 0.3662-0.0000 ( 4612 PWs) bands (ev): -2.9308 -2.9308 -2.9296 -2.9296 -1.4577 -1.4577 -1.4548 -1.4548 3.6020 3.6020 3.6972 3.6972 5.1643 5.1643 5.3814 5.3814 5.5042 5.5042 5.6062 5.6062 6.5852 6.5852 6.6318 6.6318 7.4052 7.4052 7.5078 7.5078 8.2306 8.2306 8.2337 8.2337 8.5560 8.5560 8.5657 8.5657 8.8181 8.8181 8.8741 8.8741 9.6270 9.6270 9.6521 9.6521 10.8179 10.8179 11.0598 11.0598 11.9436 11.9436 k = 0.2561 0.3662-0.0000 ( 4612 PWs) bands (ev): -2.9649 -2.9649 -2.9637 -2.9637 -1.4623 -1.4623 -1.4594 -1.4594 3.5639 3.5639 3.6498 3.6498 5.2395 5.2395 5.4424 5.4424 5.5901 5.5901 5.6835 5.6835 6.6144 6.6144 6.6515 6.6515 7.4408 7.4408 7.5358 7.5358 8.2382 8.2382 8.2397 8.2397 8.5604 8.5604 8.5696 8.5696 8.8445 8.8445 8.9123 8.9123 9.6308 9.6308 9.6540 9.6540 10.8206 10.8206 11.0670 11.0670 11.9299 11.9299 k = 0.2439 0.3662-0.0000 ( 4612 PWs) bands (ev): -2.9981 -2.9981 -2.9970 -2.9970 -1.4674 -1.4674 -1.4647 -1.4647 3.5262 3.5262 3.6037 3.6037 5.3173 5.3173 5.5054 5.5054 5.6782 5.6782 5.7615 5.7615 6.6415 6.6415 6.6706 6.6706 7.4722 7.4722 7.5573 7.5573 8.2445 8.2445 8.2502 8.2502 8.5647 8.5647 8.5735 8.5735 8.8728 8.8728 8.9528 8.9528 9.6383 9.6383 9.6585 9.6585 10.8253 10.8253 11.0769 11.0769 11.9146 11.9146 k = 0.2317 0.3662-0.0000 ( 4600 PWs) bands (ev): -3.0304 -3.0304 -3.0294 -3.0294 -1.4732 -1.4732 -1.4705 -1.4705 3.4891 3.4891 3.5590 3.5590 5.3971 5.3971 5.5701 5.5701 5.7682 5.7682 5.8403 5.8403 6.6667 6.6667 6.6891 6.6891 7.4991 7.4991 7.5727 7.5727 8.2526 8.2526 8.2618 8.2618 8.5690 8.5690 8.5775 8.5775 8.9025 8.9025 8.9940 8.9940 9.6507 9.6507 9.6664 9.6664 10.8318 10.8318 11.0895 11.0895 11.8979 11.8979 k = 0.2195 0.3662-0.0000 ( 4604 PWs) bands (ev): -3.0616 -3.0616 -3.0607 -3.0607 -1.4794 -1.4794 -1.4769 -1.4769 3.4529 3.4529 3.5159 3.5159 5.4779 5.4779 5.6358 5.6358 5.8595 5.8595 5.9196 5.9196 6.6902 6.6902 6.7071 6.7071 7.5215 7.5215 7.5828 7.5828 8.2621 8.2621 8.2741 8.2741 8.5730 8.5730 8.5812 8.5812 8.9330 8.9330 9.0342 9.0342 9.6693 9.6693 9.6784 9.6784 10.8401 10.8401 11.1045 11.1045 11.8795 11.8795 k = 0.2073 0.3662-0.0000 ( 4598 PWs) bands (ev): -3.0916 -3.0916 -3.0908 -3.0908 -1.4860 -1.4860 -1.4836 -1.4836 3.4178 3.4178 3.4746 3.4746 5.5591 5.5591 5.7019 5.7019 5.9516 5.9516 5.9992 5.9992 6.7121 6.7121 6.7245 6.7245 7.5395 7.5395 7.5885 7.5885 8.2729 8.2729 8.2867 8.2867 8.5767 8.5767 8.5847 8.5847 8.9635 8.9635 9.0715 9.0715 9.6954 9.6954 9.6959 9.6959 10.8498 10.8498 11.1219 11.1219 11.8596 11.8596 k = 0.1951 0.3662-0.0000 ( 4592 PWs) bands (ev): -3.1204 -3.1204 -3.1196 -3.1196 -1.4928 -1.4928 -1.4905 -1.4905 3.3840 3.3840 3.4351 3.4351 5.6399 5.6399 5.7677 5.7677 6.0440 6.0440 6.0790 6.0790 6.7326 6.7326 6.7416 6.7416 7.5537 7.5537 7.5906 7.5906 8.2846 8.2846 8.2994 8.2994 8.5797 8.5797 8.5877 8.5877 8.9931 8.9931 9.1039 9.1039 9.7180 9.7180 9.7315 9.7315 10.8608 10.8608 11.1414 11.1414 11.8380 11.8380 k = 0.1829 0.3662-0.0000 ( 4604 PWs) bands (ev): -3.1478 -3.1478 -3.1471 -3.1471 -1.4998 -1.4998 -1.4977 -1.4977 3.3517 3.3517 3.3975 3.3975 5.7194 5.7194 5.8328 5.8328 6.1358 6.1358 6.1584 6.1584 6.7519 6.7519 6.7585 6.7585 7.5647 7.5647 7.5900 7.5900 8.2968 8.2968 8.3118 8.3118 8.5819 8.5819 8.5901 8.5901 9.0209 9.0209 9.1302 9.1302 9.7471 9.7471 9.7769 9.7769 10.8725 10.8725 11.1627 11.1627 11.8148 11.8148 k = 0.1707 0.3662-0.0000 ( 4598 PWs) bands (ev): -3.1738 -3.1738 -3.1732 -3.1732 -1.5069 -1.5069 -1.5048 -1.5048 3.3209 3.3209 3.3621 3.3621 5.7969 5.7969 5.8967 5.8967 6.2259 6.2259 6.2371 6.2371 6.7701 6.7701 6.7755 6.7755 7.5733 7.5733 7.5880 7.5880 8.3091 8.3091 8.3238 8.3238 8.5833 8.5833 8.5920 8.5920 9.0460 9.0460 9.1499 9.1499 9.7830 9.7830 9.8319 9.8319 10.8845 10.8845 11.1853 11.1853 11.7902 11.7902 k = 0.1585 0.3662-0.0000 ( 4598 PWs) bands (ev): -3.1983 -3.1983 -3.1977 -3.1977 -1.5139 -1.5139 -1.5120 -1.5120 3.2919 3.2919 3.3287 3.3287 5.8718 5.8718 5.9590 5.9590 6.3129 6.3129 6.3141 6.3141 6.7875 6.7875 6.7928 6.7928 7.5805 7.5805 7.5853 7.5853 8.3214 8.3214 8.3354 8.3354 8.5838 8.5838 8.5932 8.5932 9.0679 9.0679 9.1633 9.1633 9.8257 9.8257 9.8954 9.8954 10.8964 10.8964 11.2088 11.2088 11.7642 11.7642 k = 0.1463 0.3662-0.0000 ( 4596 PWs) bands (ev): -3.2212 -3.2212 -3.2207 -3.2207 -1.5208 -1.5208 -1.5190 -1.5190 3.2647 3.2647 3.2976 3.2976 5.9437 5.9437 6.0193 6.0193 6.3884 6.3884 6.3950 6.3950 6.8044 6.8044 6.8112 6.8112 7.5832 7.5832 7.5872 7.5872 8.3333 8.3333 8.3463 8.3463 8.5832 8.5832 8.5936 8.5936 9.0863 9.0863 9.1711 9.1711 9.8751 9.8751 9.9660 9.9660 10.9073 10.9073 11.2325 11.2325 11.7373 11.7373 k = 0.1341 0.3662-0.0000 ( 4600 PWs) bands (ev): -3.2425 -3.2425 -3.2420 -3.2420 -1.5274 -1.5274 -1.5258 -1.5258 3.2395 3.2395 3.2687 3.2687 6.0120 6.0120 6.0774 6.0774 6.4584 6.4584 6.4699 6.4699 6.8213 6.8213 6.8314 6.8314 7.5827 7.5827 7.5944 7.5944 8.3447 8.3447 8.3567 8.3567 8.5815 8.5815 8.5932 8.5932 9.1010 9.1010 9.1743 9.1743 9.9302 9.9302 10.0419 10.0419 10.9167 10.9167 11.2557 11.2557 11.7097 11.7097 k = 0.1220 0.3662-0.0000 ( 4596 PWs) bands (ev): -3.2621 -3.2621 -3.2616 -3.2616 -1.5338 -1.5338 -1.5322 -1.5322 3.2163 3.2163 3.2421 3.2421 6.0766 6.0766 6.1329 6.1329 6.5222 6.5222 6.5352 6.5352 6.8388 6.8388 6.8543 6.8543 7.5849 7.5849 7.6033 7.6033 8.3556 8.3556 8.3663 8.3663 8.5788 8.5788 8.5920 8.5920 9.1124 9.1124 9.1740 9.1740 9.9901 9.9901 10.1212 10.1212 10.9239 10.9239 11.2775 11.2775 11.6821 11.6821 k = 0.1098 0.3662-0.0000 ( 4592 PWs) bands (ev): -3.2800 -3.2800 -3.2796 -3.2796 -1.5397 -1.5397 -1.5383 -1.5383 3.1952 3.1952 3.2179 3.2179 6.1372 6.1372 6.1856 6.1856 6.5778 6.5778 6.5887 6.5887 6.8576 6.8576 6.8801 6.8801 7.5910 7.5910 7.6145 7.6145 8.3658 8.3658 8.3753 8.3753 8.5751 8.5751 8.5899 8.5899 9.1207 9.1207 9.1711 9.1711 10.0535 10.0535 10.2020 10.2020 10.9284 10.9284 11.2965 11.2965 11.6551 11.6551 k = 0.0976 0.3662-0.0000 ( 4592 PWs) bands (ev): -3.2960 -3.2960 -3.2957 -3.2957 -1.5452 -1.5452 -1.5440 -1.5440 3.1763 3.1763 3.1960 3.1960 6.1936 6.1936 6.2352 6.2352 6.6235 6.6235 6.6295 6.6295 6.8780 6.8780 6.9081 6.9081 7.6018 7.6018 7.6287 7.6287 8.3752 8.3752 8.3834 8.3834 8.5706 8.5706 8.5868 8.5868 9.1264 9.1264 9.1664 9.1664 10.1191 10.1191 10.2826 10.2826 10.9298 10.9298 11.3109 11.3109 11.6296 11.6296 k = 0.0854 0.3662-0.0000 ( 4590 PWs) bands (ev): -3.3103 -3.3103 -3.3100 -3.3100 -1.5502 -1.5502 -1.5491 -1.5491 3.1596 3.1596 3.1765 3.1765 6.2456 6.2456 6.2812 6.2812 6.6582 6.6582 6.6586 6.6586 6.9000 6.9000 6.9361 6.9361 7.6178 7.6178 7.6461 7.6461 8.3839 8.3839 8.3908 8.3908 8.5655 8.5655 8.5829 8.5829 9.1300 9.1300 9.1605 9.1605 10.1855 10.1855 10.3609 10.3609 10.9283 10.9283 11.3176 11.3176 11.5976 11.5976 k = 0.0732 0.3662-0.0000 ( 4594 PWs) bands (ev): -3.3227 -3.3227 -3.3225 -3.3225 -1.5546 -1.5546 -1.5537 -1.5537 3.1452 3.1452 3.1594 3.1594 6.2930 6.2930 6.3234 6.3234 6.6781 6.6781 6.6826 6.6826 6.9224 6.9224 6.9613 6.9613 7.6386 7.6386 7.6664 7.6664 8.3917 8.3917 8.3973 8.3973 8.5601 8.5601 8.5782 8.5782 9.1317 9.1317 9.1541 9.1541 10.2514 10.2514 10.4346 10.4346 10.9247 10.9247 11.3123 11.3123 11.5584 11.5584 k = 0.0610 0.3662-0.0000 ( 4594 PWs) bands (ev): -3.3333 -3.3333 -3.3331 -3.3331 -1.5584 -1.5584 -1.5577 -1.5577 3.1331 3.1331 3.1448 3.1448 6.3354 6.3354 6.3610 6.3610 6.6903 6.6903 6.6981 6.6981 6.9438 6.9438 6.9817 6.9817 7.6629 7.6629 7.6884 7.6884 8.3986 8.3986 8.4029 8.4029 8.5548 8.5548 8.5727 8.5727 9.1321 9.1321 9.1478 9.1478 10.3156 10.3156 10.5004 10.5004 10.9214 10.9214 11.2911 11.2911 11.5319 11.5319 k = 0.0488 0.3662-0.0000 ( 4598 PWs) bands (ev): -3.3420 -3.3420 -3.3418 -3.3418 -1.5616 -1.5616 -1.5610 -1.5610 3.1234 3.1234 3.1326 3.1326 6.3724 6.3724 6.3934 6.3934 6.6975 6.6975 6.7066 6.7066 6.9627 6.9627 6.9965 6.9965 7.6887 7.6887 7.7104 7.7104 8.4045 8.4045 8.4076 8.4076 8.5500 8.5500 8.5667 8.5667 9.1316 9.1316 9.1420 9.1420 10.3770 10.3770 10.5537 10.5537 10.9222 10.9222 11.2541 11.2541 11.5187 11.5187 k = 0.0366 0.3662-0.0000 ( 4590 PWs) bands (ev): -3.3487 -3.3487 -3.3486 -3.3486 -1.5641 -1.5641 -1.5636 -1.5636 3.1160 3.1160 3.1229 3.1229 6.4034 6.4034 6.4197 6.4197 6.7015 6.7015 6.7102 6.7102 6.9786 6.9786 7.0057 7.0057 7.7133 7.7133 7.7303 7.7303 8.4093 8.4093 8.4113 8.4113 8.5463 8.5463 8.5605 8.5605 9.1307 9.1307 9.1370 9.1370 10.4343 10.4343 10.5889 10.5889 10.9330 10.9330 11.2063 11.2063 11.5146 11.5146 k = 0.0244 0.3662-0.0000 ( 4590 PWs) bands (ev): -3.3535 -3.3535 -3.3535 -3.3535 -1.5658 -1.5658 -1.5655 -1.5655 3.1111 3.1111 3.1156 3.1156 6.4275 6.4275 6.4388 6.4388 6.7036 6.7036 6.7105 6.7105 6.9912 6.9912 7.0100 7.0100 7.7340 7.7340 7.7456 7.7456 8.4129 8.4129 8.4140 8.4140 8.5441 8.5441 8.5545 8.5545 9.1298 9.1298 9.1332 9.1332 10.4864 10.4864 10.6019 10.6019 10.9579 10.9579 11.1530 11.1530 11.5153 11.5153 k = 0.0122 0.3662-0.0000 ( 4590 PWs) bands (ev): -3.3564 -3.3564 -3.3564 -3.3564 -1.5669 -1.5669 -1.5667 -1.5667 3.1085 3.1085 3.1108 3.1108 6.4437 6.4437 6.4495 6.4495 6.7052 6.7052 6.7090 6.7090 7.0006 7.0006 7.0102 7.0102 7.7487 7.7487 7.7545 7.7545 8.4151 8.4151 8.4156 8.4156 8.5439 8.5439 8.5494 8.5494 9.1292 9.1292 9.1307 9.1307 10.5319 10.5319 10.5936 10.5936 10.9966 10.9966 11.0981 11.0981 11.5183 11.5183 k = 0.0000 0.3662-0.0000 ( 4586 PWs) bands (ev): -3.3574 -3.3574 -3.3574 -3.3574 -1.5672 -1.5672 -1.5672 -1.5672 3.1084 3.1084 3.1084 3.1084 6.4512 6.4512 6.4512 6.4512 6.7070 6.7070 6.7070 6.7070 7.0070 7.0070 7.0070 7.0070 7.7557 7.7557 7.7557 7.7557 8.4160 8.4160 8.4160 8.4160 8.5457 8.5457 8.5457 8.5457 9.1294 9.1294 9.1294 9.1294 10.5687 10.5687 10.5687 10.5687 11.0449 11.0449 11.0449 11.0449 11.5225 11.5225 k = 0.0000 0.3662-0.0000 ( 4586 PWs) bands (ev): -3.3574 -3.3574 -3.3574 -3.3574 -1.5672 -1.5672 -1.5672 -1.5672 3.1084 3.1084 3.1084 3.1084 6.4512 6.4512 6.4512 6.4512 6.7070 6.7070 6.7070 6.7070 7.0070 7.0070 7.0070 7.0070 7.7557 7.7557 7.7557 7.7557 8.4160 8.4160 8.4160 8.4160 8.5457 8.5457 8.5457 8.5457 9.1294 9.1294 9.1294 9.1294 10.5687 10.5687 10.5687 10.5687 11.0449 11.0449 11.0449 11.0449 11.5225 11.5225 k = 0.0000 0.3540-0.0000 ( 4584 PWs) bands (ev): -3.4316 -3.4316 -3.2814 -3.2814 -1.5744 -1.5744 -1.5607 -1.5607 3.1028 3.1028 3.1195 3.1195 6.4300 6.4300 6.4705 6.4705 6.6209 6.6209 6.7622 6.7622 6.9275 6.9275 7.1134 7.1134 7.7197 7.7197 7.7909 7.7909 8.4136 8.4136 8.4176 8.4176 8.5392 8.5392 8.5520 8.5520 9.0709 9.0709 9.1895 9.1895 10.5567 10.5567 10.5757 10.5757 11.0140 11.0140 11.0754 11.0754 11.4780 11.4780 k = 0.0000 0.3417-0.0000 ( 4584 PWs) bands (ev): -3.5039 -3.5039 -3.2037 -3.2037 -1.5823 -1.5823 -1.5551 -1.5551 3.1026 3.1026 3.1360 3.1360 6.3990 6.3990 6.4873 6.4873 6.5156 6.5156 6.7922 6.7922 6.8793 6.8793 7.2331 7.2331 7.6830 7.6830 7.8253 7.8253 8.4103 8.4103 8.4183 8.4183 8.5322 8.5322 8.5580 8.5580 9.0143 9.0143 9.2506 9.2506 10.5404 10.5404 10.5771 10.5771 10.9838 10.9838 11.1051 11.1051 11.4386 11.4386 k = 0.0000 0.3295-0.0000 ( 4596 PWs) bands (ev): -3.5742 -3.5742 -3.1244 -3.1244 -1.5908 -1.5908 -1.5504 -1.5504 3.1076 3.1076 3.1581 3.1581 6.3163 6.3163 6.4362 6.4362 6.5100 6.5100 6.7944 6.7944 6.8640 6.8640 7.3549 7.3549 7.6454 7.6454 7.8590 7.8590 8.4061 8.4061 8.4183 8.4183 8.5246 8.5246 8.5639 8.5639 8.9601 8.9601 9.3119 9.3119 10.5205 10.5205 10.5724 10.5724 10.9560 10.9560 11.1336 11.1336 11.4046 11.4046 k = 0.0000 0.3173-0.0000 ( 4594 PWs) bands (ev): -3.6423 -3.6423 -3.0438 -3.0438 -1.5996 -1.5996 -1.5467 -1.5467 3.1176 3.1176 3.1859 3.1859 6.1765 6.1765 6.4076 6.4076 6.5288 6.5288 6.7749 6.7749 6.8720 6.8720 7.4724 7.4724 7.6071 7.6071 7.8919 7.8919 8.4010 8.4010 8.4176 8.4176 8.5163 8.5163 8.5695 8.5695 8.9085 8.9085 9.3726 9.3726 10.4973 10.4973 10.5619 10.5619 10.9327 10.9327 11.1611 11.1611 11.3761 11.3761 k = 0.0000 0.3051-0.0000 ( 4602 PWs) bands (ev): -3.7083 -3.7083 -2.9621 -2.9621 -1.6085 -1.6085 -1.5439 -1.5439 3.1324 3.1324 3.2193 3.2193 6.0204 6.0204 6.3896 6.3896 6.5476 6.5476 6.7508 6.7508 6.8844 6.8844 7.5681 7.5681 7.5816 7.5816 7.9240 7.9240 8.3948 8.3948 8.4162 8.4162 8.5071 8.5071 8.5746 8.5746 8.8598 8.8598 9.4313 9.4313 10.4704 10.4704 10.5474 10.5474 10.9161 10.9161 11.1873 11.1873 11.3526 11.3526 k = 0.0000 0.2929-0.0000 ( 4596 PWs) bands (ev): -3.7721 -3.7721 -2.8796 -2.8796 -1.6174 -1.6174 -1.5421 -1.5421 3.1519 3.1519 3.2582 3.2582 5.8584 5.8584 6.3748 6.3748 6.5659 6.5659 6.7274 6.7274 6.8956 6.8956 7.5288 7.5288 7.6798 7.6798 7.9553 7.9553 8.3874 8.3874 8.4141 8.4141 8.4970 8.4970 8.5790 8.5790 8.8143 8.8143 9.4863 9.4863 10.4387 10.4387 10.5329 10.5329 10.9078 10.9078 11.2123 11.2123 11.3340 11.3340 k = 0.0000 0.2807-0.0000 ( 4594 PWs) bands (ev): -3.8335 -3.8335 -2.7965 -2.7965 -1.6258 -1.6258 -1.5412 -1.5412 3.1758 3.1758 3.3027 3.3027 5.6936 5.6936 6.3619 6.3619 6.5824 6.5824 6.7061 6.7061 6.9044 6.9044 7.4890 7.4890 7.7656 7.7656 7.9850 7.9850 8.3782 8.3782 8.4117 8.4117 8.4859 8.4859 8.5820 8.5820 8.7724 8.7724 9.5358 9.5358 10.4003 10.4003 10.5239 10.5239 10.9089 10.9089 11.2356 11.2356 11.3201 11.3201 k = 0.0000 0.2685-0.0000 ( 4598 PWs) bands (ev): -3.8926 -3.8926 -2.7133 -2.7133 -1.6335 -1.6335 -1.5411 -1.5411 3.2038 3.2038 3.3527 3.3527 5.5278 5.5278 6.3502 6.3502 6.5943 6.5943 6.6897 6.6897 6.9106 6.9106 7.4489 7.4489 7.8382 7.8382 8.0118 8.0118 8.3670 8.3670 8.4088 8.4088 8.4745 8.4745 8.5827 8.5827 8.7348 8.7348 9.5774 9.5774 10.3554 10.3554 10.5249 10.5249 10.9199 10.9199 11.2563 11.2563 11.3115 11.3115 k = 0.0000 0.2563-0.0000 ( 4586 PWs) bands (ev): -3.9493 -3.9493 -2.6305 -2.6305 -1.6399 -1.6399 -1.5419 -1.5419 3.2356 3.2356 3.4082 3.4082 5.3619 5.3619 6.3398 6.3398 6.5970 6.5970 6.6831 6.6831 6.9141 6.9141 7.4088 7.4088 7.8982 7.8982 8.0335 8.0335 8.3533 8.3533 8.4053 8.4053 8.4636 8.4636 8.5797 8.5797 8.7028 8.7028 9.6094 9.6094 10.3052 10.3052 10.5388 10.5388 10.9407 10.9407 11.2713 11.2713 11.3112 11.3112 k = 0.0000 0.2441-0.0000 ( 4590 PWs) bands (ev): -4.0036 -4.0036 -2.5489 -2.5489 -1.6443 -1.6443 -1.5435 -1.5435 3.2708 3.2708 3.4689 3.4689 5.1969 5.1969 6.3304 6.3304 6.5875 6.5875 6.6887 6.6887 6.9146 6.9146 7.3686 7.3686 7.9472 7.9472 8.0466 8.0466 8.3365 8.3365 8.4009 8.4009 8.4547 8.4547 8.5711 8.5711 8.6782 8.6782 9.6306 9.6306 10.2516 10.2516 10.5666 10.5666 10.9712 10.9712 11.2780 11.2780 11.3219 11.3219 k = 0.0000 0.2319-0.0000 ( 4594 PWs) bands (ev): -4.0554 -4.0554 -2.4693 -2.4693 -1.6460 -1.6460 -1.5458 -1.5458 3.3089 3.3089 3.5348 3.5348 5.0337 5.0337 6.3220 6.3220 6.5698 6.5698 6.7024 6.7024 6.9121 6.9121 7.3288 7.3288 7.9864 7.9864 8.0480 8.0480 8.3174 8.3174 8.3955 8.3955 8.4490 8.4490 8.5559 8.5559 8.6619 8.6619 9.6408 9.6408 10.1964 10.1964 10.6075 10.6075 11.0106 11.0106 11.2820 11.2820 11.3391 11.3391 k = 0.0000 0.2197-0.0000 ( 4582 PWs) bands (ev): -4.1047 -4.1047 -2.3929 -2.3929 -1.6440 -1.6440 -1.5486 -1.5486 3.3495 3.3495 3.6059 3.6059 4.8729 4.8729 6.3144 6.3144 6.5485 6.5485 6.7198 6.7198 6.9067 6.9067 7.2893 7.2893 8.0084 8.0084 8.0437 8.0437 8.2973 8.2973 8.3893 8.3893 8.4465 8.4465 8.5358 8.5358 8.6529 8.6529 9.6411 9.6411 10.1411 10.1411 10.6596 10.6596 11.0569 11.0569 11.2897 11.2897 11.3584 11.3584 k = 0.0000 0.2075-0.0000 ( 4580 PWs) bands (ev): -4.1514 -4.1514 -2.3212 -2.3212 -1.6368 -1.6368 -1.5520 -1.5520 3.3918 3.3918 3.6818 3.6818 4.7155 4.7155 6.3077 6.3077 6.5254 6.5254 6.7385 6.7385 6.8984 6.8984 7.2503 7.2503 7.9843 7.9843 8.0622 8.0622 8.2777 8.2777 8.3830 8.3830 8.4462 8.4462 8.5138 8.5138 8.6487 8.6487 9.6330 9.6330 10.0865 10.0865 10.7192 10.7192 11.1064 11.1064 11.3059 11.3059 11.3793 11.3793 k = 0.0000 0.1953-0.0000 ( 4576 PWs) bands (ev): -4.1956 -4.1956 -2.2558 -2.2558 -1.6230 -1.6230 -1.5558 -1.5558 3.4350 3.4350 3.7624 3.7624 4.5626 4.5626 6.3016 6.3016 6.5014 6.5014 6.7575 6.7575 6.8873 6.8873 7.2119 7.2119 7.9320 7.9320 8.0872 8.0872 8.2591 8.2591 8.3769 8.3769 8.4457 8.4457 8.4932 8.4932 8.6475 8.6475 9.6184 9.6184 10.0338 10.0338 10.7825 10.7825 11.1532 11.1532 11.3343 11.3343 11.4042 11.4042 k = 0.0000 0.1831-0.0000 ( 4580 PWs) bands (ev): -4.2373 -4.2373 -2.1987 -2.1987 -1.6011 -1.6011 -1.5599 -1.5599 3.4776 3.4776 3.8477 3.8477 4.4156 4.4156 6.2959 6.2959 6.4769 6.4769 6.7761 6.7761 6.8739 6.8739 7.1742 7.1742 7.8627 7.8627 8.1107 8.1107 8.2413 8.2413 8.3713 8.3713 8.4408 8.4408 8.4785 8.4785 8.6483 8.6483 9.5989 9.5989 9.9835 9.9835 10.8446 10.8446 11.1942 11.1942 11.3700 11.3700 11.4424 11.4424 k = 0.0000 0.1709-0.0000 ( 4584 PWs) bands (ev): -4.2763 -4.2763 -2.1512 -2.1512 -1.5698 -1.5698 -1.5642 -1.5642 3.5174 3.5174 3.9373 3.9373 4.2771 4.2771 6.2902 6.2902 6.4520 6.4520 6.7933 6.7933 6.8591 6.8591 7.1371 7.1371 7.7807 7.7807 8.1315 8.1315 8.2244 8.2244 8.3662 8.3662 8.4283 8.4283 8.4730 8.4730 8.6507 8.6507 9.5758 9.5758 9.9361 9.9361 10.9006 10.9006 11.2329 11.2329 11.3984 11.3984 11.5060 11.5060 k = 0.0000 0.1587-0.0000 ( 4582 PWs) bands (ev): -4.3127 -4.3127 -2.1140 -2.1140 -1.5689 -1.5689 -1.5287 -1.5287 3.5505 3.5505 4.0309 4.0309 4.1512 4.1512 6.2840 6.2840 6.4272 6.4272 6.8057 6.8057 6.8464 6.8464 7.1006 7.1006 7.6894 7.6894 8.1478 8.1478 8.2098 8.2098 8.3614 8.3614 8.4121 8.4121 8.4728 8.4728 8.6545 8.6545 9.5502 9.5502 9.8921 9.8921 10.9457 10.9457 11.2766 11.2766 11.4188 11.4188 11.5902 11.5902 k = 0.0000 0.1465-0.0000 ( 4588 PWs) bands (ev): -4.3465 -4.3465 -2.0865 -2.0865 -1.5735 -1.5735 -1.4791 -1.4791 3.5689 3.5689 4.0447 4.0447 4.1297 4.1297 6.2762 6.2762 6.4028 6.4028 6.8032 6.8032 6.8460 6.8460 7.0646 7.0646 7.5920 7.5920 8.1543 8.1543 8.2033 8.2033 8.3565 8.3565 8.3960 8.3960 8.4742 8.4742 8.6593 8.6593 9.5232 9.5232 9.8516 9.8516 10.9777 10.9777 11.3289 11.3289 11.4363 11.4363 11.6852 11.6852 k = 0.0000 0.1343-0.0000 ( 4587 PWs) bands (ev): -4.3776 -4.3776 -2.0674 -2.0674 -1.5780 -1.5780 -1.4228 -1.4228 3.5600 3.5600 3.9728 3.9728 4.2309 4.2309 6.2649 6.2649 6.3801 6.3801 6.7870 6.7870 6.8572 6.8572 7.0288 7.0288 7.4915 7.4915 8.1463 8.1463 8.2096 8.2096 8.3508 8.3508 8.3823 8.3823 8.4758 8.4758 8.6651 8.6651 9.4953 9.4953 9.8148 9.8148 10.9977 10.9977 11.3864 11.3864 11.4560 11.4560 11.7853 11.7853 k = 0.0000 0.1221-0.0000 ( 4595 PWs) bands (ev): -4.4061 -4.4061 -2.0548 -2.0548 -1.5825 -1.5825 -1.3621 -1.3621 3.5143 3.5143 3.9434 3.9434 4.3359 4.3359 6.2476 6.2476 6.3606 6.3606 6.7666 6.7666 6.8706 6.8706 6.9929 6.9929 7.3912 7.3912 8.1310 8.1310 8.2220 8.2220 8.3433 8.3433 8.3723 8.3723 8.4772 8.4772 8.6715 8.6715 9.4673 9.4673 9.7817 9.7817 11.0086 11.0086 11.4319 11.4319 11.4925 11.4925 11.8870 11.8870 k = 0.0000 0.1098-0.0000 ( 4599 PWs) bands (ev): -4.4319 -4.4319 -2.0470 -2.0470 -1.5867 -1.5867 -1.2995 -1.2995 3.4401 3.4401 3.9487 3.9487 4.4440 4.4440 6.2215 6.2215 6.3460 6.3460 6.7452 6.7452 6.8831 6.8831 6.9564 6.9564 7.2946 7.2946 8.1138 8.1138 8.2350 8.2350 8.3339 8.3339 8.3663 8.3663 8.4783 8.4783 8.6784 8.6784 9.4398 9.4398 9.7523 9.7523 11.0136 11.0136 11.4531 11.4531 11.5552 11.5552 11.9873 11.9873 k = 0.0000 0.0976-0.0000 ( 4585 PWs) bands (ev): -4.4549 -4.4549 -2.0425 -2.0425 -1.5907 -1.5907 -1.2372 -1.2372 3.3538 3.3538 3.9727 3.9727 4.5550 4.5550 6.1854 6.1854 6.3360 6.3360 6.7241 6.7241 6.8925 6.8925 6.9197 6.9197 7.2061 7.2061 8.0969 8.0969 8.2473 8.2473 8.3240 8.3240 8.3633 8.3633 8.4793 8.4793 8.6856 8.6856 9.4133 9.4133 9.7266 9.7266 11.0148 11.0148 11.4651 11.4651 11.6259 11.6259 12.0067 12.0067 k = 0.0000 0.0854-0.0000 ( 4581 PWs) bands (ev): -4.4753 -4.4753 -2.0404 -2.0404 -1.5944 -1.5944 -1.1772 -1.1772 3.2664 3.2664 4.0043 4.0043 4.6685 4.6685 6.1389 6.1389 6.3294 6.3294 6.7038 6.7038 6.8745 6.8745 6.9050 6.9050 7.1305 7.1305 8.0809 8.0809 8.2580 8.2580 8.3144 8.3144 8.3621 8.3621 8.4799 8.4799 8.6927 8.6927 9.3883 9.3883 9.7044 9.7044 11.0138 11.0138 11.4740 11.4740 11.6960 11.6960 12.0044 12.0044 k = 0.0000 0.0732-0.0000 ( 4581 PWs) bands (ev): -4.4930 -4.4930 -2.0397 -2.0397 -1.5978 -1.5978 -1.1211 -1.1211 3.1839 3.1839 4.0378 4.0378 4.7838 4.7838 6.0820 6.0820 6.3245 6.3245 6.6846 6.6846 6.8330 6.8330 6.9076 6.9076 7.0720 7.0720 8.0663 8.0663 8.2669 8.2669 8.3059 8.3059 8.3622 8.3622 8.4803 8.4803 8.6996 8.6996 9.3653 9.3653 9.6855 9.6855 11.0117 11.0117 11.4811 11.4811 11.7618 11.7618 12.0036 12.0036 k = 0.0000 0.0610-0.0000 ( 4581 PWs) bands (ev): -4.5080 -4.5080 -2.0399 -2.0399 -1.6007 -1.6007 -1.0706 -1.0706 3.1099 3.1099 4.0698 4.0698 4.9004 4.9004 6.0144 6.0144 6.3205 6.3205 6.6669 6.6669 6.7908 6.7908 6.9054 6.9054 7.0328 7.0328 8.0535 8.0535 8.2739 8.2739 8.2988 8.2988 8.3632 8.3632 8.4807 8.4807 8.7059 8.7059 9.3449 9.3449 9.6697 9.6697 11.0089 11.0089 11.4868 11.4868 11.8201 11.8201 12.0048 12.0048 k = 0.0000 0.0488-0.0000 ( 4583 PWs) bands (ev): -4.5203 -4.5203 -2.0405 -2.0405 -1.6031 -1.6031 -1.0271 -1.0271 3.0467 3.0467 4.0984 4.0984 5.0174 5.0174 5.9366 5.9366 6.3168 6.3168 6.6506 6.6506 6.7529 6.7529 6.8975 6.8975 7.0112 7.0112 8.0428 8.0428 8.2785 8.2785 8.2936 8.2936 8.3646 8.3646 8.4810 8.4810 8.7115 8.7115 9.3274 9.3274 9.6571 9.6571 11.0062 11.0062 11.4913 11.4913 11.8680 11.8680 12.0091 12.0091 k = 0.0000 0.0366-0.0000 ( 4587 PWs) bands (ev): -4.5298 -4.5298 -2.0413 -2.0413 -1.6050 -1.6050 -0.9918 -0.9918 2.9958 2.9958 4.1221 4.1221 5.1332 5.1332 5.8500 5.8500 6.3134 6.3134 6.6361 6.6361 6.7232 6.7232 6.8868 6.8868 7.0015 7.0015 8.0343 8.0343 8.2801 8.2801 8.2911 8.2911 8.3663 8.3663 8.4811 8.4811 8.7161 8.7161 9.3133 9.3133 9.6474 9.6474 11.0037 11.0037 11.4948 11.4948 11.9027 11.9027 12.0174 12.0174 k = 0.0000 0.0244-0.0000 ( 4577 PWs) bands (ev): -4.5367 -4.5367 -2.0419 -2.0419 -1.6064 -1.6064 -0.9658 -0.9658 2.9585 2.9585 4.1397 4.1397 5.2447 5.2447 5.7585 5.7585 6.3105 6.3105 6.6242 6.6242 6.7029 6.7029 6.8770 6.8770 6.9979 6.9979 8.0282 8.0282 8.2793 8.2793 8.2912 8.2912 8.3678 8.3678 8.4813 8.4813 8.7196 8.7196 9.3029 9.3029 9.6406 9.6406 11.0018 11.0018 11.4972 11.4972 11.9238 11.9238 12.0284 12.0284 k = 0.0000 0.0122-0.0000 ( 4577 PWs) bands (ev): -4.5407 -4.5407 -2.0424 -2.0424 -1.6072 -1.6072 -0.9499 -0.9499 2.9358 2.9358 4.1506 4.1506 5.3427 5.3427 5.6720 5.6720 6.3085 6.3085 6.6163 6.6163 6.6915 6.6915 6.8704 6.8704 6.9968 6.9968 8.0244 8.0244 8.2781 8.2781 8.2919 8.2919 8.3688 8.3688 8.4814 8.4814 8.7217 8.7217 9.2965 9.2965 9.6365 9.6365 11.0006 11.0006 11.4987 11.4987 11.9340 11.9340 12.0379 12.0379 k = 0.0000 0.0000 0.0000 ( 4571 PWs) bands (ev): -4.5421 -4.5421 -2.0426 -2.0426 -1.6075 -1.6075 -0.9445 -0.9445 2.9282 2.9282 4.1543 4.1543 5.3914 5.3914 5.6272 5.6272 6.3078 6.3078 6.6136 6.6136 6.6879 6.6879 6.8681 6.8681 6.9966 6.9966 8.0232 8.0232 8.2776 8.2776 8.2922 8.2922 8.3691 8.3691 8.4815 8.4815 8.7224 8.7224 9.2944 9.2944 9.6351 9.6351 11.0002 11.0002 11.4992 11.4992 11.9370 11.9370 12.0417 12.0417 k = 0.0000 0.0000 0.0000 ( 4571 PWs) bands (ev): -4.5421 -4.5421 -2.0426 -2.0426 -1.6075 -1.6075 -0.9445 -0.9445 2.9282 2.9282 4.1543 4.1543 5.3914 5.3914 5.6272 5.6272 6.3078 6.3078 6.6136 6.6136 6.6879 6.6879 6.8681 6.8681 6.9966 6.9966 8.0232 8.0232 8.2776 8.2776 8.2922 8.2922 8.3691 8.3691 8.4815 8.4815 8.7224 8.7224 9.2944 9.2944 9.6351 9.6351 11.0002 11.0002 11.4992 11.4992 11.9370 11.9370 12.0417 12.0417 k = 0.0000 0.0000 0.0123 ( 4569 PWs) bands (ev): -4.5408 -4.5408 -2.0560 -2.0560 -1.5959 -1.5959 -0.9442 -0.9442 2.9299 2.9299 4.1559 4.1559 5.3933 5.3933 5.6211 5.6211 6.3039 6.3039 6.5915 6.5915 6.7033 6.7033 6.8792 6.8792 7.0026 7.0026 8.0243 8.0243 8.2758 8.2758 8.2920 8.2920 8.3691 8.3691 8.4811 8.4811 8.7218 8.7218 9.2937 9.2937 9.6354 9.6354 10.9937 10.9937 11.5003 11.5003 11.9300 11.9300 12.0365 12.0365 k = 0.0000 0.0000 0.0247 ( 4567 PWs) bands (ev): -4.5368 -4.5368 -2.0925 -2.0925 -1.5648 -1.5648 -0.9431 -0.9431 2.9349 2.9349 4.1604 4.1604 5.3988 5.3988 5.6033 5.6033 6.2922 6.2922 6.5549 6.5549 6.7225 6.7225 6.9060 6.9060 7.0246 7.0246 8.0275 8.0275 8.2703 8.2703 8.2916 8.2916 8.3689 8.3689 8.4801 8.4801 8.7198 8.7198 9.2915 9.2915 9.6359 9.6359 10.9744 10.9744 11.5035 11.5035 11.9068 11.9068 12.0250 12.0250 k = 0.0000 0.0000 0.0370 ( 4567 PWs) bands (ev): -4.5302 -4.5302 -2.1450 -2.1450 -1.5212 -1.5212 -0.9414 -0.9414 2.9433 2.9433 4.1681 4.1681 5.4064 5.4064 5.5757 5.5757 6.2731 6.2731 6.5236 6.5236 6.7331 6.7331 6.9324 6.9324 7.0704 7.0704 8.0328 8.0328 8.2608 8.2608 8.2908 8.2908 8.3692 8.3692 8.4784 8.4784 8.7166 8.7166 9.2878 9.2878 9.6369 9.6369 10.9431 10.9431 11.5076 11.5076 11.8648 11.8648 12.0142 12.0142 k = 0.0000 0.0000 0.0493 ( 4573 PWs) bands (ev): -4.5210 -4.5210 -2.2075 -2.2075 -1.4713 -1.4713 -0.9390 -0.9390 2.9549 2.9549 4.1791 4.1791 5.4113 5.4113 5.5434 5.5434 6.2481 6.2481 6.5017 6.5017 6.7376 6.7376 6.9509 6.9509 7.1379 7.1379 8.0400 8.0400 8.2472 8.2472 8.2888 8.2888 8.3702 8.3702 8.4761 8.4761 8.7121 8.7121 9.2825 9.2825 9.6382 9.6382 10.9009 10.9009 11.5107 11.5107 11.8079 11.8079 12.0067 12.0067 k = 0.0000 0.0000 0.0616 ( 4587 PWs) bands (ev): -4.5091 -4.5091 -2.2762 -2.2762 -1.4187 -1.4187 -0.9359 -0.9359 2.9695 2.9695 4.1936 4.1936 5.4004 5.4004 5.5210 5.5210 6.2200 6.2200 6.4884 6.4884 6.7386 6.7386 6.9652 6.9652 7.2173 7.2173 8.0491 8.0491 8.2297 8.2297 8.2851 8.2851 8.3727 8.3727 8.4735 8.4735 8.7065 8.7065 9.2757 9.2757 9.6401 9.6401 10.8492 10.8492 11.5095 11.5095 11.7451 11.7451 12.0016 12.0016 k = 0.0000 0.0000 0.0740 ( 4607 PWs) bands (ev): -4.4946 -4.4946 -2.3488 -2.3488 -1.3656 -1.3656 -0.9322 -0.9322 2.9871 2.9871 4.2117 4.2117 5.3597 5.3597 5.5236 5.5236 6.1911 6.1911 6.4815 6.4815 6.7376 6.7376 6.9784 6.9784 7.3014 7.3014 8.0598 8.0598 8.2086 8.2086 8.2787 8.2787 8.3772 8.3772 8.4705 8.4705 8.6997 8.6997 9.2673 9.2673 9.6424 9.6424 10.7894 10.7894 11.4978 11.4978 11.6879 11.6879 11.9976 11.9976 k = 0.0000 0.0000 0.0863 ( 4605 PWs) bands (ev): -4.4775 -4.4775 -2.4241 -2.4241 -1.3134 -1.3134 -0.9280 -0.9280 3.0075 3.0075 4.2335 4.2335 5.2979 5.2979 5.5446 5.5446 6.1627 6.1627 6.4790 6.4790 6.7354 6.7354 6.9921 6.9921 7.3858 7.3858 8.0719 8.0719 8.1845 8.1845 8.2692 8.2692 8.3841 8.3841 8.4677 8.4677 8.6922 8.6922 9.2572 9.2572 9.6455 9.6455 10.7233 10.7233 11.4668 11.4668 11.6492 11.6492 11.9942 11.9942 k = 0.0000 0.0000 0.0986 ( 4602 PWs) bands (ev): -4.4578 -4.4578 -2.5010 -2.5010 -1.2630 -1.2630 -0.9232 -0.9232 3.0304 3.0304 4.2591 4.2591 5.2258 5.2258 5.5749 5.5749 6.1355 6.1355 6.4796 6.4796 6.7322 6.7322 7.0069 7.0069 7.4673 7.4673 8.0844 8.0844 8.1586 8.1586 8.2563 8.2563 8.3932 8.3932 8.4649 8.4649 8.6838 8.6838 9.2453 9.2453 9.6492 9.6492 10.6530 10.6530 11.4160 11.4160 11.6321 11.6321 11.9910 11.9910 k = 0.0000 0.0000 0.1109 ( 4618 PWs) bands (ev): -4.4355 -4.4355 -2.5790 -2.5790 -1.2148 -1.2148 -0.9180 -0.9180 3.0558 3.0558 4.2882 4.2882 5.1485 5.1485 5.6108 5.6108 6.1091 6.1091 6.4823 6.4823 6.7282 6.7282 7.0230 7.0230 7.5432 7.5432 8.0929 8.0929 8.1354 8.1354 8.2400 8.2400 8.4043 8.4043 8.4625 8.4625 8.6746 8.6746 9.2318 9.2318 9.6537 9.6537 10.5809 10.5809 11.3554 11.3554 11.6281 11.6281 11.9878 11.9878 k = 0.0000 0.0000 0.1233 ( 4610 PWs) bands (ev): -4.4107 -4.4107 -2.6575 -2.6575 -1.1692 -1.1692 -0.9123 -0.9123 3.0836 3.0836 4.3203 4.3203 5.0695 5.0695 5.6507 5.6507 6.0836 6.0836 6.4866 6.4866 6.7236 6.7236 7.0406 7.0406 7.6099 7.6099 8.0811 8.0811 8.1319 8.1319 8.2215 8.2215 8.4175 8.4175 8.4608 8.4608 8.6651 8.6651 9.2166 9.2166 9.6592 9.6592 10.5094 10.5094 11.2937 11.2937 11.6300 11.6300 11.9844 11.9844 k = 0.0000 0.0000 0.1356 ( 4610 PWs) bands (ev): -4.3832 -4.3832 -2.7363 -2.7363 -1.1266 -1.1266 -0.9064 -0.9064 3.1135 3.1135 4.3540 4.3540 4.9916 4.9916 5.6937 5.6937 6.0588 6.0588 6.4921 6.4921 6.7184 6.7184 7.0598 7.0598 7.6631 7.6631 8.0529 8.0529 8.1448 8.1448 8.2028 8.2028 8.4319 8.4319 8.4601 8.4601 8.6552 8.6552 9.1996 9.1996 9.6657 9.6657 10.4408 10.4408 11.2350 11.2350 11.6342 11.6342 11.9808 11.9808 k = 0.0000 0.0000 0.1479 ( 4602 PWs) bands (ev): -4.3533 -4.3533 -2.8150 -2.8150 -1.0871 -1.0871 -0.9001 -0.9001 3.1455 3.1455 4.3869 4.3869 4.9185 4.9185 5.7384 5.7384 6.0350 6.0350 6.4986 6.4986 6.7127 6.7127 7.0805 7.0805 7.6972 7.6972 8.0219 8.0219 8.1609 8.1609 8.1880 8.1880 8.4453 8.4453 8.4627 8.4627 8.6451 8.6451 9.1809 9.1809 9.6735 9.6735 10.3772 10.3772 11.1814 11.1814 11.6387 11.6387 11.9770 11.9770 k = 0.0000 0.0000 0.1603 ( 4608 PWs) bands (ev): -4.3208 -4.3208 -2.8933 -2.8933 -1.0507 -1.0507 -0.8937 -0.8937 3.1796 3.1796 4.4139 4.4139 4.8561 4.8561 5.7825 5.7825 6.0137 6.0137 6.5058 6.5058 6.7064 6.7064 7.1026 7.1026 7.7064 7.7064 7.9905 7.9905 8.1731 8.1731 8.1862 8.1862 8.4513 8.4513 8.4747 8.4747 8.6350 8.6350 9.1603 9.1603 9.6826 9.6826 10.3200 10.3200 11.1342 11.1342 11.6426 11.6426 11.9728 11.9728 k = 0.0000 0.0000 0.1726 ( 4604 PWs) bands (ev): -4.2858 -4.2858 -2.9710 -2.9710 -1.0176 -1.0176 -0.8872 -0.8872 3.2158 3.2158 4.4263 4.4263 4.8134 4.8134 5.8209 5.8209 5.9997 5.9997 6.5136 6.5136 6.6997 6.6997 7.1263 7.1263 7.6887 7.6887 7.9579 7.9579 8.1805 8.1805 8.2014 8.2014 8.4526 8.4526 8.4933 8.4933 8.6250 8.6250 9.1381 9.1381 9.6931 9.6931 10.2700 10.2700 11.0946 11.0946 11.6449 11.6449 11.9684 11.9684 k = 0.0000 0.0000 0.1849 ( 4600 PWs) bands (ev): -4.2483 -4.2483 -3.0480 -3.0480 -0.9878 -0.9878 -0.8808 -0.8808 3.2540 3.2540 4.4139 4.4139 4.8008 4.8008 5.8423 5.8423 6.0038 6.0038 6.5220 6.5220 6.6926 6.6926 7.1511 7.1511 7.6473 7.6473 7.9224 7.9224 8.1958 8.1958 8.2194 8.2194 8.4531 8.4531 8.5142 8.5142 8.6154 8.6154 9.1140 9.1140 9.7053 9.7053 10.2270 10.2270 11.0636 11.0636 11.6444 11.6444 11.9637 11.9637 k = 0.0000 0.0000 0.1972 ( 4602 PWs) bands (ev): -4.2084 -4.2084 -3.1241 -3.1241 -0.9612 -0.9612 -0.8745 -0.8745 3.2944 3.2944 4.3751 4.3751 4.8197 4.8197 5.8376 5.8376 6.0345 6.0345 6.5308 6.5308 6.6851 6.6851 7.1768 7.1768 7.5880 7.5880 7.8836 7.8836 8.2171 8.2171 8.2375 8.2375 8.4539 8.4539 8.5359 8.5359 8.6069 8.6069 9.0883 9.0883 9.7193 9.7193 10.1901 10.1901 11.0422 11.0422 11.6400 11.6400 11.9586 11.9586 k = 0.0000 0.0000 0.2096 ( 4602 PWs) bands (ev): -4.1661 -4.1661 -3.1991 -3.1991 -0.9377 -0.9377 -0.8684 -0.8684 3.3369 3.3369 4.3180 4.3180 4.8617 4.8617 5.8139 5.8139 6.0847 6.0847 6.5401 6.5401 6.6771 6.6771 7.2026 7.2026 7.5167 7.5167 7.8425 7.8425 8.2401 8.2401 8.2554 8.2554 8.4550 8.4550 8.5555 8.5555 8.6018 8.6018 9.0611 9.0611 9.7351 9.7351 10.1579 10.1579 11.0313 11.0313 11.6301 11.6301 11.9530 11.9530 k = 0.0000 0.0000 0.2219 ( 4610 PWs) bands (ev): -4.1214 -4.1214 -3.2728 -3.2728 -0.9172 -0.9172 -0.8628 -0.8628 3.3818 3.3818 4.2515 4.2515 4.9178 4.9178 5.7798 5.7798 6.1452 6.1452 6.5498 6.5498 6.6688 6.6688 7.2255 7.2255 7.4397 7.4397 7.8001 7.8001 8.2613 8.2613 8.2733 8.2733 8.4567 8.4567 8.5651 8.5651 8.6082 8.6082 9.0324 9.0324 9.7528 9.7528 10.1287 10.1287 11.0314 11.0314 11.6128 11.6128 11.9466 11.9466 k = 0.0000 0.0000 0.2342 ( 4604 PWs) bands (ev): -4.0743 -4.0743 -3.3452 -3.3452 -0.8997 -0.8997 -0.8577 -0.8577 3.4290 3.4290 4.1807 4.1807 4.9820 4.9820 5.7393 5.7393 6.2121 6.2121 6.5601 6.5601 6.6601 6.6601 7.2342 7.2342 7.3715 7.3715 7.7570 7.7570 8.2790 8.2790 8.2911 8.2911 8.4594 8.4594 8.5618 8.5618 8.6289 8.6289 9.0025 9.0025 9.7726 9.7726 10.1009 10.1009 11.0429 11.0429 11.5871 11.5871 11.9384 11.9384 k = 0.0000 0.0000 0.2466 ( 4604 PWs) bands (ev): -4.0250 -4.0250 -3.4161 -3.4161 -0.8850 -0.8850 -0.8533 -0.8533 3.4787 3.4787 4.1086 4.1086 5.0509 5.0509 5.6938 5.6938 6.2836 6.2836 6.5710 6.5710 6.6511 6.6511 7.1948 7.1948 7.3482 7.3482 7.7139 7.7139 8.2935 8.2935 8.3071 8.3071 8.4632 8.4632 8.5537 8.5537 8.6553 8.6553 8.9716 8.9716 9.7943 9.7943 10.0734 10.0734 11.0652 11.0652 11.5523 11.5523 11.9273 11.9273 k = 0.0000 0.0000 0.2589 ( 4604 PWs) bands (ev): -3.9734 -3.9734 -3.4855 -3.4855 -0.8730 -0.8730 -0.8498 -0.8498 3.5308 3.5308 4.0367 4.0367 5.1223 5.1223 5.6438 5.6438 6.3585 6.3585 6.5831 6.5831 6.6416 6.6416 7.1132 7.1132 7.3659 7.3659 7.6709 7.6709 8.3057 8.3057 8.3198 8.3198 8.4686 8.4686 8.5441 8.5441 8.6841 8.6841 8.9399 8.9399 9.8179 9.8179 10.0454 10.0454 11.0973 11.0973 11.5095 11.5095 11.9178 11.9178 k = 0.0000 0.0000 0.2712 ( 4606 PWs) bands (ev): -3.9195 -3.9195 -3.5531 -3.5531 -0.8633 -0.8633 -0.8473 -0.8473 3.5855 3.5855 3.9659 3.9659 5.1945 5.1945 5.5897 5.5897 6.4349 6.4349 6.5976 6.5976 6.6319 6.6319 7.0197 7.0197 7.3959 7.3959 7.6285 7.6285 8.3158 8.3158 8.3287 8.3287 8.4754 8.4754 8.5340 8.5340 8.7143 8.7143 8.9077 8.9077 9.8433 9.8433 10.0167 10.0167 11.1379 11.1379 11.4602 11.4602 11.9124 11.9124 k = 0.0000 0.0000 0.2835 ( 4602 PWs) bands (ev): -3.8635 -3.8635 -3.6191 -3.6191 -0.8560 -0.8560 -0.8459 -0.8459 3.6428 3.6428 3.8968 3.8968 5.2662 5.2662 5.5316 5.5316 6.5075 6.5075 6.6141 6.6141 6.6272 6.6272 6.9240 6.9240 7.4304 7.4304 7.5867 7.5867 8.3241 8.3241 8.3338 8.3338 8.4836 8.4836 8.5237 8.5237 8.7455 8.7455 8.8751 8.8751 9.8703 9.8703 9.9873 9.9873 11.1854 11.1854 11.4064 11.4064 11.9106 11.9106 k = 0.0000 0.0000 0.2959 ( 4606 PWs) bands (ev): -3.8054 -3.8054 -3.6831 -3.6831 -0.8508 -0.8508 -0.8459 -0.8459 3.7026 3.7026 3.8298 3.8298 5.3365 5.3365 5.4697 5.4697 6.5614 6.5614 6.6060 6.6060 6.6678 6.6678 6.8300 6.8300 7.4673 7.4673 7.5458 7.5458 8.3302 8.3302 8.3355 8.3355 8.4928 8.4928 8.5132 8.5132 8.7774 8.7774 8.8424 8.8424 9.8986 9.8986 9.9575 9.9575 11.2377 11.2377 11.3501 11.3501 11.9115 11.9115 k = 0.0000 0.0000 0.3082 ( 4590 PWs) bands (ev): -3.7453 -3.7453 -3.7453 -3.7453 -0.8475 -0.8475 -0.8475 -0.8475 3.7650 3.7650 3.7650 3.7650 5.4046 5.4046 5.4046 5.4046 6.5897 6.5897 6.5897 6.5897 6.7416 6.7416 6.7416 6.7416 7.5059 7.5059 7.5059 7.5059 8.3342 8.3342 8.3342 8.3342 8.5028 8.5028 8.5028 8.5028 8.8098 8.8098 8.8098 8.8098 9.9278 9.9278 9.9278 9.9278 11.2933 11.2933 11.2933 11.2933 11.9143 11.9143 k = 0.0000 0.0000 0.3082 ( 4590 PWs) bands (ev): -3.7453 -3.7453 -3.7453 -3.7453 -0.8475 -0.8475 -0.8475 -0.8475 3.7650 3.7650 3.7650 3.7650 5.4046 5.4046 5.4046 5.4046 6.5897 6.5897 6.5897 6.5897 6.7416 6.7416 6.7416 6.7416 7.5059 7.5059 7.5059 7.5059 8.3342 8.3342 8.3342 8.3342 8.5028 8.5028 8.5028 8.5028 8.8098 8.8098 8.8098 8.8098 9.9278 9.9278 9.9278 9.9278 11.2933 11.2933 11.2933 11.2933 11.9143 11.9143 k = 0.0122-0.0000 0.3082 ( 4606 PWs) bands (ev): -3.7443 -3.7443 -3.7442 -3.7442 -0.8476 -0.8476 -0.8473 -0.8473 3.7649 3.7649 3.7672 3.7672 5.4045 5.4045 5.4051 5.4051 6.5841 6.5841 6.5843 6.5843 6.7357 6.7357 6.7442 6.7442 7.4934 7.4934 7.5154 7.5154 8.3324 8.3324 8.3342 8.3342 8.4982 8.4982 8.5078 8.5078 8.8094 8.8094 8.8143 8.8143 9.9261 9.9261 9.9382 9.9382 11.2751 11.2751 11.3078 11.3078 11.8910 11.8910 k = 0.0244-0.0000 0.3082 ( 4598 PWs) bands (ev): -3.7412 -3.7412 -3.7411 -3.7411 -0.8475 -0.8475 -0.8470 -0.8470 3.7669 3.7669 3.7716 3.7716 5.4049 5.4049 5.4062 5.4062 6.5674 6.5674 6.5678 6.5678 6.7269 6.7269 6.7430 6.7430 7.4789 7.4789 7.5215 7.5215 8.3289 8.3289 8.3323 8.3323 8.4946 8.4946 8.5129 8.5129 8.8133 8.8133 8.8229 8.8229 9.9331 9.9331 9.9571 9.9571 11.2528 11.2528 11.3189 11.3189 11.8526 11.8526 k = 0.0366-0.0000 0.3082 ( 4606 PWs) bands (ev): -3.7361 -3.7361 -3.7360 -3.7360 -0.8473 -0.8473 -0.8466 -0.8466 3.7710 3.7710 3.7781 3.7781 5.4057 5.4057 5.4076 5.4076 6.5398 6.5398 6.5404 6.5404 6.7159 6.7159 6.7384 6.7384 7.4637 7.4637 7.5246 7.5246 8.3237 8.3237 8.3280 8.3280 8.4923 8.4923 8.5176 8.5176 8.8207 8.8207 8.8347 8.8347 9.9486 9.9486 9.9838 9.9838 11.2259 11.2259 11.3268 11.3268 11.7999 11.7999 k = 0.0488-0.0000 0.3082 ( 4606 PWs) bands (ev): -3.7290 -3.7290 -3.7289 -3.7289 -0.8471 -0.8471 -0.8461 -0.8461 3.7771 3.7771 3.7868 3.7868 5.4067 5.4067 5.4091 5.4091 6.5018 6.5018 6.5022 6.5022 6.7030 6.7030 6.7305 6.7305 7.4490 7.4490 7.5251 7.5251 8.3168 8.3168 8.3214 8.3214 8.4912 8.4912 8.5217 8.5217 8.8308 8.8308 8.8487 8.8487 9.9723 9.9723 10.0178 10.0178 11.1939 11.1939 11.3316 11.3316 11.7348 11.7348 k = 0.0610-0.0000 0.3082 ( 4606 PWs) bands (ev): -3.7199 -3.7199 -3.7197 -3.7197 -0.8467 -0.8467 -0.8455 -0.8455 3.7851 3.7851 3.7975 3.7975 5.4075 5.4075 5.4104 5.4104 6.4539 6.4539 6.4545 6.4545 6.6887 6.6887 6.7200 6.7200 7.4360 7.4360 7.5241 7.5241 8.3083 8.3083 8.3125 8.3125 8.4912 8.4912 8.5252 8.5252 8.8426 8.8426 8.8638 8.8638 10.0034 10.0034 10.0580 10.0580 11.1564 11.1564 11.3330 11.3330 11.6596 11.6596 k = 0.0732-0.0000 0.3082 ( 4608 PWs) bands (ev): -3.7087 -3.7087 -3.7086 -3.7086 -0.8464 -0.8464 -0.8449 -0.8449 3.7951 3.7951 3.8104 3.8104 5.4077 5.4077 5.4108 5.4108 6.3969 6.3969 6.3995 6.3995 6.6729 6.6729 6.7073 6.7073 7.4252 7.4252 7.5222 7.5222 8.2980 8.2980 8.3015 8.3015 8.4918 8.4918 8.5277 8.5277 8.8551 8.8551 8.8790 8.8790 10.0412 10.0412 10.1032 10.1032 11.1132 11.1132 11.3303 11.3303 11.5772 11.5772 k = 0.0854-0.0000 0.3082 ( 4604 PWs) bands (ev): -3.6956 -3.6956 -3.6954 -3.6954 -0.8460 -0.8460 -0.8443 -0.8443 3.8069 3.8069 3.8254 3.8254 5.4066 5.4066 5.4098 5.4098 6.3331 6.3331 6.3386 6.3386 6.6558 6.6558 6.6929 6.6929 7.4167 7.4167 7.5201 7.5201 8.2862 8.2862 8.2887 8.2887 8.4925 8.4925 8.5294 8.5294 8.8675 8.8675 8.8936 8.8936 10.0843 10.0843 10.1518 10.1518 11.0644 11.0644 11.3210 11.3210 11.4926 11.4926 k = 0.0976-0.0000 0.3082 ( 4602 PWs) bands (ev): -3.6806 -3.6806 -3.6803 -3.6803 -0.8457 -0.8457 -0.8438 -0.8438 3.8204 3.8204 3.8423 3.8423 5.4034 5.4034 5.4061 5.4061 6.2650 6.2650 6.2741 6.2741 6.6376 6.6376 6.6769 6.6769 7.4104 7.4104 7.5180 7.5180 8.2729 8.2729 8.2745 8.2745 8.4929 8.4929 8.5300 8.5300 8.8793 8.8793 8.9069 8.9069 10.1315 10.1315 10.2021 10.2021 11.0110 11.0110 11.2960 11.2960 11.4168 11.4168 k = 0.1098-0.0000 0.3082 ( 4598 PWs) bands (ev): -3.6636 -3.6636 -3.6633 -3.6633 -0.8456 -0.8456 -0.8433 -0.8433 3.8355 3.8355 3.8612 3.8612 5.3969 5.3969 5.3985 5.3985 6.1958 6.1958 6.2086 6.2086 6.6185 6.6185 6.6598 6.6598 7.4059 7.4059 7.5163 7.5163 8.2583 8.2583 8.2589 8.2589 8.4925 8.4925 8.5294 8.5294 8.8899 8.8899 8.9184 8.9184 10.1812 10.1812 10.2516 10.2516 10.9547 10.9547 11.2379 11.2379 11.3696 11.3696 k = 0.1220-0.0000 0.3082 ( 4594 PWs) bands (ev): -3.6448 -3.6448 -3.6445 -3.6445 -0.8456 -0.8456 -0.8431 -0.8431 3.8520 3.8520 3.8821 3.8821 5.3849 5.3849 5.3855 5.3855 6.1287 6.1287 6.1449 6.1449 6.5985 6.5985 6.6417 6.6417 7.4027 7.4027 7.5147 7.5147 8.2424 8.2424 8.2425 8.2425 8.4910 8.4910 8.5275 8.5275 8.8992 8.8992 8.9279 8.9279 10.2314 10.2314 10.2970 10.2970 10.8986 10.8986 11.1537 11.1537 11.3461 11.3461 k = 0.1341-0.0000 0.3082 ( 4602 PWs) bands (ev): -3.6241 -3.6241 -3.6238 -3.6238 -0.8458 -0.8458 -0.8431 -0.8431 3.8697 3.8697 3.9047 3.9047 5.3632 5.3632 5.3677 5.3677 6.0673 6.0673 6.0861 6.0861 6.5780 6.5780 6.6227 6.6227 7.4000 7.4000 7.5131 7.5131 8.2251 8.2251 8.2256 8.2256 8.4882 8.4882 8.5241 8.5241 8.9070 8.9070 8.9354 8.9354 10.2797 10.2797 10.3332 10.3332 10.8480 10.8480 11.0631 11.0631 11.3296 11.3296 k = 0.1463-0.0000 0.3082 ( 4608 PWs) bands (ev): -3.6017 -3.6017 -3.6013 -3.6013 -0.8464 -0.8464 -0.8435 -0.8435 3.8885 3.8885 3.9290 3.9290 5.3313 5.3313 5.3418 5.3418 6.0150 6.0150 6.0348 6.0348 6.5570 6.5570 6.6032 6.6032 7.3977 7.3977 7.5114 7.5114 8.2069 8.2069 8.2077 8.2077 8.4840 8.4840 8.5192 8.5192 8.9133 8.9133 8.9406 8.9406 10.3224 10.3224 10.3530 10.3530 10.8104 10.8104 10.9757 10.9757 11.3142 11.3142 k = 0.1585-0.0000 0.3082 ( 4606 PWs) bands (ev): -3.5775 -3.5775 -3.5770 -3.5770 -0.8474 -0.8474 -0.8442 -0.8442 3.9078 3.9078 3.9548 3.9548 5.2878 5.2878 5.3066 5.3066 5.9743 5.9743 5.9935 5.9935 6.5357 6.5357 6.5832 6.5832 7.3952 7.3952 7.5093 7.5093 8.1881 8.1881 8.1890 8.1890 8.4783 8.4783 8.5128 8.5128 8.9179 8.9179 8.9438 8.9438 10.3492 10.3492 10.3542 10.3542 10.7937 10.7937 10.8990 10.8990 11.2983 11.2983 k = 0.1707-0.0000 0.3082 ( 4608 PWs) bands (ev): -3.5516 -3.5516 -3.5511 -3.5511 -0.8488 -0.8488 -0.8454 -0.8454 3.9275 3.9275 3.9820 3.9820 5.2328 5.2328 5.2622 5.2622 5.9462 5.9462 5.9632 5.9632 6.5145 6.5145 6.5629 6.5629 7.3920 7.3920 7.5066 7.5066 8.1686 8.1686 8.1694 8.1694 8.4710 8.4710 8.5048 8.5048 8.9209 8.9209 8.9447 8.9447 10.3196 10.3196 10.3672 10.3672 10.8004 10.8004 10.8414 10.8414 11.2815 11.2815 k = 0.1829-0.0000 0.3082 ( 4610 PWs) bands (ev): -3.5241 -3.5241 -3.5237 -3.5237 -0.8508 -0.8508 -0.8472 -0.8472 3.9470 3.9470 4.0102 4.0102 5.1679 5.1679 5.2099 5.2099 5.9298 5.9298 5.9437 5.9437 6.4935 6.4935 6.5424 6.5424 7.3879 7.3879 7.5029 7.5029 8.1486 8.1486 8.1491 8.1491 8.4621 8.4621 8.4952 8.4952 8.9222 8.9222 8.9435 8.9435 10.2701 10.2701 10.3535 10.3535 10.8109 10.8109 10.8249 10.8249 11.2640 11.2640 k = 0.1951-0.0000 0.3082 ( 4614 PWs) bands (ev): -3.4951 -3.4951 -3.4946 -3.4946 -0.8535 -0.8535 -0.8497 -0.8497 3.9656 3.9656 4.0391 4.0391 5.0958 5.0958 5.1520 5.1520 5.9236 5.9236 5.9336 5.9336 6.4729 6.4729 6.5219 6.5219 7.3826 7.3826 7.4981 7.4981 8.1280 8.1280 8.1281 8.1281 8.4515 8.4515 8.4840 8.4840 8.9217 8.9217 8.9400 8.9400 10.2084 10.2084 10.3127 10.3127 10.8077 10.8077 10.8592 10.8592 11.2467 11.2467 k = 0.2073-0.0000 0.3082 ( 4618 PWs) bands (ev): -3.4647 -3.4647 -3.4642 -3.4642 -0.8568 -0.8568 -0.8528 -0.8528 3.9826 3.9826 4.0681 4.0681 5.0194 5.0194 5.0914 5.0914 5.9253 5.9253 5.9313 5.9313 6.4531 6.4531 6.5015 6.5015 7.3758 7.3758 7.4919 7.4919 8.1065 8.1065 8.1067 8.1067 8.4394 8.4394 8.4713 8.4713 8.9196 8.9196 8.9346 8.9346 10.1408 10.1408 10.2528 10.2528 10.8232 10.8232 10.8964 10.8964 11.2306 11.2306 k = 0.2195-0.0000 0.3082 ( 4622 PWs) bands (ev): -3.4329 -3.4329 -3.4323 -3.4323 -0.8610 -0.8610 -0.8568 -0.8568 3.9970 3.9970 4.0966 4.0966 4.9417 4.9417 5.0310 5.0310 5.9330 5.9330 5.9348 5.9348 6.4343 6.4343 6.4814 6.4814 7.3673 7.3673 7.4841 7.4841 8.0843 8.0843 8.0849 8.0849 8.4257 8.4257 8.4571 8.4571 8.9156 8.9156 8.9270 8.9270 10.0712 10.0712 10.1830 10.1830 10.8466 10.8466 10.9303 10.9303 11.2177 11.2177 k = 0.2317-0.0000 0.3082 ( 4614 PWs) bands (ev): -3.3999 -3.3999 -3.3993 -3.3993 -0.8661 -0.8661 -0.8617 -0.8617 4.0076 4.0076 4.1233 4.1233 4.8656 4.8656 4.9737 4.9737 5.9425 5.9425 5.9451 5.9451 6.4170 6.4170 6.4617 6.4617 7.3571 7.3571 7.4747 7.4747 8.0617 8.0617 8.0626 8.0626 8.4105 8.4105 8.4416 8.4416 8.9098 8.9098 8.9174 8.9174 10.0019 10.0019 10.1098 10.1098 10.8697 10.8697 10.9548 10.9548 11.2107 11.2107 k = 0.2439-0.0000 0.3082 ( 4624 PWs) bands (ev): -3.3657 -3.3657 -3.3651 -3.3651 -0.8721 -0.8721 -0.8675 -0.8675 4.0133 4.0133 4.1465 4.1465 4.7943 4.7943 4.9222 4.9222 5.9528 5.9528 5.9603 5.9603 6.4014 6.4014 6.4426 6.4426 7.3450 7.3450 7.4633 7.4633 8.0387 8.0387 8.0397 8.0397 8.3939 8.3939 8.4247 8.4247 8.9022 8.9022 8.9057 8.9057 9.9344 9.9344 10.0367 10.0367 10.8860 10.8860 10.9640 10.9640 11.2125 11.2125 k = 0.2561-0.0000 0.3082 ( 4624 PWs) bands (ev): -3.3306 -3.3306 -3.3299 -3.3299 -0.8791 -0.8791 -0.8744 -0.8744 4.0126 4.0126 4.1637 4.1637 4.7312 4.7312 4.8788 4.8788 5.9644 5.9644 5.9774 5.9774 6.3882 6.3882 6.4243 6.4243 7.3311 7.3311 7.4500 7.4500 8.0153 8.0153 8.0164 8.0164 8.3759 8.3759 8.4066 8.4066 8.8922 8.8922 8.8928 8.8928 9.8697 9.8697 9.9660 9.9660 10.8921 10.8921 10.9563 10.9563 11.2254 11.2254 k = 0.2683-0.0000 0.3082 ( 4624 PWs) bands (ev): -3.2946 -3.2946 -3.2938 -3.2938 -0.8872 -0.8872 -0.8823 -0.8823 4.0045 4.0045 4.1714 4.1714 4.6807 4.6807 4.8453 4.8453 5.9763 5.9763 5.9954 5.9954 6.3778 6.3778 6.4071 6.4071 7.3157 7.3157 7.4348 7.4348 7.9918 7.9918 7.9926 7.9926 8.3567 8.3567 8.3875 8.3875 8.8769 8.8769 8.8817 8.8817 9.8085 9.8085 9.8988 9.8988 10.8872 10.8872 10.9349 10.9349 11.2491 11.2491 k = 0.2805-0.0000 0.3082 ( 4628 PWs) bands (ev): -3.2578 -3.2578 -3.2571 -3.2571 -0.8963 -0.8963 -0.8912 -0.8912 3.9885 3.9885 4.1660 4.1660 4.6470 4.6470 4.8228 4.8228 5.9872 5.9872 6.0135 6.0135 6.3707 6.3707 6.3911 6.3911 7.2988 7.2988 7.4176 7.4176 7.9681 7.9681 7.9684 7.9684 8.3365 8.3365 8.3674 8.3674 8.8599 8.8599 8.8688 8.8688 9.7511 9.7511 9.8358 9.8358 10.8736 10.8736 10.9050 10.9050 11.2812 11.2812 k = 0.2927-0.0000 0.3082 ( 4620 PWs) bands (ev): -3.2206 -3.2206 -3.2198 -3.2198 -0.9065 -0.9065 -0.9013 -0.9013 3.9650 3.9650 4.1455 4.1455 4.6322 4.6322 4.8115 4.8115 5.9965 5.9965 6.0307 6.0307 6.3673 6.3673 6.3766 6.3766 7.2809 7.2809 7.3986 7.3986 7.9439 7.9439 7.9444 7.9444 8.3153 8.3153 8.3465 8.3465 8.8415 8.8415 8.8544 8.8544 9.6978 9.6978 9.7774 9.7774 10.8538 10.8538 10.8709 10.8709 11.3189 11.3189 k = 0.3049-0.0000 0.3082 ( 4612 PWs) bands (ev): -3.1830 -3.1830 -3.1822 -3.1822 -0.9178 -0.9178 -0.9125 -0.9125 3.9349 3.9349 4.1116 4.1116 4.6352 4.6352 4.8104 4.8104 6.0035 6.0035 6.0462 6.0462 6.3639 6.3639 6.3677 6.3677 7.2625 7.2625 7.3781 7.3781 7.9193 7.9193 7.9208 7.9208 8.2933 8.2933 8.3250 8.3250 8.8221 8.8221 8.8387 8.8387 9.6485 9.6485 9.7237 9.7237 10.8304 10.8304 10.8349 10.8349 11.3599 11.3599 k = 0.3171-0.0000 0.3082 ( 4616 PWs) bands (ev): -3.1453 -3.1453 -3.1444 -3.1444 -0.9301 -0.9301 -0.9246 -0.9246 3.8999 3.8999 4.0682 4.0682 4.6521 4.6521 4.8183 4.8183 6.0079 6.0079 6.0593 6.0593 6.3530 6.3530 6.3716 6.3716 7.2440 7.2440 7.3562 7.3562 7.8946 7.8946 7.8972 7.8972 8.2706 8.2706 8.3028 8.3028 8.8017 8.8017 8.8217 8.8217 9.6033 9.6033 9.6747 9.6747 10.7987 10.7987 10.8050 10.8050 11.4024 11.4024 k = 0.3293-0.0000 0.3082 ( 4624 PWs) bands (ev): -3.1077 -3.1077 -3.1067 -3.1067 -0.9433 -0.9433 -0.9378 -0.9378 3.8615 3.8615 4.0196 4.0196 4.6787 4.6787 4.8335 4.8335 6.0101 6.0101 6.0695 6.0695 6.3440 6.3440 6.3787 6.3787 7.2263 7.2263 7.3335 7.3335 7.8699 7.8699 7.8737 7.8737 8.2475 8.2475 8.2803 8.2803 8.7806 8.7806 8.8037 8.8037 9.5621 9.5621 9.6302 9.6302 10.7633 10.7633 10.7790 10.7790 11.4452 11.4452 k = 0.3415-0.0000 0.3082 ( 4622 PWs) bands (ev): -3.0704 -3.0704 -3.0694 -3.0694 -0.9574 -0.9574 -0.9517 -0.9517 3.8214 3.8214 3.9692 3.9692 4.7115 4.7115 4.8543 4.8543 6.0104 6.0104 6.0764 6.0764 6.3366 6.3366 6.3878 6.3878 7.2101 7.2101 7.3106 7.3106 7.8456 7.8456 7.8506 7.8506 8.2241 8.2241 8.2575 8.2575 8.7594 8.7594 8.7850 8.7850 9.5248 9.5248 9.5902 9.5902 10.7293 10.7293 10.7532 10.7532 11.4876 11.4876 k = 0.3537-0.0000 0.3082 ( 4626 PWs) bands (ev): -3.0338 -3.0338 -3.0328 -3.0328 -0.9721 -0.9721 -0.9663 -0.9663 3.7809 3.7809 3.9192 3.9192 4.7483 4.7483 4.8790 4.8790 6.0094 6.0094 6.0802 6.0802 6.3301 6.3301 6.3980 6.3980 7.1960 7.1960 7.2880 7.2880 7.8216 7.8216 7.8276 7.8276 8.2006 8.2006 8.2347 8.2347 8.7382 8.7382 8.7659 8.7659 9.4911 9.4911 9.5542 9.5542 10.6972 10.6972 10.7281 10.7281 11.5288 11.5288 k = 0.3659-0.0000 0.3082 ( 4626 PWs) bands (ev): -2.9981 -2.9981 -2.9970 -2.9970 -0.9873 -0.9873 -0.9815 -0.9815 3.7413 3.7413 3.8710 3.8710 4.7874 4.7874 4.9065 4.9065 6.0080 6.0080 6.0810 6.0810 6.3239 6.3239 6.4081 6.4081 7.1849 7.1849 7.2665 7.2665 7.7981 7.7981 7.8051 7.8051 8.1773 8.1773 8.2121 8.2121 8.7174 8.7174 8.7466 8.7466 9.4609 9.4609 9.5222 9.5222 10.6674 10.6674 10.7044 10.7044 11.5684 11.5684 k = 0.3780-0.0000 0.3082 ( 4630 PWs) bands (ev): -2.9637 -2.9637 -2.9626 -2.9626 -1.0028 -1.0028 -0.9969 -0.9969 3.7034 3.7034 3.8257 3.8257 4.8275 4.8275 4.9353 4.9353 6.0067 6.0067 6.0797 6.0797 6.3170 6.3170 6.4167 6.4167 7.1773 7.1773 7.2470 7.2470 7.7754 7.7754 7.7830 7.7830 8.1543 8.1543 8.1898 8.1898 8.6973 8.6973 8.7275 8.7275 9.4340 9.4340 9.4939 9.4939 10.6400 10.6400 10.6822 10.6822 11.6060 11.6060 k = 0.3902-0.0000 0.3082 ( 4620 PWs) bands (ev): -2.9308 -2.9308 -2.9297 -2.9297 -1.0183 -1.0183 -1.0123 -1.0123 3.6679 3.6679 3.7838 3.7838 4.8677 4.8677 4.9646 4.9646 6.0061 6.0061 6.0768 6.0768 6.3088 6.3088 6.4230 6.4230 7.1735 7.1735 7.2302 7.2302 7.7535 7.7535 7.7616 7.7616 8.1319 8.1319 8.1680 8.1680 8.6782 8.6782 8.7091 8.7091 9.4103 9.4103 9.4690 9.4690 10.6153 10.6153 10.6618 10.6618 11.6411 11.6411 k = 0.4024-0.0000 0.3082 ( 4620 PWs) bands (ev): -2.9000 -2.9000 -2.8988 -2.8988 -1.0335 -1.0335 -1.0274 -1.0274 3.6353 3.6353 3.7457 3.7457 4.9069 4.9069 4.9932 4.9932 6.0067 6.0067 6.0730 6.0730 6.2988 6.2988 6.4261 6.4261 7.1735 7.1735 7.2168 7.2168 7.7326 7.7326 7.7407 7.7407 8.1104 8.1104 8.1471 8.1471 8.6604 8.6604 8.6914 8.6914 9.3896 9.3896 9.4473 9.4473 10.5931 10.5931 10.6434 10.6434 11.6735 11.6735 k = 0.4146-0.0000 0.3082 ( 4620 PWs) bands (ev): -2.8715 -2.8715 -2.8703 -2.8703 -1.0480 -1.0480 -1.0419 -1.0419 3.6059 3.6059 3.7117 3.7117 4.9445 4.9445 5.0205 5.0205 6.0089 6.0089 6.0690 6.0690 6.2870 6.2870 6.4256 6.4256 7.1771 7.1771 7.2070 7.2070 7.7128 7.7128 7.7208 7.7208 8.0900 8.0900 8.1273 8.1273 8.6440 8.6440 8.6750 8.6750 9.3717 9.3717 9.4286 9.4286 10.5737 10.5737 10.6271 10.6271 11.7028 11.7028 k = 0.4268-0.0000 0.3082 ( 4626 PWs) bands (ev): -2.8458 -2.8458 -2.8446 -2.8446 -1.0616 -1.0616 -1.0555 -1.0555 3.5801 3.5801 3.6821 3.6821 4.9794 4.9794 5.0456 5.0456 6.0126 6.0126 6.0652 6.0652 6.2737 6.2737 6.4216 6.4216 7.1836 7.1836 7.2010 7.2010 7.6945 7.6945 7.7019 7.7019 8.0713 8.0713 8.1090 8.1090 8.6294 8.6294 8.6601 8.6601 9.3564 9.3564 9.4127 9.4127 10.5569 10.5569 10.6129 10.6129 11.7288 11.7288 k = 0.4390-0.0000 0.3082 ( 4626 PWs) bands (ev): -2.8232 -2.8232 -2.8220 -2.8220 -1.0739 -1.0739 -1.0677 -1.0677 3.5580 3.5580 3.6569 3.6569 5.0110 5.0110 5.0679 5.0679 6.0177 6.0177 6.0619 6.0619 6.2596 6.2596 6.4145 6.4145 7.1922 7.1922 7.1984 7.1984 7.6778 7.6778 7.6845 7.6845 8.0545 8.0545 8.0925 8.0925 8.6168 8.6168 8.6471 8.6471 9.3437 9.3437 9.3995 9.3995 10.5429 10.5429 10.6008 10.6008 11.7511 11.7511 k = 0.4512-0.0000 0.3082 ( 4622 PWs) bands (ev): -2.8042 -2.8042 -2.8029 -2.8029 -1.0845 -1.0845 -1.0783 -1.0783 3.5397 3.5397 3.6362 3.6362 5.0384 5.0384 5.0869 5.0869 6.0238 6.0238 6.0595 6.0595 6.2457 6.2457 6.4055 6.4055 7.1983 7.1983 7.2018 7.2018 7.6633 7.6633 7.6689 7.6689 8.0401 8.0401 8.0784 8.0784 8.6062 8.6062 8.6361 8.6361 9.3335 9.3335 9.3889 9.3889 10.5314 10.5314 10.5910 10.5910 11.7697 11.7697 k = 0.4634-0.0000 0.3082 ( 4614 PWs) bands (ev): -2.7889 -2.7889 -2.7876 -2.7876 -1.0931 -1.0931 -1.0869 -1.0869 3.5255 3.5255 3.6201 3.6201 5.0607 5.0607 5.1021 5.1021 6.0301 6.0301 6.0578 6.0578 6.2331 6.2331 6.3959 6.3959 7.1999 7.1999 7.2111 7.2111 7.6513 7.6513 7.6558 7.6558 8.0285 8.0285 8.0669 8.0669 8.5979 8.5979 8.6273 8.6273 9.3257 9.3257 9.3808 9.3808 10.5226 10.5226 10.5834 10.5834 11.7844 11.7844 k = 0.4756-0.0000 0.3082 ( 4616 PWs) bands (ev): -2.7778 -2.7778 -2.7765 -2.7765 -1.0995 -1.0995 -1.0932 -1.0932 3.5152 3.5152 3.6086 3.6086 5.0772 5.0772 5.1131 5.1131 6.0358 6.0358 6.0569 6.0569 6.2230 6.2230 6.3874 6.3874 7.2020 7.2020 7.2190 7.2190 7.6422 7.6422 7.6458 7.6458 8.0199 8.0199 8.0584 8.0584 8.5919 8.5919 8.6210 8.6210 9.3201 9.3201 9.3751 9.3751 10.5163 10.5163 10.5779 10.5779 11.7949 11.7949 k = 0.4878-0.0000 0.3082 ( 4624 PWs) bands (ev): -2.7711 -2.7711 -2.7697 -2.7697 -1.1034 -1.1034 -1.0971 -1.0971 3.5091 3.5091 3.6016 3.6016 5.0874 5.0874 5.1199 5.1199 6.0397 6.0397 6.0566 6.0566 6.2163 6.2163 6.3815 6.3815 7.2037 7.2037 7.2242 7.2242 7.6365 7.6365 7.6394 7.6394 8.0146 8.0146 8.0532 8.0532 8.5883 8.5883 8.6171 8.6171 9.3168 9.3168 9.3716 9.3716 10.5125 10.5125 10.5746 10.5746 11.8013 11.8013 k = 0.5000-0.0000 0.3082 ( 4628 PWs) bands (ev): -2.7688 -2.7688 -2.7674 -2.7674 -1.1047 -1.1047 -1.0984 -1.0984 3.5070 3.5070 3.5993 3.5993 5.0908 5.0908 5.1221 5.1221 6.0412 6.0412 6.0565 6.0565 6.2140 6.2140 6.3794 6.3794 7.2044 7.2044 7.2260 7.2260 7.6345 7.6345 7.6373 7.6373 8.0128 8.0128 8.0514 8.0514 8.5871 8.5871 8.6158 8.6158 9.3156 9.3156 9.3704 9.3704 10.5112 10.5112 10.5735 10.5735 11.8034 11.8034 k = 0.5000-0.0000 0.3082 ( 4628 PWs) bands (ev): -2.7688 -2.7688 -2.7674 -2.7674 -1.1047 -1.1047 -1.0984 -1.0984 3.5070 3.5070 3.5993 3.5993 5.0908 5.0908 5.1221 5.1221 6.0412 6.0412 6.0565 6.0565 6.2140 6.2140 6.3794 6.3794 7.2044 7.2044 7.2260 7.2260 7.6345 7.6345 7.6373 7.6373 8.0128 8.0128 8.0514 8.0514 8.5871 8.5871 8.6158 8.6158 9.3156 9.3156 9.3704 9.3704 10.5112 10.5112 10.5735 10.5735 11.8034 11.8034 k = 0.5000 0.0122 0.3082 ( 4632 PWs) bands (ev): -2.7680 -2.7680 -2.7666 -2.7666 -1.1054 -1.1054 -1.0992 -1.0992 3.5028 3.5028 3.5942 3.5942 5.0979 5.0979 5.1269 5.1269 6.0211 6.0211 6.0228 6.0228 6.2449 6.2449 6.3949 6.3949 7.2041 7.2041 7.2254 7.2254 7.6384 7.6384 7.6415 7.6415 8.0134 8.0134 8.0521 8.0521 8.5871 8.5871 8.6158 8.6158 9.3171 9.3171 9.3717 9.3717 10.5148 10.5148 10.5771 10.5771 11.8005 11.8005 k = 0.5000 0.0244 0.3082 ( 4624 PWs) bands (ev): -2.7654 -2.7654 -2.7640 -2.7640 -1.1075 -1.1075 -1.1013 -1.1013 3.4903 3.4903 3.5793 3.5793 5.1184 5.1184 5.1404 5.1404 5.9501 5.9501 5.9761 5.9761 6.3029 6.3029 6.4333 6.4333 7.2036 7.2036 7.2236 7.2236 7.6498 7.6498 7.6539 7.6539 8.0155 8.0155 8.0543 8.0543 8.5874 8.5874 8.6159 8.6159 9.3215 9.3215 9.3755 9.3755 10.5254 10.5254 10.5879 10.5879 11.7916 11.7916 k = 0.5000 0.0366 0.3082 ( 4616 PWs) bands (ev): -2.7611 -2.7611 -2.7597 -2.7597 -1.1111 -1.1111 -1.1049 -1.1049 3.4703 3.4703 3.5556 3.5556 5.1506 5.1506 5.1607 5.1607 5.8690 5.8690 5.9156 5.9156 6.3633 6.3633 6.4818 6.4818 7.2031 7.2031 7.2213 7.2213 7.6681 7.6681 7.6737 7.6737 8.0190 8.0190 8.0580 8.0580 8.5879 8.5879 8.6161 8.6161 9.3289 9.3289 9.3819 9.3819 10.5431 10.5431 10.6058 10.6058 11.7769 11.7769 k = 0.5000 0.0488 0.3082 ( 4608 PWs) bands (ev): -2.7550 -2.7550 -2.7537 -2.7537 -1.1160 -1.1160 -1.1099 -1.1099 3.4440 3.4440 3.5247 3.5247 5.1838 5.1838 5.1911 5.1911 5.7860 5.7860 5.8520 5.8520 6.4200 6.4200 6.5323 6.5323 7.2032 7.2032 7.2190 7.2190 7.6923 7.6923 7.6996 7.6996 8.0239 8.0239 8.0633 8.0633 8.5885 8.5885 8.6164 8.6164 9.3392 9.3392 9.3909 9.3909 10.5677 10.5677 10.6307 10.6307 11.7564 11.7564 k = 0.5000 0.0610 0.3082 ( 4612 PWs) bands (ev): -2.7473 -2.7473 -2.7460 -2.7460 -1.1225 -1.1225 -1.1164 -1.1164 3.4128 3.4128 3.4884 3.4884 5.2036 5.2036 5.2338 5.2338 5.7074 5.7074 5.7943 5.7943 6.4714 6.4714 6.5811 6.5811 7.2044 7.2044 7.2177 7.2177 7.7213 7.7213 7.7302 7.7302 8.0303 8.0303 8.0702 8.0702 8.5892 8.5892 8.6167 8.6167 9.3524 9.3524 9.4025 9.4025 10.5991 10.5991 10.6623 10.6623 11.7301 11.7301 k = 0.5000 0.0732 0.3082 ( 4604 PWs) bands (ev): -2.7380 -2.7380 -2.7366 -2.7366 -1.1304 -1.1304 -1.1244 -1.1244 3.3782 3.3782 3.4484 3.4484 5.2113 5.2113 5.2671 5.2671 5.6443 5.6443 5.7523 5.7523 6.5167 6.5167 6.6263 6.6263 7.2073 7.2073 7.2177 7.2177 7.7539 7.7539 7.7641 7.7641 8.0383 8.0383 8.0789 8.0789 8.5902 8.5902 8.6171 8.6171 9.3688 9.3688 9.4168 9.4168 10.6370 10.6370 10.7005 10.7005 11.6985 11.6985 k = 0.5000 0.0854 0.3082 ( 4608 PWs) bands (ev): -2.7270 -2.7270 -2.7256 -2.7256 -1.1397 -1.1397 -1.1338 -1.1338 3.3413 3.3413 3.4063 3.4063 5.1974 5.1974 5.2704 5.2704 5.6165 5.6165 5.7351 5.7351 6.5560 6.5560 6.6672 6.6672 7.2123 7.2123 7.2197 7.2197 7.7885 7.7885 7.7997 7.7997 8.0482 8.0482 8.0895 8.0895 8.5913 8.5913 8.6176 8.6176 9.3883 9.3883 9.4338 9.4338 10.6809 10.6809 10.7446 10.7446 11.6616 11.6616 k = 0.5000 0.0976 0.3082 ( 4612 PWs) bands (ev): -2.7144 -2.7144 -2.7130 -2.7130 -1.1506 -1.1506 -1.1448 -1.1448 3.3035 3.3035 3.3636 3.3636 5.1578 5.1578 5.2297 5.2297 5.6370 5.6370 5.7464 5.7464 6.5894 6.5894 6.7034 6.7034 7.2197 7.2197 7.2238 7.2238 7.8238 7.8238 7.8356 7.8356 8.0601 8.0601 8.1023 8.1023 8.5925 8.5925 8.6181 8.6181 9.4109 9.4109 9.4536 9.4536 10.7304 10.7304 10.7940 10.7940 11.6203 11.6203 k = 0.5000 0.1098 0.3082 ( 4616 PWs) bands (ev): -2.7003 -2.7003 -2.6989 -2.6989 -1.1629 -1.1629 -1.1572 -1.1572 3.2659 3.2659 3.3212 3.3212 5.0965 5.0965 5.1572 5.1572 5.6926 5.6926 5.7817 5.7817 6.6173 6.6173 6.7353 6.7353 7.2298 7.2298 7.2303 7.2303 7.8585 7.8585 7.8704 7.8704 8.0744 8.0744 8.1175 8.1175 8.5939 8.5939 8.6186 8.6186 9.4368 9.4368 9.4764 9.4764 10.7846 10.7846 10.8475 10.8475 11.5751 11.5751 k = 0.5000 0.1221 0.3082 ( 4612 PWs) bands (ev): -2.6848 -2.6848 -2.6833 -2.6833 -1.1767 -1.1767 -1.1711 -1.1711 3.2294 3.2294 3.2803 3.2803 5.0203 5.0203 5.0694 5.0694 5.7663 5.7663 5.8334 5.8334 6.6403 6.6403 6.7632 6.7632 7.2391 7.2391 7.2426 7.2426 7.8911 7.8911 7.9029 7.9029 8.0915 8.0915 8.1354 8.1354 8.5954 8.5954 8.6193 8.6193 9.4660 9.4660 9.5021 9.5021 10.8422 10.8422 10.9036 10.9036 11.5274 11.5274 k = 0.5000 0.1343 0.3082 ( 4616 PWs) bands (ev): -2.6678 -2.6678 -2.6663 -2.6663 -1.1920 -1.1920 -1.1866 -1.1866 3.1948 3.1948 3.2417 3.2417 4.9352 4.9352 4.9748 4.9748 5.8489 5.8489 5.8948 5.8948 6.6589 6.6589 6.7876 6.7876 7.2501 7.2501 7.2579 7.2579 7.9206 7.9206 7.9323 7.9323 8.1118 8.1118 8.1560 8.1560 8.5970 8.5970 8.6200 8.6200 9.4986 9.4986 9.5310 9.5310 10.9015 10.9015 10.9594 10.9594 11.4792 11.4792 k = 0.5000 0.1465 0.3082 ( 4620 PWs) bands (ev): -2.6494 -2.6494 -2.6480 -2.6480 -1.2087 -1.2087 -1.2034 -1.2034 3.1628 3.1628 3.2059 3.2059 4.8449 4.8449 4.8771 4.8771 5.9358 5.9358 5.9613 5.9613 6.6738 6.6738 6.8093 6.8093 7.2632 7.2632 7.2758 7.2758 7.9462 7.9462 7.9579 7.9579 8.1353 8.1353 8.1792 8.1792 8.5988 8.5988 8.6208 8.6208 9.5345 9.5345 9.5630 9.5630 10.9603 10.9603 11.0107 11.0107 11.4340 11.4340 k = 0.5000 0.1587 0.3082 ( 4616 PWs) bands (ev): -2.6298 -2.6298 -2.6284 -2.6284 -1.2268 -1.2268 -1.2217 -1.2217 3.1339 3.1339 3.1735 3.1735 4.7520 4.7520 4.7784 4.7784 6.0245 6.0245 6.0298 6.0298 6.6858 6.6858 6.8290 6.8290 7.2780 7.2780 7.2960 7.2960 7.9676 7.9676 7.9798 7.9798 8.1618 8.1618 8.2048 8.2048 8.6007 8.6007 8.6216 8.6216 9.5740 9.5740 9.5983 9.5983 11.0147 11.0147 11.0499 11.0499 11.3981 11.3981 k = 0.5000 0.1709 0.3082 ( 4620 PWs) bands (ev): -2.6091 -2.6091 -2.6077 -2.6077 -1.2462 -1.2462 -1.2413 -1.2413 3.1085 3.1085 3.1450 3.1450 4.6579 4.6579 4.6797 4.6797 6.0978 6.0978 6.1130 6.1130 6.6957 6.6957 6.8472 6.8472 7.2944 7.2944 7.3183 7.3183 7.9849 7.9849 7.9978 7.9978 8.1909 8.1909 8.2321 8.2321 8.6027 8.6027 8.6226 8.6226 9.6168 9.6168 9.6369 9.6369 11.0592 11.0592 11.0665 11.0665 11.3806 11.3806 k = 0.5000 0.1831 0.3082 ( 4620 PWs) bands (ev): -2.5874 -2.5874 -2.5859 -2.5859 -1.2668 -1.2668 -1.2621 -1.2621 3.0870 3.0870 3.1206 3.1206 4.5638 4.5638 4.5818 4.5818 6.1638 6.1638 6.1998 6.1998 6.7041 6.7041 6.8648 6.8648 7.3122 7.3122 7.3424 7.3424 7.9986 7.9986 8.0126 8.0126 8.2217 8.2217 8.2606 8.2606 8.6047 8.6047 8.6235 8.6235 9.6630 9.6630 9.6790 9.6790 11.0535 11.0535 11.0851 11.0851 11.3840 11.3840 k = 0.5000 0.1953 0.3082 ( 4616 PWs) bands (ev): -2.5647 -2.5647 -2.5633 -2.5633 -1.2885 -1.2885 -1.2840 -1.2840 3.0697 3.0697 3.1006 3.1006 4.4703 4.4703 4.4853 4.4853 6.2262 6.2262 6.2834 6.2834 6.7121 6.7121 6.8821 6.8821 7.3313 7.3313 7.3682 7.3682 8.0091 8.0091 8.0243 8.0243 8.2537 8.2537 8.2898 8.2898 8.6068 8.6068 8.6246 8.6246 9.7126 9.7126 9.7244 9.7244 11.0166 11.0166 11.0840 11.0840 11.3687 11.3687 k = 0.5000 0.2075 0.3082 ( 4616 PWs) bands (ev): -2.5414 -2.5414 -2.5400 -2.5400 -1.3112 -1.3112 -1.3069 -1.3069 3.0567 3.0567 3.0852 3.0852 4.3782 4.3782 4.3904 4.3904 6.2840 6.2840 6.3620 6.3620 6.7208 6.7208 6.8995 6.8995 7.3516 7.3516 7.3954 7.3954 8.0167 8.0167 8.0333 8.0333 8.2864 8.2864 8.3192 8.3192 8.6090 8.6090 8.6256 8.6256 9.7655 9.7655 9.7733 9.7733 10.9659 10.9659 11.0562 11.0562 11.3698 11.3698 k = 0.5000 0.2197 0.3082 ( 4612 PWs) bands (ev): -2.5175 -2.5175 -2.5161 -2.5161 -1.3346 -1.3346 -1.3305 -1.3305 3.0483 3.0483 3.0745 3.0745 4.2877 4.2877 4.2978 4.2978 6.3364 6.3364 6.4336 6.4336 6.7317 6.7317 6.9173 6.9173 7.3730 7.3730 7.4237 7.4237 8.0217 8.0217 8.0398 8.0398 8.3193 8.3193 8.3485 8.3485 8.6113 8.6113 8.6268 8.6268 9.8213 9.8213 9.8256 9.8256 10.9087 10.9087 11.0113 11.0113 11.3760 11.3760 k = 0.5000 0.2319 0.3082 ( 4612 PWs) bands (ev): -2.4933 -2.4933 -2.4919 -2.4919 -1.3585 -1.3585 -1.3546 -1.3546 3.0445 3.0445 3.0685 3.0685 4.1995 4.1995 4.2076 4.2076 6.3831 6.3831 6.4952 6.4952 6.7471 6.7471 6.9353 6.9353 7.3955 7.3955 7.4529 7.4529 8.0244 8.0244 8.0440 8.0440 8.3522 8.3522 8.3775 8.3775 8.6137 8.6137 8.6281 8.6281 9.8800 9.8800 9.8811 9.8811 10.8491 10.8491 10.9583 10.9583 11.3776 11.3776 k = 0.5000 0.2441 0.3082 ( 4620 PWs) bands (ev): -2.4690 -2.4690 -2.4676 -2.4676 -1.3827 -1.3827 -1.3791 -1.3791 3.0454 3.0454 3.0673 3.0673 4.1139 4.1139 4.1201 4.1201 6.4238 6.4238 6.5440 6.5440 6.7693 6.7693 6.9534 6.9534 7.4192 7.4192 7.4825 7.4825 8.0249 8.0249 8.0459 8.0459 8.3846 8.3846 8.4058 8.4058 8.6163 8.6163 8.6295 8.6295 9.9397 9.9397 9.9409 9.9409 10.7898 10.7898 10.9026 10.9026 11.3695 11.3695 k = 0.5000 0.2563 0.3082 ( 4620 PWs) bands (ev): -2.4449 -2.4449 -2.4436 -2.4436 -1.4068 -1.4068 -1.4034 -1.4034 3.0507 3.0507 3.0708 3.0708 4.0311 4.0311 4.0358 4.0358 6.4588 6.4588 6.5783 6.5783 6.7995 6.7995 6.9712 6.9712 7.4439 7.4439 7.5122 7.5122 8.0233 8.0233 8.0458 8.0458 8.4162 8.4162 8.4334 8.4334 8.6190 8.6190 8.6311 8.6311 10.0010 10.0010 10.0037 10.0037 10.7325 10.7325 10.8475 10.8475 11.3497 11.3497 k = 0.5000 0.2685 0.3082 ( 4612 PWs) bands (ev): -2.4214 -2.4214 -2.4201 -2.4201 -1.4304 -1.4304 -1.4274 -1.4274 3.0605 3.0605 3.0787 3.0787 3.9517 3.9517 3.9550 3.9550 6.4886 6.4886 6.5999 6.5999 6.8356 6.8356 6.9881 6.9881 7.4697 7.4697 7.5412 7.5412 8.0201 8.0201 8.0438 8.0438 8.4464 8.4464 8.4597 8.4597 8.6220 8.6220 8.6329 8.6329 10.0645 10.0645 10.0673 10.0673 10.6788 10.6788 10.7954 10.7954 11.3182 11.3182 k = 0.5000 0.2807 0.3082 ( 4616 PWs) bands (ev): -2.3988 -2.3988 -2.3976 -2.3976 -1.4532 -1.4532 -1.4504 -1.4504 3.0745 3.0745 3.0910 3.0910 3.8761 3.8761 3.8780 3.8780 6.5137 6.5137 6.6122 6.6122 6.8738 6.8738 7.0037 7.0037 7.4962 7.4962 7.5688 7.5688 8.0153 8.0153 8.0400 8.0400 8.4746 8.4746 8.4842 8.4842 8.6254 8.6254 8.6351 8.6351 10.1293 10.1293 10.1304 10.1304 10.6304 10.6304 10.7487 10.7487 11.2763 11.2763 k = 0.5000 0.2929 0.3082 ( 4616 PWs) bands (ev): -2.3777 -2.3777 -2.3766 -2.3766 -1.4745 -1.4745 -1.4721 -1.4721 3.0923 3.0923 3.1070 3.1070 3.8047 3.8047 3.8055 3.8055 6.5347 6.5347 6.6185 6.6185 6.9106 6.9106 7.0174 7.0174 7.5232 7.5232 7.5944 7.5944 8.0097 8.0097 8.0346 8.0346 8.5001 8.5001 8.5066 8.5066 8.6293 8.6293 8.6377 8.6377 10.1910 10.1910 10.1936 10.1936 10.5895 10.5895 10.7099 10.7099 11.2258 11.2258 k = 0.5000 0.3051 0.3082 ( 4612 PWs) bands (ev): -2.3584 -2.3584 -2.3574 -2.3574 -1.4940 -1.4940 -1.4919 -1.4919 3.1134 3.1134 3.1263 3.1263 3.7381 3.7381 3.7383 3.7383 6.5523 6.5523 6.6210 6.6210 6.9439 6.9439 7.0288 7.0288 7.5500 7.5500 7.6168 7.6168 8.0037 8.0037 8.0281 8.0281 8.5221 8.5221 8.5261 8.5261 8.6339 8.6339 8.6408 8.6408 10.2458 10.2458 10.2545 10.2545 10.5593 10.5593 10.6823 10.6823 11.1690 11.1690 k = 0.5000 0.3173 0.3082 ( 4600 PWs) bands (ev): -2.3416 -2.3416 -2.3408 -2.3408 -1.5110 -1.5110 -1.5093 -1.5093 3.1368 3.1368 3.1478 3.1478 3.6770 3.6770 3.6780 3.6780 6.5670 6.5670 6.6211 6.6211 6.9727 6.9727 7.0375 7.0375 7.5760 7.5760 7.6352 7.6352 7.9980 7.9980 8.0207 8.0207 8.5400 8.5400 8.5422 8.5422 8.6391 8.6391 8.6445 8.6445 10.2908 10.2908 10.3059 10.3059 10.5459 10.5459 10.6692 10.6692 11.1088 11.1088 k = 0.5000 0.3295 0.3082 ( 4600 PWs) bands (ev): -2.3277 -2.3277 -2.3271 -2.3271 -1.5250 -1.5250 -1.5236 -1.5236 3.1609 3.1609 3.1699 3.1699 3.6237 3.6237 3.6253 3.6253 6.5793 6.5793 6.6192 6.6192 6.9965 6.9965 7.0431 7.0431 7.6001 7.6001 7.6485 7.6485 7.9935 7.9935 8.0128 8.0128 8.5534 8.5534 8.5545 8.5545 8.6445 8.6445 8.6483 8.6483 10.3224 10.3224 10.3394 10.3394 10.5566 10.5566 10.6722 10.6722 11.0492 11.0492 k = 0.5000 0.3417 0.3082 ( 4620 PWs) bands (ev): -2.3173 -2.3173 -2.3169 -2.3169 -1.5353 -1.5353 -1.5344 -1.5344 3.1834 3.1834 3.1900 3.1900 3.5811 3.5811 3.5826 3.5826 6.5896 6.5896 6.6159 6.6159 7.0153 7.0153 7.0454 7.0454 7.6214 7.6214 7.6558 7.6558 7.9909 7.9909 8.0051 8.0051 8.5624 8.5624 8.5629 8.5629 8.6494 8.6494 8.6517 8.6517 10.3405 10.3405 10.3531 10.3531 10.5914 10.5914 10.6856 10.6856 10.9974 10.9974 k = 0.5000 0.3540 0.3082 ( 4624 PWs) bands (ev): -2.3109 -2.3109 -2.3106 -2.3106 -1.5416 -1.5416 -1.5412 -1.5412 3.2006 3.2006 3.2042 3.2042 3.5528 3.5528 3.5538 3.5538 6.5982 6.5982 6.6113 6.6113 7.0293 7.0293 7.0440 7.0440 7.6386 7.6386 7.6565 7.6565 7.9909 7.9909 7.9984 7.9984 8.5675 8.5675 8.5677 8.5677 8.6529 8.6529 8.6541 8.6541 10.3492 10.3492 10.3553 10.3553 10.6372 10.6372 10.6934 10.6934 10.9669 10.9669 k = 0.5000 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3086 -2.3086 -2.3086 -2.3086 -1.5436 -1.5436 -1.5436 -1.5436 3.2083 3.2083 3.2083 3.2083 3.5431 3.5431 3.5431 3.5431 6.6054 6.6054 6.6054 6.6054 7.0388 7.0388 7.0388 7.0388 7.6506 7.6506 7.6506 7.6506 7.9935 7.9935 7.9935 7.9935 8.5692 8.5692 8.5692 8.5692 8.6546 8.6546 8.6546 8.6546 10.3533 10.3533 10.3533 10.3533 10.6768 10.6768 10.6768 10.6768 10.9723 10.9723 k = 0.5000 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3086 -2.3086 -2.3086 -2.3086 -1.5436 -1.5436 -1.5436 -1.5436 3.2083 3.2083 3.2083 3.2083 3.5431 3.5431 3.5431 3.5431 6.6054 6.6054 6.6054 6.6054 7.0388 7.0388 7.0388 7.0388 7.6506 7.6506 7.6506 7.6506 7.9935 7.9935 7.9935 7.9935 8.5692 8.5692 8.5692 8.5692 8.6546 8.6546 8.6546 8.6546 10.3533 10.3533 10.3533 10.3533 10.6768 10.6768 10.6768 10.6768 10.9723 10.9723 k = 0.4878 0.3662 0.3082 ( 4620 PWs) bands (ev): -2.3096 -2.3096 -2.3096 -2.3096 -1.5453 -1.5453 -1.5453 -1.5453 3.2115 3.2115 3.2115 3.2115 3.5457 3.5457 3.5457 3.5457 6.6048 6.6048 6.6048 6.6048 7.0397 7.0397 7.0397 7.0397 7.6496 7.6496 7.6496 7.6496 7.9934 7.9934 7.9934 7.9934 8.5688 8.5688 8.5688 8.5688 8.6543 8.6543 8.6543 8.6543 10.3504 10.3504 10.3504 10.3504 10.6814 10.6814 10.6814 10.6814 10.9718 10.9718 k = 0.4756 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3124 -2.3124 -2.3124 -2.3124 -1.5504 -1.5504 -1.5504 -1.5504 3.2212 3.2212 3.2212 3.2212 3.5535 3.5535 3.5535 3.5535 6.6031 6.6031 6.6031 6.6031 7.0426 7.0426 7.0426 7.0426 7.6466 7.6466 7.6466 7.6466 7.9930 7.9930 7.9930 7.9930 8.5675 8.5675 8.5675 8.5675 8.6534 8.6534 8.6534 8.6534 10.3421 10.3421 10.3421 10.3421 10.6946 10.6946 10.6946 10.6946 10.9706 10.9706 k = 0.4634 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3172 -2.3172 -2.3172 -2.3172 -1.5588 -1.5588 -1.5588 -1.5588 3.2372 3.2372 3.2372 3.2372 3.5663 3.5663 3.5663 3.5663 6.6002 6.6002 6.6002 6.6002 7.0474 7.0474 7.0474 7.0474 7.6416 7.6416 7.6416 7.6416 7.9923 7.9923 7.9923 7.9923 8.5653 8.5653 8.5653 8.5653 8.6519 8.6519 8.6519 8.6519 10.3296 10.3296 10.3296 10.3296 10.7149 10.7149 10.7149 10.7149 10.9687 10.9687 k = 0.4512 0.3662 0.3082 ( 4612 PWs) bands (ev): -2.3239 -2.3239 -2.3239 -2.3239 -1.5703 -1.5703 -1.5703 -1.5703 3.2593 3.2593 3.2593 3.2593 3.5843 3.5843 3.5843 3.5843 6.5964 6.5964 6.5964 6.5964 7.0541 7.0541 7.0541 7.0541 7.6346 7.6346 7.6346 7.6346 7.9912 7.9912 7.9912 7.9912 8.5624 8.5624 8.5624 8.5624 8.6499 8.6499 8.6499 8.6499 10.3143 10.3143 10.3143 10.3143 10.7403 10.7403 10.7403 10.7403 10.9666 10.9666 k = 0.4390 0.3662 0.3082 ( 4608 PWs) bands (ev): -2.3323 -2.3323 -2.3323 -2.3323 -1.5849 -1.5849 -1.5849 -1.5849 3.2872 3.2872 3.2872 3.2872 3.6071 3.6071 3.6071 3.6071 6.5918 6.5918 6.5918 6.5918 7.0627 7.0627 7.0627 7.0627 7.6257 7.6257 7.6257 7.6257 7.9897 7.9897 7.9897 7.9897 8.5588 8.5588 8.5588 8.5588 8.6474 8.6474 8.6474 8.6474 10.2976 10.2976 10.2976 10.2976 10.7686 10.7686 10.7686 10.7686 10.9649 10.9649 k = 0.4268 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3424 -2.3424 -2.3424 -2.3424 -1.6024 -1.6024 -1.6024 -1.6024 3.3208 3.3208 3.3208 3.3208 3.6348 3.6348 3.6348 3.6348 6.5868 6.5868 6.5868 6.5868 7.0731 7.0731 7.0731 7.0731 7.6150 7.6150 7.6150 7.6150 7.9877 7.9877 7.9877 7.9877 8.5546 8.5546 8.5546 8.5546 8.6445 8.6445 8.6445 8.6445 10.2801 10.2801 10.2801 10.2801 10.7971 10.7971 10.7971 10.7971 10.9652 10.9652 k = 0.4146 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3541 -2.3541 -2.3541 -2.3541 -1.6226 -1.6226 -1.6226 -1.6226 3.3596 3.3596 3.3596 3.3596 3.6671 3.6671 3.6671 3.6671 6.5814 6.5814 6.5814 6.5814 7.0853 7.0853 7.0853 7.0853 7.6025 7.6025 7.6025 7.6025 7.9852 7.9852 7.9852 7.9852 8.5501 8.5501 8.5501 8.5501 8.6414 8.6414 8.6414 8.6414 10.2625 10.2625 10.2625 10.2625 10.8221 10.8221 10.8221 10.8221 10.9703 10.9703 k = 0.4024 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3674 -2.3674 -2.3674 -2.3674 -1.6452 -1.6452 -1.6452 -1.6452 3.4032 3.4032 3.4032 3.4032 3.7040 3.7040 3.7040 3.7040 6.5762 6.5762 6.5762 6.5762 7.0993 7.0993 7.0993 7.0993 7.5884 7.5884 7.5884 7.5884 7.9821 7.9821 7.9821 7.9821 8.5452 8.5452 8.5452 8.5452 8.6380 8.6380 8.6380 8.6380 10.2452 10.2452 10.2452 10.2452 10.8388 10.8388 10.8388 10.8388 10.9841 10.9841 k = 0.3902 0.3662 0.3082 ( 4624 PWs) bands (ev): -2.3820 -2.3820 -2.3820 -2.3820 -1.6700 -1.6700 -1.6700 -1.6700 3.4510 3.4510 3.4510 3.4510 3.7451 3.7451 3.7451 3.7451 6.5715 6.5715 6.5715 6.5715 7.1147 7.1147 7.1147 7.1147 7.5728 7.5728 7.5728 7.5728 7.9782 7.9782 7.9782 7.9782 8.5403 8.5403 8.5403 8.5403 8.6345 8.6345 8.6345 8.6345 10.2283 10.2283 10.2283 10.2283 10.8446 10.8446 10.8446 10.8446 11.0087 11.0087 k = 0.3780 0.3662 0.3082 ( 4620 PWs) bands (ev): -2.3979 -2.3979 -2.3979 -2.3979 -1.6968 -1.6968 -1.6968 -1.6968 3.5027 3.5027 3.5027 3.5027 3.7903 3.7903 3.7903 3.7903 6.5677 6.5677 6.5677 6.5677 7.1314 7.1314 7.1314 7.1314 7.5562 7.5562 7.5562 7.5562 7.9737 7.9737 7.9737 7.9737 8.5355 8.5355 8.5355 8.5355 8.6310 8.6310 8.6310 8.6310 10.2120 10.2120 10.2120 10.2120 10.8410 10.8410 10.8410 10.8410 11.0422 11.0422 k = 0.3659 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.4150 -2.4150 -2.4150 -2.4150 -1.7252 -1.7252 -1.7252 -1.7252 3.5576 3.5576 3.5576 3.5576 3.8393 3.8393 3.8393 3.8393 6.5652 6.5652 6.5652 6.5652 7.1490 7.1490 7.1490 7.1490 7.5389 7.5389 7.5389 7.5389 7.9684 7.9684 7.9684 7.9684 8.5307 8.5307 8.5307 8.5307 8.6275 8.6275 8.6275 8.6275 10.1963 10.1963 10.1963 10.1963 10.8311 10.8311 10.8311 10.8311 11.0810 11.0810 k = 0.3537 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.4330 -2.4330 -2.4330 -2.4330 -1.7550 -1.7550 -1.7550 -1.7550 3.6152 3.6152 3.6152 3.6152 3.8920 3.8920 3.8920 3.8920 6.5646 6.5646 6.5646 6.5646 7.1668 7.1668 7.1668 7.1668 7.5218 7.5218 7.5218 7.5218 7.9623 7.9623 7.9623 7.9623 8.5263 8.5263 8.5263 8.5263 8.6242 8.6242 8.6242 8.6242 10.1812 10.1812 10.1812 10.1812 10.8170 10.8170 10.8170 10.8170 11.1226 11.1226 k = 0.3415 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.4519 -2.4519 -2.4519 -2.4519 -1.7860 -1.7860 -1.7860 -1.7860 3.6747 3.6747 3.6747 3.6747 3.9480 3.9480 3.9480 3.9480 6.5662 6.5662 6.5662 6.5662 7.1839 7.1839 7.1839 7.1839 7.5056 7.5056 7.5056 7.5056 7.9555 7.9555 7.9555 7.9555 8.5223 8.5223 8.5223 8.5223 8.6210 8.6210 8.6210 8.6210 10.1667 10.1667 10.1667 10.1667 10.8001 10.8001 10.8001 10.8001 11.1655 11.1655 k = 0.3293 0.3662 0.3082 ( 4628 PWs) bands (ev): -2.4715 -2.4715 -2.4715 -2.4715 -1.8180 -1.8180 -1.8180 -1.8180 3.7355 3.7355 3.7355 3.7355 4.0070 4.0070 4.0070 4.0070 6.5707 6.5707 6.5707 6.5707 7.1988 7.1988 7.1988 7.1988 7.4921 7.4921 7.4921 7.4921 7.9479 7.9479 7.9479 7.9479 8.5186 8.5186 8.5186 8.5186 8.6178 8.6178 8.6178 8.6178 10.1527 10.1527 10.1527 10.1527 10.7812 10.7812 10.7812 10.7812 11.2085 11.2085 k = 0.3171 0.3662 0.3082 ( 4628 PWs) bands (ev): -2.4917 -2.4917 -2.4917 -2.4917 -1.8506 -1.8506 -1.8506 -1.8506 3.7971 3.7971 3.7971 3.7971 4.0688 4.0688 4.0688 4.0688 6.5785 6.5785 6.5785 6.5785 7.2096 7.2096 7.2096 7.2096 7.4833 7.4833 7.4833 7.4833 7.9397 7.9397 7.9397 7.9397 8.5155 8.5155 8.5155 8.5155 8.6150 8.6150 8.6150 8.6150 10.1391 10.1391 10.1391 10.1391 10.7609 10.7609 10.7609 10.7609 11.2509 11.2509 k = 0.3049 0.3662 0.3082 ( 4620 PWs) bands (ev): -2.5123 -2.5123 -2.5123 -2.5123 -1.8836 -1.8836 -1.8836 -1.8836 3.8586 3.8586 3.8586 3.8586 4.1331 4.1331 4.1331 4.1331 6.5902 6.5902 6.5902 6.5902 7.2142 7.2142 7.2142 7.2142 7.4815 7.4815 7.4815 7.4815 7.9308 7.9308 7.9308 7.9308 8.5130 8.5130 8.5130 8.5130 8.6125 8.6125 8.6125 8.6125 10.1258 10.1258 10.1258 10.1258 10.7398 10.7398 10.7398 10.7398 11.2921 11.2921 k = 0.2927 0.3662 0.3082 ( 4612 PWs) bands (ev): -2.5332 -2.5332 -2.5332 -2.5332 -1.9168 -1.9168 -1.9168 -1.9168 3.9194 3.9194 3.9194 3.9194 4.1996 4.1996 4.1996 4.1996 6.6060 6.6060 6.6060 6.6060 7.2108 7.2108 7.2108 7.2108 7.4883 7.4883 7.4883 7.4883 7.9214 7.9214 7.9214 7.9214 8.5110 8.5110 8.5110 8.5110 8.6101 8.6101 8.6101 8.6101 10.1127 10.1127 10.1127 10.1127 10.7184 10.7184 10.7184 10.7184 11.3317 11.3317 k = 0.2805 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.5543 -2.5543 -2.5543 -2.5543 -1.9500 -1.9500 -1.9500 -1.9500 3.9788 3.9788 3.9788 3.9788 4.2678 4.2678 4.2678 4.2678 6.6265 6.6265 6.6265 6.6265 7.1996 7.1996 7.1996 7.1996 7.5040 7.5040 7.5040 7.5040 7.9115 7.9115 7.9115 7.9115 8.5096 8.5096 8.5096 8.5096 8.6079 8.6079 8.6079 8.6079 10.0998 10.0998 10.0998 10.0998 10.6970 10.6970 10.6970 10.6970 11.3692 11.3692 k = 0.2683 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.5754 -2.5754 -2.5754 -2.5754 -1.9831 -1.9831 -1.9831 -1.9831 4.0362 4.0362 4.0362 4.0362 4.3377 4.3377 4.3377 4.3377 6.6517 6.6517 6.6517 6.6517 7.1818 7.1818 7.1818 7.1818 7.5273 7.5273 7.5273 7.5273 7.9015 7.9015 7.9015 7.9015 8.5087 8.5087 8.5087 8.5087 8.6059 8.6059 8.6059 8.6059 10.0868 10.0868 10.0868 10.0868 10.6762 10.6762 10.6762 10.6762 11.4042 11.4042 k = 0.2561 0.3662 0.3082 ( 4620 PWs) bands (ev): -2.5965 -2.5965 -2.5965 -2.5965 -2.0157 -2.0157 -2.0157 -2.0157 4.0911 4.0911 4.0911 4.0911 4.4087 4.4087 4.4087 4.4087 6.6817 6.6817 6.6817 6.6817 7.1595 7.1595 7.1595 7.1595 7.5564 7.5564 7.5564 7.5564 7.8913 7.8913 7.8913 7.8913 8.5083 8.5083 8.5083 8.5083 8.6040 8.6040 8.6040 8.6040 10.0737 10.0737 10.0737 10.0737 10.6564 10.6564 10.6564 10.6564 11.4365 11.4365 k = 0.2439 0.3662 0.3082 ( 4620 PWs) bands (ev): -2.6173 -2.6173 -2.6173 -2.6173 -2.0478 -2.0478 -2.0478 -2.0478 4.1430 4.1430 4.1430 4.1430 4.4805 4.4805 4.4805 4.4805 6.7161 6.7161 6.7161 6.7161 7.1348 7.1348 7.1348 7.1348 7.5898 7.5898 7.5898 7.5898 7.8813 7.8813 7.8813 7.8813 8.5082 8.5082 8.5082 8.5082 8.6024 8.6024 8.6024 8.6024 10.0604 10.0604 10.0604 10.0604 10.6381 10.6381 10.6381 10.6381 11.4658 11.4658 k = 0.2317 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.6378 -2.6378 -2.6378 -2.6378 -2.0792 -2.0792 -2.0792 -2.0792 4.1915 4.1915 4.1915 4.1915 4.5529 4.5529 4.5529 4.5529 6.7538 6.7538 6.7538 6.7538 7.1101 7.1101 7.1101 7.1101 7.6260 7.6260 7.6260 7.6260 7.8718 7.8718 7.8718 7.8718 8.5086 8.5086 8.5086 8.5086 8.6008 8.6008 8.6008 8.6008 10.0467 10.0467 10.0467 10.0467 10.6216 10.6216 10.6216 10.6216 11.4919 11.4919 k = 0.2195 0.3662 0.3082 ( 4612 PWs) bands (ev): -2.6578 -2.6578 -2.6578 -2.6578 -2.1098 -2.1098 -2.1098 -2.1098 4.2361 4.2361 4.2361 4.2361 4.6256 4.6256 4.6256 4.6256 6.7922 6.7922 6.7922 6.7922 7.0887 7.0887 7.0887 7.0887 7.6638 7.6638 7.6638 7.6638 7.8635 7.8635 7.8635 7.8635 8.5091 8.5091 8.5091 8.5091 8.5994 8.5994 8.5994 8.5994 10.0327 10.0327 10.0327 10.0327 10.6075 10.6075 10.6075 10.6075 11.5148 11.5148 k = 0.2073 0.3662 0.3082 ( 4608 PWs) bands (ev): -2.6774 -2.6774 -2.6774 -2.6774 -2.1394 -2.1394 -2.1394 -2.1394 4.2769 4.2769 4.2769 4.2769 4.6981 4.6981 4.6981 4.6981 6.8258 6.8258 6.8258 6.8258 7.0764 7.0764 7.0764 7.0764 7.7013 7.7013 7.7013 7.7013 7.8574 7.8574 7.8574 7.8574 8.5097 8.5097 8.5097 8.5097 8.5981 8.5981 8.5981 8.5981 10.0180 10.0180 10.0180 10.0180 10.5962 10.5962 10.5962 10.5962 11.5343 11.5343 k = 0.1951 0.3662 0.3082 ( 4608 PWs) bands (ev): -2.6963 -2.6963 -2.6963 -2.6963 -2.1678 -2.1678 -2.1678 -2.1678 4.3137 4.3137 4.3137 4.3137 4.7703 4.7703 4.7703 4.7703 6.8456 6.8456 6.8456 6.8456 7.0824 7.0824 7.0824 7.0824 7.7357 7.7357 7.7357 7.7357 7.8561 7.8561 7.8561 7.8561 8.5102 8.5102 8.5102 8.5102 8.5971 8.5971 8.5971 8.5971 10.0026 10.0026 10.0026 10.0026 10.5881 10.5881 10.5881 10.5881 11.5504 11.5504 k = 0.1829 0.3662 0.3082 ( 4608 PWs) bands (ev): -2.7144 -2.7144 -2.7144 -2.7144 -2.1950 -2.1950 -2.1950 -2.1950 4.3464 4.3464 4.3464 4.3464 4.8417 4.8417 4.8417 4.8417 6.8452 6.8452 6.8452 6.8452 7.1130 7.1130 7.1130 7.1130 7.7616 7.7616 7.7616 7.7616 7.8645 7.8645 7.8645 7.8645 8.5104 8.5104 8.5104 8.5104 8.5963 8.5963 8.5963 8.5963 9.9864 9.9864 9.9864 9.9864 10.5834 10.5834 10.5834 10.5834 11.5631 11.5631 k = 0.1707 0.3662 0.3082 ( 4612 PWs) bands (ev): -2.7318 -2.7318 -2.7318 -2.7318 -2.2209 -2.2209 -2.2209 -2.2209 4.3753 4.3753 4.3753 4.3753 4.9121 4.9121 4.9121 4.9121 6.8279 6.8279 6.8279 6.8279 7.1643 7.1643 7.1643 7.1643 7.7744 7.7744 7.7744 7.7744 7.8868 7.8868 7.8868 7.8868 8.5098 8.5098 8.5098 8.5098 8.5961 8.5961 8.5961 8.5961 9.9692 9.9692 9.9692 9.9692 10.5826 10.5826 10.5826 10.5826 11.5725 11.5725 k = 0.1585 0.3662 0.3082 ( 4608 PWs) bands (ev): -2.7483 -2.7483 -2.7483 -2.7483 -2.2454 -2.2454 -2.2454 -2.2454 4.4005 4.4005 4.4005 4.4005 4.9812 4.9812 4.9812 4.9812 6.8007 6.8007 6.8007 6.8007 7.2287 7.2287 7.2287 7.2287 7.7773 7.7773 7.7773 7.7773 7.9198 7.9198 7.9198 7.9198 8.5083 8.5083 8.5083 8.5083 8.5968 8.5968 8.5968 8.5968 9.9509 9.9509 9.9509 9.9509 10.5858 10.5858 10.5858 10.5858 11.5788 11.5788 k = 0.1463 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.7639 -2.7639 -2.7639 -2.7639 -2.2684 -2.2684 -2.2684 -2.2684 4.4223 4.4223 4.4223 4.4223 5.0487 5.0487 5.0487 5.0487 6.7684 6.7684 6.7684 6.7684 7.3005 7.3005 7.3005 7.3005 7.7760 7.7760 7.7760 7.7760 7.9576 7.9576 7.9576 7.9576 8.5051 8.5051 8.5051 8.5051 8.5987 8.5987 8.5987 8.5987 9.9313 9.9313 9.9313 9.9313 10.5931 10.5931 10.5931 10.5931 11.5822 11.5822 k = 0.1341 0.3662 0.3082 ( 4624 PWs) bands (ev): -2.7784 -2.7784 -2.7784 -2.7784 -2.2898 -2.2898 -2.2898 -2.2898 4.4408 4.4408 4.4408 4.4408 5.1141 5.1141 5.1141 5.1141 6.7336 6.7336 6.7336 6.7336 7.3758 7.3758 7.3758 7.3758 7.7743 7.7743 7.7743 7.7743 7.9965 7.9965 7.9965 7.9965 8.5001 8.5001 8.5001 8.5001 8.6022 8.6022 8.6022 8.6022 9.9105 9.9105 9.9105 9.9105 10.6045 10.6045 10.6045 10.6045 11.5829 11.5829 k = 0.1220 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.7919 -2.7919 -2.7919 -2.7919 -2.3096 -2.3096 -2.3096 -2.3096 4.4566 4.4566 4.4566 4.4566 5.1773 5.1773 5.1773 5.1773 6.6976 6.6976 6.6976 6.6976 7.4515 7.4515 7.4515 7.4515 7.7746 7.7746 7.7746 7.7746 8.0350 8.0350 8.0350 8.0350 8.4927 8.4927 8.4927 8.4927 8.6076 8.6076 8.6076 8.6076 9.8884 9.8884 9.8884 9.8884 10.6198 10.6198 10.6198 10.6198 11.5814 11.5814 k = 0.1098 0.3662 0.3082 ( 4612 PWs) bands (ev): -2.8042 -2.8042 -2.8042 -2.8042 -2.3276 -2.3276 -2.3276 -2.3276 4.4697 4.4697 4.4697 4.4697 5.2377 5.2377 5.2377 5.2377 6.6613 6.6613 6.6613 6.6613 7.5233 7.5233 7.5233 7.5233 7.7798 7.7798 7.7798 7.7798 8.0718 8.0718 8.0718 8.0718 8.4829 8.4829 8.4829 8.4829 8.6151 8.6151 8.6151 8.6151 9.8650 9.8650 9.8650 9.8650 10.6385 10.6385 10.6385 10.6385 11.5781 11.5781 k = 0.0976 0.3662 0.3082 ( 4612 PWs) bands (ev): -2.8154 -2.8154 -2.8154 -2.8154 -2.3439 -2.3439 -2.3439 -2.3439 4.4807 4.4807 4.4807 4.4807 5.2948 5.2948 5.2948 5.2948 6.6256 6.6256 6.6256 6.6256 7.5853 7.5853 7.5853 7.5853 7.7947 7.7947 7.7947 7.7947 8.1061 8.1061 8.1061 8.1061 8.4704 8.4704 8.4704 8.4704 8.6249 8.6249 8.6249 8.6249 9.8405 9.8405 9.8405 9.8405 10.6601 10.6601 10.6601 10.6601 11.5734 11.5734 k = 0.0854 0.3662 0.3082 ( 4608 PWs) bands (ev): -2.8253 -2.8253 -2.8253 -2.8253 -2.3584 -2.3584 -2.3584 -2.3584 4.4896 4.4896 4.4896 4.4896 5.3482 5.3482 5.3482 5.3482 6.5910 6.5910 6.5910 6.5910 7.6300 7.6300 7.6300 7.6300 7.8259 7.8259 7.8259 7.8259 8.1371 8.1371 8.1371 8.1371 8.4552 8.4552 8.4552 8.4552 8.6367 8.6367 8.6367 8.6367 9.8153 9.8153 9.8153 9.8153 10.6836 10.6836 10.6836 10.6836 11.5679 11.5679 k = 0.0732 0.3662 0.3082 ( 4596 PWs) bands (ev): -2.8340 -2.8340 -2.8340 -2.8340 -2.3710 -2.3710 -2.3710 -2.3710 4.4968 4.4968 4.4968 4.4968 5.3972 5.3972 5.3972 5.3972 6.5583 6.5583 6.5583 6.5583 7.6553 7.6553 7.6553 7.6553 7.8741 7.8741 7.8741 7.8741 8.1644 8.1644 8.1644 8.1644 8.4374 8.4374 8.4374 8.4374 8.6503 8.6503 8.6503 8.6503 9.7899 9.7899 9.7899 9.7899 10.7079 10.7079 10.7079 10.7079 11.5621 11.5621 k = 0.0610 0.3662 0.3082 ( 4600 PWs) bands (ev): -2.8414 -2.8414 -2.8414 -2.8414 -2.3817 -2.3817 -2.3817 -2.3817 4.5025 4.5025 4.5025 4.5025 5.4411 5.4411 5.4411 5.4411 6.5282 6.5282 6.5282 6.5282 7.6673 7.6673 7.6673 7.6673 7.9321 7.9321 7.9321 7.9321 8.1871 8.1871 8.1871 8.1871 8.4171 8.4171 8.4171 8.4171 8.6652 8.6652 8.6652 8.6652 9.7651 9.7651 9.7651 9.7651 10.7318 10.7318 10.7318 10.7318 11.5565 11.5565 k = 0.0488 0.3662 0.3082 ( 4596 PWs) bands (ev): -2.8475 -2.8475 -2.8475 -2.8475 -2.3905 -2.3905 -2.3905 -2.3905 4.5070 4.5070 4.5070 4.5070 5.4789 5.4789 5.4789 5.4789 6.5016 6.5016 6.5016 6.5016 7.6726 7.6726 7.6726 7.6726 7.9924 7.9924 7.9924 7.9924 8.2046 8.2046 8.2046 8.2046 8.3949 8.3949 8.3949 8.3949 8.6803 8.6803 8.6803 8.6803 9.7420 9.7420 9.7420 9.7420 10.7540 10.7540 10.7540 10.7540 11.5516 11.5516 k = 0.0366 0.3662 0.3082 ( 4592 PWs) bands (ev): -2.8523 -2.8523 -2.8523 -2.8523 -2.3974 -2.3974 -2.3974 -2.3974 4.5102 4.5102 4.5102 4.5102 5.5098 5.5098 5.5098 5.5098 6.4795 6.4795 6.4795 6.4795 7.6748 7.6748 7.6748 7.6748 8.0504 8.0504 8.0504 8.0504 8.2158 8.2158 8.2158 8.2158 8.3716 8.3716 8.3716 8.3716 8.6944 8.6944 8.6944 8.6944 9.7218 9.7218 9.7218 9.7218 10.7730 10.7730 10.7730 10.7730 11.5476 11.5476 k = 0.0244 0.3662 0.3082 ( 4600 PWs) bands (ev): -2.8557 -2.8557 -2.8557 -2.8557 -2.4024 -2.4024 -2.4024 -2.4024 4.5125 4.5125 4.5125 4.5125 5.5328 5.5328 5.5328 5.5328 6.4627 6.4627 6.4627 6.4627 7.6756 7.6756 7.6756 7.6756 8.1034 8.1034 8.1034 8.1034 8.2186 8.2186 8.2186 8.2186 8.3497 8.3497 8.3497 8.3497 8.7060 8.7060 8.7060 8.7060 9.7060 9.7060 9.7060 9.7060 10.7876 10.7876 10.7876 10.7876 11.5448 11.5448 k = 0.0122 0.3662 0.3082 ( 4596 PWs) bands (ev): -2.8578 -2.8578 -2.8578 -2.8578 -2.4053 -2.4053 -2.4053 -2.4053 4.5138 4.5138 4.5138 4.5138 5.5470 5.5470 5.5470 5.5470 6.4523 6.4523 6.4523 6.4523 7.6758 7.6758 7.6758 7.6758 8.1490 8.1490 8.1490 8.1490 8.2100 8.2100 8.2100 8.2100 8.3336 8.3336 8.3336 8.3336 8.7137 8.7137 8.7137 8.7137 9.6959 9.6959 9.6959 9.6959 10.7968 10.7968 10.7968 10.7968 11.5431 11.5431 k = 0.0000 0.3662 0.3082 ( 4604 PWs) bands (ev): -2.8584 -2.8584 -2.8584 -2.8584 -2.4063 -2.4063 -2.4063 -2.4063 4.5142 4.5142 4.5142 4.5142 5.5518 5.5518 5.5518 5.5518 6.4487 6.4487 6.4487 6.4487 7.6759 7.6759 7.6759 7.6759 8.1794 8.1794 8.1794 8.1794 8.1925 8.1925 8.1925 8.1925 8.3275 8.3275 8.3275 8.3275 8.7165 8.7165 8.7165 8.7165 9.6924 9.6924 9.6924 9.6924 10.7999 10.7999 10.7999 10.7999 11.5425 11.5425 k = 0.0000 0.3662 0.3082 ( 4604 PWs) bands (ev): -2.8584 -2.8584 -2.8584 -2.8584 -2.4063 -2.4063 -2.4063 -2.4063 4.5142 4.5142 4.5142 4.5142 5.5518 5.5518 5.5518 5.5518 6.4487 6.4487 6.4487 6.4487 7.6759 7.6759 7.6759 7.6759 8.1794 8.1794 8.1794 8.1794 8.1925 8.1925 8.1925 8.1925 8.3275 8.3275 8.3275 8.3275 8.7165 8.7165 8.7165 8.7165 9.6924 9.6924 9.6924 9.6924 10.7999 10.7999 10.7999 10.7999 11.5425 11.5425 k = 0.0000 0.3540 0.3082 ( 4606 PWs) bands (ev): -2.8678 -2.8678 -2.8678 -2.8678 -2.3955 -2.3955 -2.3955 -2.3955 4.5106 4.5106 4.5106 4.5106 5.5562 5.5562 5.5562 5.5562 6.4489 6.4489 6.4489 6.4489 7.6699 7.6699 7.6699 7.6699 8.1580 8.1580 8.1580 8.1580 8.2058 8.2058 8.2058 8.2058 8.3321 8.3321 8.3321 8.3321 8.7154 8.7154 8.7154 8.7154 9.6958 9.6958 9.6958 9.6958 10.8024 10.8024 10.8024 10.8024 11.5446 11.5446 k = 0.0000 0.3417 0.3082 ( 4594 PWs) bands (ev): -2.8934 -2.8934 -2.8934 -2.8934 -2.3653 -2.3653 -2.3653 -2.3653 4.5000 4.5000 4.5000 4.5000 5.5691 5.5691 5.5691 5.5691 6.4496 6.4496 6.4496 6.4496 7.6520 7.6520 7.6520 7.6520 8.1281 8.1281 8.1281 8.1281 8.2124 8.2124 8.2124 8.2124 8.3456 8.3456 8.3456 8.3456 8.7125 8.7125 8.7125 8.7125 9.7057 9.7057 9.7057 9.7057 10.8100 10.8100 10.8100 10.8100 11.5508 11.5508 k = 0.0000 0.3295 0.3082 ( 4598 PWs) bands (ev): -2.9303 -2.9303 -2.9303 -2.9303 -2.3208 -2.3208 -2.3208 -2.3208 4.4829 4.4829 4.4829 4.4829 5.5900 5.5900 5.5900 5.5900 6.4506 6.4506 6.4506 6.4506 7.6210 7.6210 7.6210 7.6210 8.0987 8.0987 8.0987 8.0987 8.2075 8.2075 8.2075 8.2075 8.3651 8.3651 8.3651 8.3651 8.7085 8.7085 8.7085 8.7085 9.7209 9.7209 9.7209 9.7209 10.8225 10.8225 10.8225 10.8225 11.5606 11.5606 k = 0.0000 0.3173 0.3082 ( 4590 PWs) bands (ev): -2.9739 -2.9739 -2.9739 -2.9739 -2.2666 -2.2666 -2.2666 -2.2666 4.4603 4.4603 4.4603 4.4603 5.6177 5.6177 5.6177 5.6177 6.4520 6.4520 6.4520 6.4520 7.5766 7.5766 7.5766 7.5766 8.0724 8.0724 8.0724 8.0724 8.1938 8.1938 8.1938 8.1938 8.3870 8.3870 8.3870 8.3870 8.7045 8.7045 8.7045 8.7045 9.7401 9.7401 9.7401 9.7401 10.8397 10.8397 10.8397 10.8397 11.5734 11.5734 k = 0.0000 0.3051 0.3082 ( 4590 PWs) bands (ev): -3.0212 -3.0212 -3.0212 -3.0212 -2.2059 -2.2059 -2.2059 -2.2059 4.4331 4.4331 4.4331 4.4331 5.6512 5.6512 5.6512 5.6512 6.4538 6.4538 6.4538 6.4538 7.5189 7.5189 7.5189 7.5189 8.0503 8.0503 8.0503 8.0503 8.1745 8.1745 8.1745 8.1745 8.4084 8.4084 8.4084 8.4084 8.7014 8.7014 8.7014 8.7014 9.7616 9.7616 9.7616 9.7616 10.8615 10.8615 10.8615 10.8615 11.5883 11.5883 k = 0.0000 0.2929 0.3082 ( 4592 PWs) bands (ev): -3.0700 -3.0700 -3.0700 -3.0700 -2.1408 -2.1408 -2.1408 -2.1408 4.4022 4.4022 4.4022 4.4022 5.6892 5.6892 5.6892 5.6892 6.4558 6.4558 6.4558 6.4558 7.4494 7.4494 7.4494 7.4494 8.0321 8.0321 8.0321 8.0321 8.1524 8.1524 8.1524 8.1524 8.4276 8.4276 8.4276 8.4276 8.7000 8.7000 8.7000 8.7000 9.7842 9.7842 9.7842 9.7842 10.8874 10.8874 10.8874 10.8874 11.6043 11.6043 k = 0.0000 0.2807 0.3082 ( 4590 PWs) bands (ev): -3.1192 -3.1192 -3.1192 -3.1192 -2.0726 -2.0726 -2.0726 -2.0726 4.3686 4.3686 4.3686 4.3686 5.7306 5.7306 5.7306 5.7306 6.4581 6.4581 6.4581 6.4581 7.3700 7.3700 7.3700 7.3700 8.0158 8.0158 8.0158 8.0158 8.1301 8.1301 8.1301 8.1301 8.4439 8.4439 8.4439 8.4439 8.7006 8.7006 8.7006 8.7006 9.8067 9.8067 9.8067 9.8067 10.9173 10.9173 10.9173 10.9173 11.6203 11.6203 k = 0.0000 0.2685 0.3082 ( 4602 PWs) bands (ev): -3.1679 -3.1679 -3.1679 -3.1679 -2.0022 -2.0022 -2.0022 -2.0022 4.3331 4.3331 4.3331 4.3331 5.7740 5.7740 5.7740 5.7740 6.4605 6.4605 6.4605 6.4605 7.2832 7.2832 7.2832 7.2832 7.9988 7.9988 7.9988 7.9988 8.1107 8.1107 8.1107 8.1107 8.4570 8.4570 8.4570 8.4570 8.7033 8.7033 8.7033 8.7033 9.8282 9.8282 9.8282 9.8282 10.9507 10.9507 10.9507 10.9507 11.6354 11.6354 k = 0.0000 0.2563 0.3082 ( 4602 PWs) bands (ev): -3.2158 -3.2158 -3.2158 -3.2158 -1.9304 -1.9304 -1.9304 -1.9304 4.2963 4.2963 4.2963 4.2963 5.8183 5.8183 5.8183 5.8183 6.4629 6.4629 6.4629 6.4629 7.1917 7.1917 7.1917 7.1917 7.9783 7.9783 7.9783 7.9783 8.0971 8.0971 8.0971 8.0971 8.4671 8.4671 8.4671 8.4671 8.7081 8.7081 8.7081 8.7081 9.8480 9.8480 9.8480 9.8480 10.9873 10.9873 10.9873 10.9873 11.6486 11.6486 k = 0.0000 0.2441 0.3082 ( 4606 PWs) bands (ev): -3.2623 -3.2623 -3.2623 -3.2623 -1.8576 -1.8576 -1.8576 -1.8576 4.2587 4.2587 4.2587 4.2587 5.8619 5.8619 5.8619 5.8619 6.4651 6.4651 6.4651 6.4651 7.0981 7.0981 7.0981 7.0981 7.9531 7.9531 7.9531 7.9531 8.0906 8.0906 8.0906 8.0906 8.4744 8.4744 8.4744 8.4744 8.7144 8.7144 8.7144 8.7144 9.8660 9.8660 9.8660 9.8660 11.0265 11.0265 11.0265 11.0265 11.6594 11.6594 k = 0.0000 0.2319 0.3082 ( 4608 PWs) bands (ev): -3.3072 -3.3072 -3.3072 -3.3072 -1.7843 -1.7843 -1.7843 -1.7843 4.2209 4.2209 4.2209 4.2209 5.9034 5.9034 5.9034 5.9034 6.4670 6.4670 6.4670 6.4670 7.0052 7.0052 7.0052 7.0052 7.9239 7.9239 7.9239 7.9239 8.0904 8.0904 8.0904 8.0904 8.4794 8.4794 8.4794 8.4794 8.7218 8.7218 8.7218 8.7218 9.8818 9.8818 9.8818 9.8818 11.0678 11.0678 11.0678 11.0678 11.6673 11.6673 k = 0.0000 0.2197 0.3082 ( 4608 PWs) bands (ev): -3.3504 -3.3504 -3.3504 -3.3504 -1.7108 -1.7108 -1.7108 -1.7108 4.1832 4.1832 4.1832 4.1832 5.9406 5.9406 5.9406 5.9406 6.4682 6.4682 6.4682 6.4682 6.9162 6.9162 6.9162 6.9162 7.8922 7.8922 7.8922 7.8922 8.0952 8.0952 8.0952 8.0952 8.4824 8.4824 8.4824 8.4824 8.7299 8.7299 8.7299 8.7299 9.8954 9.8954 9.8954 9.8954 11.1105 11.1105 11.1105 11.1105 11.6723 11.6723 k = 0.0000 0.2075 0.3082 ( 4612 PWs) bands (ev): -3.3917 -3.3917 -3.3917 -3.3917 -1.6377 -1.6377 -1.6377 -1.6377 4.1459 4.1459 4.1459 4.1459 5.9710 5.9710 5.9710 5.9710 6.4684 6.4684 6.4684 6.4684 6.8346 6.8346 6.8346 6.8346 7.8594 7.8594 7.8594 7.8594 8.1036 8.1036 8.1036 8.1036 8.4840 8.4840 8.4840 8.4840 8.7384 8.7384 8.7384 8.7384 9.9070 9.9070 9.9070 9.9070 11.1538 11.1538 11.1538 11.1538 11.6748 11.6748 k = 0.0000 0.1953 0.3082 ( 4610 PWs) bands (ev): -3.4310 -3.4310 -3.4310 -3.4310 -1.5652 -1.5652 -1.5652 -1.5652 4.1094 4.1094 4.1094 4.1094 5.9908 5.9908 5.9908 5.9908 6.4677 6.4677 6.4677 6.4677 6.7647 6.7647 6.7647 6.7647 7.8262 7.8262 7.8262 7.8262 8.1150 8.1150 8.1150 8.1150 8.4846 8.4846 8.4846 8.4846 8.7468 8.7468 8.7468 8.7468 9.9166 9.9166 9.9166 9.9166 11.1969 11.1969 11.1969 11.1969 11.6752 11.6752 k = 0.0000 0.1831 0.3082 ( 4604 PWs) bands (ev): -3.4683 -3.4683 -3.4683 -3.4683 -1.4937 -1.4937 -1.4937 -1.4937 4.0737 4.0737 4.0737 4.0737 5.9961 5.9961 5.9961 5.9961 6.4670 6.4670 6.4670 6.4670 6.7100 6.7100 6.7100 6.7100 7.7932 7.7932 7.7932 7.7932 8.1288 8.1288 8.1288 8.1288 8.4845 8.4845 8.4845 8.4845 8.7549 8.7549 8.7549 8.7549 9.9243 9.9243 9.9243 9.9243 11.2384 11.2384 11.2384 11.2384 11.6747 11.6747 k = 0.0000 0.1709 0.3082 ( 4604 PWs) bands (ev): -3.5033 -3.5033 -3.5033 -3.5033 -1.4238 -1.4238 -1.4238 -1.4238 4.0392 4.0392 4.0392 4.0392 5.9834 5.9834 5.9834 5.9834 6.4685 6.4685 6.4685 6.4685 6.6724 6.6724 6.6724 6.6724 7.7609 7.7609 7.7609 7.7609 8.1444 8.1444 8.1444 8.1444 8.4839 8.4839 8.4839 8.4839 8.7627 8.7627 8.7627 8.7627 9.9303 9.9303 9.9303 9.9303 11.2768 11.2768 11.2768 11.2768 11.6746 11.6746 k = 0.0000 0.1587 0.3082 ( 4606 PWs) bands (ev): -3.5361 -3.5361 -3.5361 -3.5361 -1.3557 -1.3557 -1.3557 -1.3557 4.0059 4.0059 4.0059 4.0059 5.9522 5.9522 5.9522 5.9522 6.4743 6.4743 6.4743 6.4743 6.6503 6.6503 6.6503 6.6503 7.7296 7.7296 7.7296 7.7296 8.1617 8.1617 8.1617 8.1617 8.4831 8.4831 8.4831 8.4831 8.7698 8.7698 8.7698 8.7698 9.9347 9.9347 9.9347 9.9347 11.3103 11.3103 11.3103 11.3103 11.6767 11.6767 k = 0.0000 0.1465 0.3082 ( 4602 PWs) bands (ev): -3.5667 -3.5667 -3.5667 -3.5667 -1.2899 -1.2899 -1.2899 -1.2899 3.9741 3.9741 3.9741 3.9741 5.9058 5.9058 5.9058 5.9058 6.4853 6.4853 6.4853 6.4853 6.6402 6.6402 6.6402 6.6402 7.6997 7.6997 7.6997 7.6997 8.1801 8.1801 8.1801 8.1801 8.4823 8.4823 8.4823 8.4823 8.7764 8.7764 8.7764 8.7764 9.9377 9.9377 9.9377 9.9377 11.3369 11.3369 11.3369 11.3369 11.6831 11.6831 k = 0.0000 0.1343 0.3082 ( 4596 PWs) bands (ev): -3.5949 -3.5949 -3.5949 -3.5949 -1.2269 -1.2269 -1.2269 -1.2269 3.9439 3.9439 3.9439 3.9439 5.8494 5.8494 5.8494 5.8494 6.4999 6.4999 6.4999 6.4999 6.6388 6.6388 6.6388 6.6388 7.6712 7.6712 7.6712 7.6712 8.1993 8.1993 8.1993 8.1993 8.4818 8.4818 8.4818 8.4818 8.7824 8.7824 8.7824 8.7824 9.9395 9.9395 9.9395 9.9395 11.3549 11.3549 11.3549 11.3549 11.6953 11.6953 k = 0.0000 0.1221 0.3082 ( 4594 PWs) bands (ev): -3.6208 -3.6208 -3.6208 -3.6208 -1.1671 -1.1671 -1.1671 -1.1671 3.9155 3.9155 3.9155 3.9155 5.7879 5.7879 5.7879 5.7879 6.5158 6.5158 6.5158 6.5158 6.6436 6.6436 6.6436 6.6436 7.6444 7.6444 7.6444 7.6444 8.2189 8.2189 8.2189 8.2189 8.4815 8.4815 8.4815 8.4815 8.7876 8.7876 8.7876 8.7876 9.9403 9.9403 9.9403 9.9403 11.3639 11.3639 11.3639 11.3639 11.7139 11.7139 k = 0.0000 0.1098 0.3082 ( 4602 PWs) bands (ev): -3.6443 -3.6443 -3.6443 -3.6443 -1.1110 -1.1110 -1.1110 -1.1110 3.8889 3.8889 3.8889 3.8889 5.7254 5.7254 5.7254 5.7254 6.5312 6.5312 6.5312 6.5312 6.6529 6.6529 6.6529 6.6529 7.6195 7.6195 7.6195 7.6195 8.2383 8.2383 8.2383 8.2383 8.4818 8.4818 8.4818 8.4818 8.7922 8.7922 8.7922 8.7922 9.9401 9.9401 9.9401 9.9401 11.3648 11.3648 11.3648 11.3648 11.7377 11.7377 k = 0.0000 0.0976 0.3082 ( 4594 PWs) bands (ev): -3.6654 -3.6654 -3.6654 -3.6654 -1.0592 -1.0592 -1.0592 -1.0592 3.8645 3.8645 3.8645 3.8645 5.6647 5.6647 5.6647 5.6647 6.5448 6.5448 6.5448 6.5448 6.6652 6.6652 6.6652 6.6652 7.5968 7.5968 7.5968 7.5968 8.2570 8.2570 8.2570 8.2570 8.4829 8.4829 8.4829 8.4829 8.7963 8.7963 8.7963 8.7963 9.9392 9.9392 9.9392 9.9392 11.3597 11.3597 11.3597 11.3597 11.7650 11.7650 k = 0.0000 0.0854 0.3082 ( 4592 PWs) bands (ev): -3.6840 -3.6840 -3.6840 -3.6840 -1.0120 -1.0120 -1.0120 -1.0120 3.8423 3.8423 3.8423 3.8423 5.6079 5.6079 5.6079 5.6079 6.5563 6.5563 6.5563 6.5563 6.6791 6.6791 6.6791 6.6791 7.5762 7.5762 7.5762 7.5762 8.2745 8.2745 8.2745 8.2745 8.4846 8.4846 8.4846 8.4846 8.7997 8.7997 8.7997 8.7997 9.9378 9.9378 9.9378 9.9378 11.3505 11.3505 11.3505 11.3505 11.7937 11.7937 k = 0.0000 0.0732 0.3082 ( 4598 PWs) bands (ev): -3.7002 -3.7002 -3.7002 -3.7002 -0.9700 -0.9700 -0.9700 -0.9700 3.8226 3.8226 3.8226 3.8226 5.5565 5.5565 5.5565 5.5565 6.5657 6.5657 6.5657 6.5657 6.6934 6.6934 6.6934 6.6934 7.5580 7.5580 7.5580 7.5580 8.2903 8.2903 8.2903 8.2903 8.4871 8.4871 8.4871 8.4871 8.8025 8.8025 8.8025 8.8025 9.9360 9.9360 9.9360 9.9360 11.3393 11.3393 11.3393 11.3393 11.8218 11.8218 k = 0.0000 0.0610 0.3082 ( 4606 PWs) bands (ev): -3.7140 -3.7140 -3.7140 -3.7140 -0.9335 -0.9335 -0.9335 -0.9335 3.8055 3.8055 3.8055 3.8055 5.5115 5.5115 5.5115 5.5115 6.5733 6.5733 6.5733 6.5733 6.7069 6.7069 6.7069 6.7069 7.5424 7.5424 7.5424 7.5424 8.3038 8.3038 8.3038 8.3038 8.4902 8.4902 8.4902 8.4902 8.8049 8.8049 8.8049 8.8049 9.9340 9.9340 9.9340 9.9340 11.3275 11.3275 11.3275 11.3275 11.8478 11.8478 k = 0.0000 0.0488 0.3082 ( 4602 PWs) bands (ev): -3.7252 -3.7252 -3.7252 -3.7252 -0.9031 -0.9031 -0.9031 -0.9031 3.7912 3.7912 3.7912 3.7912 5.4737 5.4737 5.4737 5.4737 6.5793 6.5793 6.5793 6.5793 6.7188 6.7188 6.7188 6.7188 7.5294 7.5294 7.5294 7.5294 8.3149 8.3149 8.3149 8.3149 8.4938 8.4938 8.4938 8.4938 8.8067 8.8067 8.8067 8.8067 9.9320 9.9320 9.9320 9.9320 11.3163 11.3163 11.3163 11.3163 11.8706 11.8706 k = 0.0000 0.0366 0.3082 ( 4598 PWs) bands (ev): -3.7340 -3.7340 -3.7340 -3.7340 -0.8790 -0.8790 -0.8790 -0.8790 3.7798 3.7798 3.7798 3.7798 5.4437 5.4437 5.4437 5.4437 6.5839 6.5839 6.5839 6.5839 6.7285 6.7285 6.7285 6.7285 7.5192 7.5192 7.5192 7.5192 8.3235 8.3235 8.3235 8.3235 8.4972 8.4972 8.4972 8.4972 8.8080 8.8080 8.8080 8.8080 9.9303 9.9303 9.9303 9.9303 11.3068 11.3068 11.3068 11.3068 11.8892 11.8892 k = 0.0000 0.0244 0.3082 ( 4610 PWs) bands (ev): -3.7403 -3.7403 -3.7403 -3.7403 -0.8616 -0.8616 -0.8616 -0.8616 3.7716 3.7716 3.7716 3.7716 5.4221 5.4221 5.4221 5.4221 6.5871 6.5871 6.5871 6.5871 6.7357 6.7357 6.7357 6.7357 7.5118 7.5118 7.5118 7.5118 8.3294 8.3294 8.3294 8.3294 8.5001 8.5001 8.5001 8.5001 8.8090 8.8090 8.8090 8.8090 9.9289 9.9289 9.9289 9.9289 11.2994 11.2994 11.2994 11.2994 11.9030 11.9030 k = 0.0000 0.0122 0.3082 ( 4614 PWs) bands (ev): -3.7440 -3.7440 -3.7440 -3.7440 -0.8510 -0.8510 -0.8510 -0.8510 3.7667 3.7667 3.7667 3.7667 5.4089 5.4089 5.4089 5.4089 6.5890 6.5890 6.5890 6.5890 6.7401 6.7401 6.7401 6.7401 7.5073 7.5073 7.5073 7.5073 8.3330 8.3330 8.3330 8.3330 8.5021 8.5021 8.5021 8.5021 8.8095 8.8095 8.8095 8.8095 9.9281 9.9281 9.9281 9.9281 11.2948 11.2948 11.2948 11.2948 11.9114 11.9114 k = 0.0000 0.0000 0.3082 ( 4590 PWs) bands (ev): -3.7453 -3.7453 -3.7453 -3.7453 -0.8475 -0.8475 -0.8475 -0.8475 3.7650 3.7650 3.7650 3.7650 5.4046 5.4046 5.4046 5.4046 6.5897 6.5897 6.5897 6.5897 6.7416 6.7416 6.7416 6.7416 7.5059 7.5059 7.5059 7.5059 8.3342 8.3342 8.3342 8.3342 8.5028 8.5028 8.5028 8.5028 8.8098 8.8098 8.8098 8.8098 9.9278 9.9278 9.9278 9.9278 11.2933 11.2933 11.2933 11.2933 11.9143 11.9143 k = 0.0000 0.3662-0.0000 ( 4586 PWs) bands (ev): -3.3574 -3.3574 -3.3574 -3.3574 -1.5672 -1.5672 -1.5672 -1.5672 3.1084 3.1084 3.1084 3.1084 6.4512 6.4512 6.4512 6.4512 6.7070 6.7070 6.7070 6.7070 7.0070 7.0070 7.0070 7.0070 7.7557 7.7557 7.7557 7.7557 8.4160 8.4160 8.4160 8.4160 8.5457 8.5457 8.5457 8.5457 9.1294 9.1294 9.1294 9.1294 10.5687 10.5687 10.5687 10.5687 11.0449 11.0449 11.0449 11.0449 11.5225 11.5225 k = 0.0000 0.3662 0.0123 ( 4586 PWs) bands (ev): -3.3563 -3.3563 -3.3563 -3.3563 -1.5699 -1.5699 -1.5699 -1.5699 3.1126 3.1126 3.1126 3.1126 6.4507 6.4507 6.4507 6.4507 6.6997 6.6997 6.6997 6.6997 7.0150 7.0150 7.0150 7.0150 7.7569 7.7569 7.7569 7.7569 8.4155 8.4155 8.4155 8.4155 8.5430 8.5430 8.5430 8.5430 9.1279 9.1279 9.1279 9.1279 10.5678 10.5678 10.5678 10.5678 11.0437 11.0437 11.0437 11.0437 11.5206 11.5206 k = 0.0000 0.3662 0.0247 ( 4586 PWs) bands (ev): -3.3529 -3.3529 -3.3529 -3.3529 -1.5779 -1.5779 -1.5779 -1.5779 3.1251 3.1251 3.1251 3.1251 6.4492 6.4492 6.4492 6.4492 6.6798 6.6798 6.6798 6.6798 7.0370 7.0370 7.0370 7.0370 7.7605 7.7605 7.7605 7.7605 8.4139 8.4139 8.4139 8.4139 8.5351 8.5351 8.5351 8.5351 9.1235 9.1235 9.1235 9.1235 10.5651 10.5651 10.5651 10.5651 11.0404 11.0404 11.0404 11.0404 11.5152 11.5152 k = 0.0000 0.3662 0.0370 ( 4600 PWs) bands (ev): -3.3472 -3.3472 -3.3472 -3.3472 -1.5911 -1.5911 -1.5911 -1.5911 3.1458 3.1458 3.1458 3.1458 6.4464 6.4464 6.4464 6.4464 6.6514 6.6514 6.6514 6.6514 7.0690 7.0690 7.0690 7.0690 7.7663 7.7663 7.7663 7.7663 8.4107 8.4107 8.4107 8.4107 8.5226 8.5226 8.5226 8.5226 9.1162 9.1162 9.1162 9.1162 10.5602 10.5602 10.5602 10.5602 11.0347 11.0347 11.0347 11.0347 11.5067 11.5067 k = 0.0000 0.3662 0.0493 ( 4592 PWs) bands (ev): -3.3393 -3.3393 -3.3393 -3.3393 -1.6094 -1.6094 -1.6094 -1.6094 3.1744 3.1744 3.1744 3.1744 6.4419 6.4419 6.4419 6.4419 6.6186 6.6186 6.6186 6.6186 7.1075 7.1075 7.1075 7.1075 7.7746 7.7746 7.7746 7.7746 8.4050 8.4050 8.4050 8.4050 8.5070 8.5070 8.5070 8.5070 9.1061 9.1061 9.1061 9.1061 10.5526 10.5526 10.5526 10.5526 11.0268 11.0268 11.0268 11.0268 11.4961 11.4961 k = 0.0000 0.3662 0.0616 ( 4596 PWs) bands (ev): -3.3292 -3.3292 -3.3292 -3.3292 -1.6324 -1.6324 -1.6324 -1.6324 3.2107 3.2107 3.2107 3.2107 6.4347 6.4347 6.4347 6.4347 6.5843 6.5843 6.5843 6.5843 7.1503 7.1503 7.1503 7.1503 7.7851 7.7851 7.7851 7.7851 8.3951 8.3951 8.3951 8.3951 8.4903 8.4903 8.4903 8.4903 9.0932 9.0932 9.0932 9.0932 10.5416 10.5416 10.5416 10.5416 11.0164 11.0164 11.0164 11.0164 11.4844 11.4844 k = 0.0000 0.3662 0.0740 ( 4592 PWs) bands (ev): -3.3169 -3.3169 -3.3169 -3.3169 -1.6599 -1.6599 -1.6599 -1.6599 3.2543 3.2543 3.2543 3.2543 6.4228 6.4228 6.4228 6.4228 6.5516 6.5516 6.5516 6.5516 7.1959 7.1959 7.1959 7.1959 7.7978 7.7978 7.7978 7.7978 8.3788 8.3788 8.3788 8.3788 8.4755 8.4755 8.4755 8.4755 9.0776 9.0776 9.0776 9.0776 10.5265 10.5265 10.5265 10.5265 11.0037 11.0037 11.0037 11.0037 11.4730 11.4730 k = 0.0000 0.3662 0.0863 ( 4590 PWs) bands (ev): -3.3024 -3.3024 -3.3024 -3.3024 -1.6915 -1.6915 -1.6915 -1.6915 3.3047 3.3047 3.3047 3.3047 6.4037 6.4037 6.4037 6.4037 6.5240 6.5240 6.5240 6.5240 7.2434 7.2434 7.2434 7.2434 7.8125 7.8125 7.8125 7.8125 8.3548 8.3548 8.3548 8.3548 8.4647 8.4647 8.4647 8.4647 9.0596 9.0596 9.0596 9.0596 10.5065 10.5065 10.5065 10.5065 10.9889 10.9889 10.9889 10.9889 11.4629 11.4629 k = 0.0000 0.3662 0.0986 ( 4592 PWs) bands (ev): -3.2858 -3.2858 -3.2858 -3.2858 -1.7268 -1.7268 -1.7268 -1.7268 3.3614 3.3614 3.3614 3.3614 6.3752 6.3752 6.3752 6.3752 6.5038 6.5038 6.5038 6.5038 7.2923 7.2923 7.2923 7.2923 7.8292 7.8292 7.8292 7.8292 8.3239 8.3239 8.3239 8.3239 8.4577 8.4577 8.4577 8.4577 9.0392 9.0392 9.0392 9.0392 10.4807 10.4807 10.4807 10.4807 10.9724 10.9724 10.9724 10.9724 11.4550 11.4550 k = 0.0000 0.3662 0.1109 ( 4594 PWs) bands (ev): -3.2671 -3.2671 -3.2671 -3.2671 -1.7654 -1.7654 -1.7654 -1.7654 3.4240 3.4240 3.4240 3.4240 6.3381 6.3381 6.3381 6.3381 6.4904 6.4904 6.4904 6.4904 7.3420 7.3420 7.3420 7.3420 7.8475 7.8475 7.8475 7.8475 8.2885 8.2885 8.2885 8.2885 8.4533 8.4533 8.4533 8.4533 9.0166 9.0166 9.0166 9.0166 10.4487 10.4487 10.4487 10.4487 10.9549 10.9549 10.9549 10.9549 11.4499 11.4499 k = 0.0000 0.3662 0.1233 ( 4594 PWs) bands (ev): -3.2463 -3.2463 -3.2463 -3.2463 -1.8069 -1.8069 -1.8069 -1.8069 3.4918 3.4918 3.4918 3.4918 6.2947 6.2947 6.2947 6.2947 6.4816 6.4816 6.4816 6.4816 7.3922 7.3922 7.3922 7.3922 7.8674 7.8674 7.8674 7.8674 8.2505 8.2505 8.2505 8.2505 8.4505 8.4505 8.4505 8.4505 8.9921 8.9921 8.9921 8.9921 10.4103 10.4103 10.4103 10.4103 10.9370 10.9370 10.9370 10.9370 11.4480 11.4480 k = 0.0000 0.3662 0.1356 ( 4590 PWs) bands (ev): -3.2236 -3.2236 -3.2236 -3.2236 -1.8509 -1.8509 -1.8509 -1.8509 3.5643 3.5643 3.5643 3.5643 6.2469 6.2469 6.2469 6.2469 6.4753 6.4753 6.4753 6.4753 7.4423 7.4423 7.4423 7.4423 7.8882 7.8882 7.8882 7.8882 8.2120 8.2120 8.2120 8.2120 8.4485 8.4485 8.4485 8.4485 8.9659 8.9659 8.9659 8.9659 10.3655 10.3655 10.3655 10.3655 10.9194 10.9194 10.9194 10.9194 11.4490 11.4490 k = 0.0000 0.3662 0.1479 ( 4586 PWs) bands (ev): -3.1991 -3.1991 -3.1991 -3.1991 -1.8968 -1.8968 -1.8968 -1.8968 3.6407 3.6407 3.6407 3.6407 6.1958 6.1958 6.1958 6.1958 6.4706 6.4706 6.4706 6.4706 7.4917 7.4917 7.4917 7.4917 7.9092 7.9092 7.9092 7.9092 8.1750 8.1750 8.1750 8.1750 8.4470 8.4470 8.4470 8.4470 8.9383 8.9383 8.9383 8.9383 10.3149 10.3149 10.3149 10.3149 10.9026 10.9026 10.9026 10.9026 11.4528 11.4528 k = 0.0000 0.3662 0.1603 ( 4584 PWs) bands (ev): -3.1727 -3.1727 -3.1727 -3.1727 -1.9444 -1.9444 -1.9444 -1.9444 3.7205 3.7205 3.7205 3.7205 6.1420 6.1420 6.1420 6.1420 6.4669 6.4669 6.4669 6.4669 7.5398 7.5398 7.5398 7.5398 7.9291 7.9291 7.9291 7.9291 8.1421 8.1421 8.1421 8.1421 8.4455 8.4455 8.4455 8.4455 8.9098 8.9098 8.9098 8.9098 10.2592 10.2592 10.2592 10.2592 10.8869 10.8869 10.8869 10.8869 11.4588 11.4588 k = 0.0000 0.3662 0.1726 ( 4588 PWs) bands (ev): -3.1447 -3.1447 -3.1447 -3.1447 -1.9930 -1.9930 -1.9930 -1.9930 3.8029 3.8029 3.8029 3.8029 6.0859 6.0859 6.0859 6.0859 6.4637 6.4637 6.4637 6.4637 7.5853 7.5853 7.5853 7.5853 7.9460 7.9460 7.9460 7.9460 8.1166 8.1166 8.1166 8.1166 8.4438 8.4438 8.4438 8.4438 8.8808 8.8808 8.8808 8.8808 10.1996 10.1996 10.1996 10.1996 10.8725 10.8725 10.8725 10.8725 11.4665 11.4665 k = 0.0000 0.3662 0.1849 ( 4588 PWs) bands (ev): -3.1153 -3.1153 -3.1153 -3.1153 -2.0423 -2.0423 -2.0423 -2.0423 3.8870 3.8870 3.8870 3.8870 6.0277 6.0277 6.0277 6.0277 6.4610 6.4610 6.4610 6.4610 7.6268 7.6268 7.6268 7.6268 7.9573 7.9573 7.9573 7.9573 8.1029 8.1029 8.1029 8.1029 8.4415 8.4415 8.4415 8.4415 8.8518 8.8518 8.8518 8.8518 10.1373 10.1373 10.1373 10.1373 10.8595 10.8595 10.8595 10.8595 11.4754 11.4754 k = 0.0000 0.3662 0.1972 ( 4590 PWs) bands (ev): -3.0846 -3.0846 -3.0846 -3.0846 -2.0918 -2.0918 -2.0918 -2.0918 3.9721 3.9721 3.9721 3.9721 5.9679 5.9679 5.9679 5.9679 6.4586 6.4586 6.4586 6.4586 7.6620 7.6620 7.6620 7.6620 7.9629 7.9629 7.9629 7.9629 8.1031 8.1031 8.1031 8.1031 8.4381 8.4381 8.4381 8.4381 8.8237 8.8237 8.8237 8.8237 10.0738 10.0738 10.0738 10.0738 10.8478 10.8478 10.8478 10.8478 11.4850 11.4850 k = 0.0000 0.3662 0.2096 ( 4590 PWs) bands (ev): -3.0529 -3.0529 -3.0529 -3.0529 -2.1409 -2.1409 -2.1409 -2.1409 4.0571 4.0571 4.0571 4.0571 5.9069 5.9069 5.9069 5.9069 6.4565 6.4565 6.4565 6.4565 7.6879 7.6879 7.6879 7.6879 7.9682 7.9682 7.9682 7.9682 8.1146 8.1146 8.1146 8.1146 8.4333 8.4333 8.4333 8.4333 8.7973 8.7973 8.7973 8.7973 10.0103 10.0103 10.0103 10.0103 10.8376 10.8376 10.8376 10.8376 11.4949 11.4949 k = 0.0000 0.3662 0.2219 ( 4590 PWs) bands (ev): -3.0206 -3.0206 -3.0206 -3.0206 -2.1891 -2.1891 -2.1891 -2.1891 4.1408 4.1408 4.1408 4.1408 5.8455 5.8455 5.8455 5.8455 6.4547 6.4547 6.4547 6.4547 7.7026 7.7026 7.7026 7.7026 7.9797 7.9797 7.9797 7.9797 8.1322 8.1322 8.1322 8.1322 8.4262 8.4262 8.4262 8.4262 8.7737 8.7737 8.7737 8.7737 9.9483 9.9483 9.9483 9.9483 10.8286 10.8286 10.8286 10.8286 11.5046 11.5046 k = 0.0000 0.3662 0.2342 ( 4586 PWs) bands (ev): -2.9882 -2.9882 -2.9882 -2.9882 -2.2356 -2.2356 -2.2356 -2.2356 4.2217 4.2217 4.2217 4.2217 5.7847 5.7847 5.7847 5.7847 6.4531 6.4531 6.4531 6.4531 7.7067 7.7067 7.7067 7.7067 8.0005 8.0005 8.0005 8.0005 8.1517 8.1517 8.1517 8.1517 8.4162 8.4162 8.4162 8.4162 8.7537 8.7537 8.7537 8.7537 9.8893 9.8893 9.8893 9.8893 10.8209 10.8209 10.8209 10.8209 11.5137 11.5137 k = 0.0000 0.3662 0.2466 ( 4594 PWs) bands (ev): -2.9565 -2.9565 -2.9565 -2.9565 -2.2795 -2.2795 -2.2795 -2.2795 4.2981 4.2981 4.2981 4.2981 5.7260 5.7260 5.7260 5.7260 6.4518 6.4518 6.4518 6.4518 7.7032 7.7032 7.7032 7.7032 8.0289 8.0289 8.0289 8.0289 8.1705 8.1705 8.1705 8.1705 8.4028 8.4028 8.4028 8.4028 8.7382 8.7382 8.7382 8.7382 9.8350 9.8350 9.8350 9.8350 10.8144 10.8144 10.8144 10.8144 11.5219 11.5219 k = 0.0000 0.3662 0.2589 ( 4590 PWs) bands (ev): -2.9265 -2.9265 -2.9265 -2.9265 -2.3197 -2.3197 -2.3197 -2.3197 4.3676 4.3676 4.3676 4.3676 5.6713 5.6713 5.6713 5.6713 6.4507 6.4507 6.4507 6.4507 7.6962 7.6962 7.6962 7.6962 8.0620 8.0620 8.0620 8.0620 8.1867 8.1867 8.1867 8.1867 8.3861 8.3861 8.3861 8.3861 8.7275 8.7275 8.7275 8.7275 9.7872 9.7872 9.7872 9.7872 10.8092 10.8092 10.8092 10.8092 11.5291 11.5291 k = 0.0000 0.3662 0.2712 ( 4602 PWs) bands (ev): -2.8997 -2.8997 -2.8997 -2.8997 -2.3546 -2.3546 -2.3546 -2.3546 4.4273 4.4273 4.4273 4.4273 5.6233 5.6233 5.6233 5.6233 6.4498 6.4498 6.4498 6.4498 7.6884 7.6884 7.6884 7.6884 8.0968 8.0968 8.0968 8.0968 8.1984 8.1984 8.1984 8.1984 8.3670 8.3670 8.3670 8.3670 8.7211 8.7211 8.7211 8.7211 9.7474 9.7474 9.7474 9.7474 10.8051 10.8051 10.8051 10.8051 11.5348 11.5348 k = 0.0000 0.3662 0.2835 ( 4594 PWs) bands (ev): -2.8779 -2.8779 -2.8779 -2.8779 -2.3821 -2.3821 -2.3821 -2.3821 4.4740 4.4740 4.4740 4.4740 5.5852 5.5852 5.5852 5.5852 6.4492 6.4492 6.4492 6.4492 7.6817 7.6817 7.6817 7.6817 8.1308 8.1308 8.1308 8.1308 8.2040 8.2040 8.2040 8.2040 8.3481 8.3481 8.3481 8.3481 8.7179 8.7179 8.7179 8.7179 9.7174 9.7174 9.7174 9.7174 10.8022 10.8022 10.8022 10.8022 11.5390 11.5390 k = 0.0000 0.3662 0.2959 ( 4594 PWs) bands (ev): -2.8635 -2.8635 -2.8635 -2.8635 -2.4001 -2.4001 -2.4001 -2.4001 4.5039 4.5039 4.5039 4.5039 5.5604 5.5604 5.5604 5.5604 6.4489 6.4489 6.4489 6.4489 7.6774 7.6774 7.6774 7.6774 8.1609 8.1609 8.1609 8.1609 8.2011 8.2011 8.2011 8.2011 8.3333 8.3333 8.3333 8.3333 8.7167 8.7167 8.7167 8.7167 9.6988 9.6988 9.6988 9.6988 10.8005 10.8005 10.8005 10.8005 11.5416 11.5416 k = 0.0000 0.3662 0.3082 ( 4604 PWs) bands (ev): -2.8584 -2.8584 -2.8584 -2.8584 -2.4063 -2.4063 -2.4063 -2.4063 4.5142 4.5142 4.5142 4.5142 5.5518 5.5518 5.5518 5.5518 6.4487 6.4487 6.4487 6.4487 7.6759 7.6759 7.6759 7.6759 8.1794 8.1794 8.1794 8.1794 8.1925 8.1925 8.1925 8.1925 8.3275 8.3275 8.3275 8.3275 8.7165 8.7165 8.7165 8.7165 9.6924 9.6924 9.6924 9.6924 10.7999 10.7999 10.7999 10.7999 11.5425 11.5425 k = 0.5000-0.0000 0.3082 ( 4628 PWs) bands (ev): -2.7688 -2.7688 -2.7674 -2.7674 -1.1047 -1.1047 -1.0984 -1.0984 3.5070 3.5070 3.5993 3.5993 5.0908 5.0908 5.1221 5.1221 6.0412 6.0412 6.0565 6.0565 6.2140 6.2140 6.3794 6.3794 7.2044 7.2044 7.2260 7.2260 7.6345 7.6345 7.6373 7.6373 8.0128 8.0128 8.0514 8.0514 8.5871 8.5871 8.6158 8.6158 9.3156 9.3156 9.3704 9.3704 10.5112 10.5112 10.5735 10.5735 11.8034 11.8034 k = 0.5000-0.0000 0.2959 ( 4628 PWs) bands (ev): -2.7695 -2.7695 -2.7681 -2.7681 -1.1035 -1.1035 -1.0973 -1.0973 3.5081 3.5081 3.6002 3.6002 5.0894 5.0894 5.1214 5.1214 6.0352 6.0352 6.0565 6.0565 6.2222 6.2222 6.3820 6.3820 7.1922 7.1922 7.2135 7.2135 7.6369 7.6369 7.6391 7.6391 8.0191 8.0191 8.0577 8.0577 8.5871 8.5871 8.6158 8.6158 9.3176 9.3176 9.3722 9.3722 10.5113 10.5113 10.5737 10.5737 11.7991 11.7991 k = 0.5000-0.0000 0.2835 ( 4622 PWs) bands (ev): -2.7715 -2.7715 -2.7701 -2.7701 -1.1000 -1.1000 -1.0938 -1.0938 3.5112 3.5112 3.6028 3.6028 5.0852 5.0852 5.1191 5.1191 6.0202 6.0202 6.0566 6.0566 6.2439 6.2439 6.3897 6.3897 7.1575 7.1575 7.1777 7.1777 7.6431 7.6431 7.6441 7.6441 8.0371 8.0371 8.0755 8.0755 8.5873 8.5873 8.6160 8.6160 9.3237 9.3237 9.3775 9.3775 10.5116 10.5116 10.5741 10.5741 11.7862 11.7862 k = 0.5000-0.0000 0.2712 ( 4622 PWs) bands (ev): -2.7748 -2.7748 -2.7734 -2.7734 -1.0943 -1.0943 -1.0881 -1.0881 3.5163 3.5163 3.6072 3.6072 5.0783 5.0783 5.1154 5.1154 6.0007 6.0007 6.0568 6.0568 6.2742 6.2742 6.4019 6.4019 7.1043 7.1043 7.1234 7.1234 7.6512 7.6512 7.6519 7.6519 8.0638 8.0638 8.1021 8.1021 8.5875 8.5875 8.6162 8.6162 9.3335 9.3335 9.3862 9.3862 10.5121 10.5121 10.5748 10.5748 11.7642 11.7642 k = 0.5000-0.0000 0.2589 ( 4620 PWs) bands (ev): -2.7792 -2.7792 -2.7779 -2.7779 -1.0864 -1.0864 -1.0803 -1.0803 3.5236 3.5236 3.6133 3.6133 5.0690 5.0690 5.1103 5.1103 5.9798 5.9798 6.0574 6.0574 6.3094 6.3094 6.4179 6.4179 7.0376 7.0376 7.0557 7.0557 7.6597 7.6597 7.6623 7.6623 8.0960 8.0960 8.1342 8.1342 8.5878 8.5878 8.6165 8.6165 9.3469 9.3469 9.3981 9.3981 10.5127 10.5127 10.5758 10.5758 11.7329 11.7329 k = 0.5000-0.0000 0.2466 ( 4620 PWs) bands (ev): -2.7848 -2.7848 -2.7835 -2.7835 -1.0765 -1.0765 -1.0705 -1.0705 3.5330 3.5330 3.6212 3.6212 5.0575 5.0575 5.1037 5.1037 5.9592 5.9592 6.0583 6.0583 6.3474 6.3474 6.4365 6.4365 6.9618 6.9618 6.9793 6.9793 7.6691 7.6691 7.6739 7.6739 8.1307 8.1307 8.1688 8.1688 8.5882 8.5882 8.6169 8.6169 9.3637 9.3637 9.4129 9.4129 10.5134 10.5134 10.5771 10.5771 11.6919 11.6919 k = 0.5000-0.0000 0.2342 ( 4618 PWs) bands (ev): -2.7914 -2.7914 -2.7901 -2.7901 -1.0648 -1.0648 -1.0589 -1.0589 3.5446 3.5446 3.6310 3.6310 5.0441 5.0441 5.0959 5.0959 5.9391 5.9391 6.0594 6.0594 6.3863 6.3863 6.4556 6.4556 6.8808 6.8808 6.8986 6.8986 7.6795 7.6795 7.6866 7.6866 8.1657 8.1657 8.2036 8.2036 8.5887 8.5887 8.6174 8.6174 9.3835 9.3835 9.4304 9.4304 10.5142 10.5142 10.5785 10.5785 11.6414 11.6414 k = 0.5000-0.0000 0.2219 ( 4618 PWs) bands (ev): -2.7988 -2.7988 -2.7976 -2.7976 -1.0515 -1.0515 -1.0457 -1.0457 3.5583 3.5583 3.6426 3.6426 5.0291 5.0291 5.0869 5.0869 5.9196 5.9196 6.0607 6.0607 6.4238 6.4238 6.4717 6.4717 6.7991 6.7991 6.8193 6.8193 7.6909 7.6909 7.7004 7.7004 8.1994 8.1994 8.2372 8.2372 8.5892 8.5892 8.6178 8.6178 9.4060 9.4060 9.4502 9.4502 10.5152 10.5152 10.5802 10.5802 11.5818 11.5818 k = 0.5000-0.0000 0.2096 ( 4606 PWs) bands (ev): -2.8069 -2.8069 -2.8057 -2.8057 -1.0369 -1.0369 -1.0312 -1.0312 3.5742 3.5742 3.6562 3.6562 5.0128 5.0128 5.0769 5.0769 5.9000 5.9000 6.0615 6.0615 6.4557 6.4557 6.4773 6.4773 6.7229 6.7229 6.7504 6.7504 7.7033 7.7033 7.7155 7.7155 8.2310 8.2310 8.2686 8.2686 8.5898 8.5898 8.6183 8.6183 9.4308 9.4308 9.4721 9.4721 10.5162 10.5162 10.5821 10.5821 11.5139 11.5139 k = 0.5000-0.0000 0.1972 ( 4608 PWs) bands (ev): -2.8156 -2.8156 -2.8144 -2.8144 -1.0211 -1.0211 -1.0156 -1.0156 3.5924 3.5924 3.6716 3.6716 4.9957 4.9957 5.0660 5.0660 5.8791 5.8791 6.0609 6.0609 6.4591 6.4591 6.4703 6.4703 6.6660 6.6660 6.7066 6.7066 7.7167 7.7167 7.7317 7.7317 8.2600 8.2600 8.2972 8.2972 8.5904 8.5904 8.6188 8.6188 9.4573 9.4573 9.4956 9.4956 10.5172 10.5172 10.5842 10.5842 11.4388 11.4388 k = 0.5000-0.0000 0.1849 ( 4612 PWs) bands (ev): -2.8246 -2.8246 -2.8235 -2.8235 -1.0045 -1.0045 -0.9991 -0.9991 3.6128 3.6128 3.6890 3.6890 4.9779 4.9779 5.0546 5.0546 5.8554 5.8554 6.0573 6.0573 6.4110 6.4110 6.4487 6.4487 6.6492 6.6492 6.6965 6.6965 7.7313 7.7313 7.7491 7.7491 8.2863 8.2863 8.3230 8.3230 8.5911 8.5911 8.6192 8.6192 9.4854 9.4854 9.5205 9.5205 10.5181 10.5181 10.5864 10.5864 11.3578 11.3578 k = 0.5000-0.0000 0.1726 ( 4620 PWs) bands (ev): -2.8339 -2.8339 -2.8328 -2.8328 -0.9873 -0.9873 -0.9822 -0.9822 3.6354 3.6354 3.7083 3.7083 4.9599 4.9599 5.0427 5.0427 5.8269 5.8269 6.0474 6.0474 6.3468 6.3468 6.3983 6.3983 6.6678 6.6678 6.7096 6.7096 7.7468 7.7468 7.7674 7.7674 8.3098 8.3098 8.3458 8.3458 8.5917 8.5917 8.6196 8.6196 9.5147 9.5147 9.5467 9.5467 10.5188 10.5188 10.5887 10.5887 11.2723 11.2723 k = 0.5000-0.0000 0.1603 ( 4616 PWs) bands (ev): -2.8432 -2.8432 -2.8422 -2.8422 -0.9699 -0.9699 -0.9650 -0.9650 3.6601 3.6601 3.7295 3.7295 4.9419 4.9419 5.0306 5.0306 5.7915 5.7915 6.0254 6.0254 6.2847 6.2847 6.3425 6.3425 6.7004 6.7004 6.7339 6.7339 7.7633 7.7633 7.7866 7.7866 8.3308 8.3308 8.3659 8.3659 8.5924 8.5924 8.6199 8.6199 9.5451 9.5451 9.5740 9.5740 10.5191 10.5191 10.5910 10.5910 11.1837 11.1837 k = 0.5000-0.0000 0.1479 ( 4614 PWs) bands (ev): -2.8525 -2.8525 -2.8516 -2.8516 -0.9524 -0.9524 -0.9477 -0.9477 3.6870 3.6870 3.7524 3.7524 4.9242 4.9242 5.0186 5.0186 5.7475 5.7475 5.9844 5.9844 6.2381 6.2381 6.2930 6.2930 6.7374 6.7374 6.7630 6.7630 7.7806 7.7806 7.8064 7.8064 8.3494 8.3494 8.3834 8.3834 8.5930 8.5930 8.6201 8.6201 9.5764 9.5764 9.6025 9.6025 10.5188 10.5188 10.5933 10.5933 11.0932 11.0932 k = 0.5000-0.0000 0.1356 ( 4618 PWs) bands (ev): -2.8615 -2.8615 -2.8607 -2.8607 -0.9352 -0.9352 -0.9308 -0.9308 3.7157 3.7157 3.7769 3.7769 4.9070 4.9070 5.0069 5.0069 5.6946 5.6946 5.9234 5.9234 6.2109 6.2109 6.2538 6.2538 6.7751 6.7751 6.7940 6.7940 7.7985 7.7985 7.8265 7.8265 8.3658 8.3658 8.3984 8.3984 8.5936 8.5936 8.6201 8.6201 9.6086 9.6086 9.6319 9.6319 10.5174 10.5174 10.5953 10.5953 11.0022 11.0022 k = 0.5000-0.0000 0.1233 ( 4618 PWs) bands (ev): -2.8702 -2.8702 -2.8694 -2.8694 -0.9184 -0.9184 -0.9144 -0.9144 3.7461 3.7461 3.8029 3.8029 4.8905 4.8905 4.9955 4.9955 5.6341 5.6341 5.8493 5.8493 6.1979 6.1979 6.2252 6.2252 6.8120 6.8120 6.8254 6.8254 7.8170 7.8170 7.8465 7.8465 8.3803 8.3803 8.4114 8.4114 8.5942 8.5942 8.6200 8.6200 9.6418 9.6418 9.6626 9.6626 10.5144 10.5144 10.5967 10.5967 10.9120 10.9120 k = 0.5000-0.0000 0.1109 ( 4616 PWs) bands (ev): -2.8784 -2.8784 -2.8777 -2.8777 -0.9025 -0.9025 -0.8987 -0.8987 3.7780 3.7780 3.8298 3.8298 4.8751 4.8751 4.9844 4.9844 5.5687 5.5687 5.7697 5.7697 6.1928 6.1928 6.2059 6.2059 6.8472 6.8472 6.8561 6.8561 7.8356 7.8356 7.8662 7.8662 8.3930 8.3930 8.4223 8.4223 8.5948 8.5948 8.6196 8.6196 9.6760 9.6760 9.6945 9.6945 10.5086 10.5086 10.5967 10.5967 10.8241 10.8241 k = 0.5000-0.0000 0.0986 ( 4614 PWs) bands (ev): -2.8860 -2.8860 -2.8854 -2.8854 -0.8875 -0.8875 -0.8841 -0.8841 3.8107 3.8107 3.8575 3.8575 4.8611 4.8611 4.9737 4.9737 5.5015 5.5015 5.6893 5.6893 6.1915 6.1915 6.1939 6.1939 6.8800 6.8800 6.8853 6.8853 7.8542 7.8542 7.8850 7.8850 8.4043 8.4043 8.4315 8.4315 8.5955 8.5955 8.6191 8.6191 9.7114 9.7114 9.7279 9.7279 10.4982 10.4982 10.5930 10.5930 10.7419 10.7419 k = 0.5000-0.0000 0.0863 ( 4610 PWs) bands (ev): -2.8930 -2.8930 -2.8924 -2.8924 -0.8737 -0.8737 -0.8707 -0.8707 3.8439 3.8439 3.8852 3.8852 4.8487 4.8487 4.9631 4.9631 5.4357 5.4357 5.6111 5.6111 6.1873 6.1873 6.1921 6.1921 6.9099 6.9099 6.9126 6.9126 7.8724 7.8724 7.9025 7.9025 8.4143 8.4143 8.4390 8.4390 8.5962 8.5962 8.6182 8.6182 9.7481 9.7481 9.7628 9.7628 10.4808 10.4808 10.5764 10.5764 10.6750 10.6750 k = 0.5000-0.0000 0.0740 ( 4616 PWs) bands (ev): -2.8992 -2.8992 -2.8987 -2.8987 -0.8613 -0.8613 -0.8587 -0.8587 3.8767 3.8767 3.9123 3.9123 4.8384 4.8384 4.9520 4.9520 5.3744 5.3744 5.5370 5.5370 6.1843 6.1843 6.1933 6.1933 6.9365 6.9365 6.9374 6.9374 7.8897 7.8897 7.9182 7.9182 8.4230 8.4230 8.4449 8.4449 8.5969 8.5969 8.6170 8.6170 9.7863 9.7863 9.7995 9.7995 10.4531 10.4531 10.5287 10.5287 10.6423 10.6423 k = 0.5000-0.0000 0.0616 ( 4612 PWs) bands (ev): -2.9046 -2.9046 -2.9041 -2.9041 -0.8505 -0.8505 -0.8483 -0.8483 3.9081 3.9081 3.9379 3.9379 4.8306 4.8306 4.9397 4.9397 5.3209 5.3209 5.4683 5.4683 6.1839 6.1839 6.1946 6.1946 6.9592 6.9592 6.9596 6.9596 7.9060 7.9060 7.9318 7.9318 8.4306 8.4306 8.4495 8.4495 8.5979 8.5979 8.6156 8.6156 9.8260 9.8260 9.8379 9.8379 10.4138 10.4138 10.4610 10.4610 10.6335 10.6335 k = 0.5000-0.0000 0.0493 ( 4608 PWs) bands (ev): -2.9090 -2.9090 -2.9087 -2.9087 -0.8414 -0.8414 -0.8396 -0.8396 3.9371 3.9371 3.9609 3.9609 4.8262 4.8262 4.9253 4.9253 5.2780 5.2780 5.4063 5.4063 6.1850 6.1850 6.1956 6.1956 6.9777 6.9777 6.9787 6.9787 7.9207 7.9207 7.9428 7.9428 8.4373 8.4373 8.4528 8.4528 8.5991 8.5991 8.6140 8.6140 9.8672 9.8672 9.8777 9.8777 10.3654 10.3654 10.3912 10.3912 10.6315 10.6315 k = 0.5000-0.0000 0.0370 ( 4608 PWs) bands (ev): -2.9125 -2.9125 -2.9123 -2.9123 -0.8341 -0.8341 -0.8328 -0.8328 3.9623 3.9623 3.9800 3.9800 4.8256 4.8256 4.9083 4.9083 5.2484 5.2484 5.3521 5.3521 6.1870 6.1870 6.1960 6.1960 6.9926 6.9926 6.9938 6.9938 7.9334 7.9334 7.9510 7.9510 8.4429 8.4429 8.4548 8.4548 8.6004 8.6004 8.6120 8.6120 9.9091 9.9091 9.9182 9.9182 10.3128 10.3128 10.3251 10.3251 10.6317 10.6317 k = 0.5000-0.0000 0.0247 ( 4592 PWs) bands (ev): -2.9151 -2.9151 -2.9149 -2.9149 -0.8288 -0.8288 -0.8279 -0.8279 3.9824 3.9824 3.9942 3.9942 4.8297 4.8297 4.8893 4.8893 5.2334 5.2334 5.3066 5.3066 6.1893 6.1893 6.1959 6.1959 7.0035 7.0035 7.0045 7.0045 7.9439 7.9439 7.9561 7.9561 8.4476 8.4476 8.4556 8.4556 8.6021 8.6021 8.6101 8.6101 9.9498 9.9498 9.9572 9.9572 10.2623 10.2623 10.2668 10.2668 10.6329 10.6329 k = 0.5000-0.0000 0.0123 ( 4592 PWs) bands (ev): -2.9166 -2.9166 -2.9165 -2.9165 -0.8255 -0.8255 -0.8250 -0.8250 3.9962 3.9962 4.0020 4.0020 4.8386 4.8386 4.8699 4.8699 5.2329 5.2329 5.2708 5.2708 6.1916 6.1916 6.1950 6.1950 7.0103 7.0103 7.0109 7.0109 7.9515 7.9515 7.9578 7.9578 8.4512 8.4512 8.4553 8.4553 8.6039 8.6039 8.6080 8.6080 9.9842 9.9842 9.9888 9.9888 10.2219 10.2219 10.2226 10.2226 10.6346 10.6346 k = 0.5000-0.0000-0.0000 ( 4592 PWs) bands (ev): -2.9170 -2.9170 -2.9170 -2.9170 -0.8242 -0.8242 -0.8242 -0.8242 4.0028 4.0028 4.0028 4.0028 4.8524 4.8524 4.8524 4.8524 5.2458 5.2458 5.2458 5.2458 6.1935 6.1935 6.1935 6.1935 7.0128 7.0128 7.0128 7.0128 7.9563 7.9563 7.9563 7.9563 8.4538 8.4538 8.4538 8.4538 8.6059 8.6059 8.6059 8.6059 10.0006 10.0006 10.0006 10.0006 10.2049 10.2049 10.2049 10.2049 10.6372 10.6372 k = 0.5000 0.3662-0.0000 ( 4648 PWs) bands (ev): -2.4279 -2.4279 -2.4253 -2.4253 -1.4978 -1.4978 -1.4945 -1.4945 4.2045 4.2045 4.2218 4.2218 4.3063 4.3063 4.4060 4.4060 5.0902 5.0902 5.2996 5.2996 5.7256 5.7256 6.0861 6.0861 6.7953 6.7953 6.8718 6.8718 8.2272 8.2272 8.2611 8.2611 8.5102 8.5102 8.5451 8.5451 8.6543 8.6543 8.6574 8.6574 9.6752 9.6752 9.7163 9.7163 10.9171 10.9171 11.1657 11.1657 12.0212 12.0212 k = 0.5000 0.3662 0.0123 ( 4648 PWs) bands (ev): -2.4275 -2.4275 -2.4248 -2.4248 -1.4979 -1.4979 -1.4946 -1.4946 4.1934 4.1934 4.2195 4.2195 4.2938 4.2938 4.3991 4.3991 5.1072 5.1072 5.3124 5.3124 5.7319 5.7319 6.0903 6.0903 6.7960 6.7960 6.8724 6.8724 8.2276 8.2276 8.2613 8.2613 8.5103 8.5103 8.5447 8.5447 8.6543 8.6543 8.6573 8.6573 9.6763 9.6763 9.7172 9.7172 10.9157 10.9157 11.1641 11.1641 12.0199 12.0199 k = 0.5000 0.3662 0.0247 ( 4648 PWs) bands (ev): -2.4262 -2.4262 -2.4236 -2.4236 -1.4983 -1.4983 -1.4950 -1.4950 4.1641 4.1641 4.2099 4.2099 4.2582 4.2582 4.3799 4.3799 5.1548 5.1548 5.3494 5.3494 5.7503 5.7503 6.1027 6.1027 6.7981 6.7981 6.8742 6.8742 8.2289 8.2289 8.2619 8.2619 8.5108 8.5108 8.5437 8.5437 8.6541 8.6541 8.6569 8.6569 9.6795 9.6795 9.7197 9.7197 10.9116 10.9116 11.1592 11.1592 12.0163 12.0163 k = 0.5000 0.3662 0.0370 ( 4644 PWs) bands (ev): -2.4241 -2.4241 -2.4215 -2.4215 -1.4990 -1.4990 -1.4957 -1.4957 4.1210 4.1210 4.1926 4.1926 4.2051 4.2051 4.3513 4.3513 5.2257 5.2257 5.4072 5.4072 5.7797 5.7797 6.1227 6.1227 6.8017 6.8017 6.8771 6.8771 8.2310 8.2310 8.2629 8.2629 8.5116 8.5116 8.5421 8.5421 8.6539 8.6539 8.6563 8.6563 9.6850 9.6850 9.7240 9.7240 10.9047 10.9047 11.1511 11.1511 12.0101 12.0101 k = 0.5000 0.3662 0.0493 ( 4636 PWs) bands (ev): -2.4213 -2.4213 -2.4187 -2.4187 -1.4999 -1.4999 -1.4967 -1.4967 4.0679 4.0679 4.1408 4.1408 4.1684 4.1684 4.3153 4.3153 5.3129 5.3129 5.4817 5.4817 5.8186 5.8186 6.1495 6.1495 6.8068 6.8068 6.8812 6.8812 8.2339 8.2339 8.2641 8.2641 8.5127 8.5127 8.5399 8.5399 8.6536 8.6536 8.6554 8.6554 9.6929 9.6929 9.7301 9.7301 10.8951 10.8951 11.1398 11.1398 12.0012 12.0012 k = 0.5000 0.3662 0.0616 ( 4636 PWs) bands (ev): -2.4176 -2.4176 -2.4151 -2.4151 -1.5011 -1.5011 -1.4980 -1.4980 4.0082 4.0082 4.0706 4.0706 4.1385 4.1385 4.2734 4.2734 5.4110 5.4110 5.5691 5.5691 5.8653 5.8653 6.1819 6.1819 6.8135 6.8135 6.8864 6.8864 8.2375 8.2375 8.2656 8.2656 8.5143 8.5143 8.5371 8.5371 8.6532 8.6532 8.6544 8.6544 9.7032 9.7032 9.7382 9.7382 10.8827 10.8827 11.1251 11.1251 11.9893 11.9893 k = 0.5000 0.3662 0.0740 ( 4632 PWs) bands (ev): -2.4133 -2.4133 -2.4108 -2.4108 -1.5026 -1.5026 -1.4995 -1.4995 3.9447 3.9447 3.9979 3.9979 4.1040 4.1040 4.2270 4.2270 5.5166 5.5166 5.6663 5.6663 5.9181 5.9181 6.2186 6.2186 6.8219 6.8219 6.8929 6.8929 8.2416 8.2416 8.2671 8.2671 8.5162 8.5162 8.5338 8.5338 8.6528 8.6528 8.6531 8.6531 9.7163 9.7163 9.7485 9.7485 10.8676 10.8676 11.1071 11.1071 11.9743 11.9743 k = 0.5000 0.3662 0.0863 ( 4624 PWs) bands (ev): -2.4083 -2.4083 -2.4058 -2.4058 -1.5043 -1.5043 -1.5013 -1.5013 3.8796 3.8796 3.9250 3.9250 4.0660 4.0660 4.1773 4.1773 5.6272 5.6272 5.7709 5.7709 5.9756 5.9756 6.2584 6.2584 6.8323 6.8323 6.9006 6.9006 8.2460 8.2460 8.2686 8.2686 8.5187 8.5187 8.5302 8.5302 8.6517 8.6517 8.6524 8.6524 9.7323 9.7323 9.7611 9.7611 10.8497 10.8497 11.0857 11.0857 11.9556 11.9556 k = 0.5000 0.3662 0.0986 ( 4624 PWs) bands (ev): -2.4026 -2.4026 -2.4003 -2.4003 -1.5062 -1.5062 -1.5034 -1.5034 3.8144 3.8144 3.8533 3.8533 4.0253 4.0253 4.1257 4.1257 5.7407 5.7407 5.8809 5.8809 6.0367 6.0367 6.2999 6.2999 6.8448 6.8448 6.9095 6.9095 8.2505 8.2505 8.2698 8.2698 8.5217 8.5217 8.5262 8.5262 8.6502 8.6502 8.6520 8.6520 9.7515 9.7515 9.7764 9.7764 10.8291 10.8291 11.0609 11.0609 11.9330 11.9330 k = 0.5000 0.3662 0.1109 ( 4628 PWs) bands (ev): -2.3965 -2.3965 -2.3942 -2.3942 -1.5084 -1.5084 -1.5057 -1.5057 3.7504 3.7504 3.7837 3.7837 3.9830 3.9830 4.0730 4.0730 5.8550 5.8550 5.9947 5.9947 6.1009 6.1009 6.3419 6.3419 6.8596 6.8596 6.9198 6.9198 8.2546 8.2546 8.2705 8.2705 8.5223 8.5223 8.5252 8.5252 8.6486 8.6486 8.6516 8.6516 9.7742 9.7742 9.7945 9.7945 10.8059 10.8059 11.0328 11.0328 11.9060 11.9060 k = 0.5000 0.3662 0.1233 ( 4632 PWs) bands (ev): -2.3898 -2.3898 -2.3876 -2.3876 -1.5108 -1.5108 -1.5082 -1.5082 3.6883 3.6883 3.7170 3.7170 3.9398 3.9398 4.0203 4.0203 5.9673 5.9673 6.1108 6.1108 6.1690 6.1690 6.3833 6.3833 6.8770 6.8770 6.9313 6.9313 8.2580 8.2580 8.2704 8.2704 8.5185 8.5185 8.5293 8.5293 8.6470 8.6470 8.6514 8.6514 9.8007 9.8007 9.8158 9.8158 10.7801 10.7801 11.0013 11.0013 11.8742 11.8742 k = 0.5000 0.3662 0.1356 ( 4624 PWs) bands (ev): -2.3829 -2.3829 -2.3807 -2.3807 -1.5134 -1.5134 -1.5109 -1.5109 3.6287 3.6287 3.6536 3.6536 3.8965 3.8965 3.9683 3.9683 6.0730 6.0730 6.2274 6.2274 6.2436 6.2436 6.4234 6.4234 6.8976 6.8976 6.9443 6.9443 8.2600 8.2600 8.2693 8.2693 8.5153 8.5153 8.5341 8.5341 8.6455 8.6455 8.6512 8.6512 9.8314 9.8314 9.8407 9.8407 10.7520 10.7520 10.9667 10.9667 11.8371 11.8371 k = 0.5000 0.3662 0.1479 ( 4616 PWs) bands (ev): -2.3756 -2.3756 -2.3736 -2.3736 -1.5161 -1.5161 -1.5138 -1.5138 3.5723 3.5723 3.5938 3.5938 3.8537 3.8537 3.9175 3.9175 6.1658 6.1658 6.3291 6.3291 6.3418 6.3418 6.4628 6.4628 6.9215 6.9215 6.9588 6.9588 8.2600 8.2600 8.2669 8.2669 8.5130 8.5130 8.5393 8.5393 8.6442 8.6442 8.6511 8.6511 9.8666 9.8666 9.8694 9.8694 10.7218 10.7218 10.9290 10.9290 11.7945 11.7945 k = 0.5000 0.3662 0.1603 ( 4616 PWs) bands (ev): -2.3682 -2.3682 -2.3663 -2.3663 -1.5190 -1.5190 -1.5168 -1.5168 3.5193 3.5193 3.5379 3.5379 3.8121 3.8121 3.8685 3.8685 6.2423 6.2423 6.4274 6.4274 6.4435 6.4435 6.5096 6.5096 6.9496 6.9496 6.9752 6.9752 8.2571 8.2571 8.2628 8.2628 8.5120 8.5120 8.5449 8.5449 8.6431 8.6431 8.6512 8.6512 9.9022 9.9022 9.9064 9.9064 10.6898 10.6898 10.8887 10.8887 11.7459 11.7459 k = 0.5000 0.3662 0.1726 ( 4616 PWs) bands (ev): -2.3607 -2.3607 -2.3589 -2.3589 -1.5219 -1.5219 -1.5199 -1.5199 3.4700 3.4700 3.4862 3.4862 3.7721 3.7721 3.8218 3.8218 6.3050 6.3050 6.5017 6.5017 6.5341 6.5341 6.5918 6.5918 6.9831 6.9831 6.9937 6.9937 8.2507 8.2507 8.2565 8.2565 8.5126 8.5126 8.5508 8.5508 8.6422 8.6422 8.6513 8.6513 9.9394 9.9394 9.9512 9.9512 10.6566 10.6566 10.8461 10.8461 11.6913 11.6913 k = 0.5000 0.3662 0.1849 ( 4624 PWs) bands (ev): -2.3533 -2.3533 -2.3516 -2.3516 -1.5249 -1.5249 -1.5230 -1.5230 3.4247 3.4247 3.4386 3.4386 3.7342 3.7342 3.7778 3.7778 6.3578 6.3578 6.5326 6.5326 6.6427 6.6427 6.6895 6.6895 7.0156 7.0156 7.0241 7.0241 8.2403 8.2403 8.2478 8.2478 8.5147 8.5147 8.5565 8.5565 8.6417 8.6417 8.6515 8.6515 9.9810 9.9810 10.0009 10.0009 10.6227 10.6227 10.8018 10.8018 11.6306 11.6306 k = 0.5000 0.3662 0.1972 ( 4616 PWs) bands (ev): -2.3461 -2.3461 -2.3446 -2.3446 -1.5278 -1.5278 -1.5262 -1.5262 3.3834 3.3834 3.3954 3.3954 3.6989 3.6989 3.7368 3.7368 6.4034 6.4034 6.5554 6.5554 6.7472 6.7472 6.7788 6.7788 7.0431 7.0431 7.0760 7.0760 8.2253 8.2253 8.2363 8.2363 8.5185 8.5185 8.5620 8.5620 8.6418 8.6418 8.6518 8.6518 10.0272 10.0272 10.0556 10.0556 10.5891 10.5891 10.7568 10.7568 11.5642 11.5642 k = 0.5000 0.3662 0.2096 ( 4608 PWs) bands (ev): -2.3392 -2.3392 -2.3378 -2.3378 -1.5307 -1.5307 -1.5292 -1.5292 3.3464 3.3464 3.3566 3.3566 3.6665 3.6665 3.6991 3.6991 6.4431 6.4431 6.5735 6.5735 6.8401 6.8401 6.8518 6.8518 7.0812 7.0812 7.1419 7.1419 8.2057 8.2057 8.2216 8.2216 8.5237 8.5237 8.5670 8.5670 8.6424 8.6424 8.6523 8.6523 10.0775 10.0775 10.1146 10.1146 10.5570 10.5570 10.7120 10.7120 11.4924 11.4924 k = 0.5000 0.3662 0.2219 ( 4612 PWs) bands (ev): -2.3327 -2.3327 -2.3315 -2.3315 -1.5334 -1.5334 -1.5321 -1.5321 3.3137 3.3137 3.3223 3.3223 3.6373 3.6373 3.6651 3.6651 6.4775 6.4775 6.5877 6.5877 6.9069 6.9069 6.9125 6.9125 7.1370 7.1370 7.2210 7.2210 8.1812 8.1812 8.2032 8.2032 8.5296 8.5296 8.5709 8.5709 8.6435 8.6435 8.6528 8.6528 10.1315 10.1315 10.1769 10.1769 10.5282 10.5282 10.6691 10.6691 11.4159 11.4159 k = 0.5000 0.3662 0.2342 ( 4616 PWs) bands (ev): -2.3268 -2.3268 -2.3257 -2.3257 -1.5360 -1.5360 -1.5349 -1.5349 3.2853 3.2853 3.2925 3.2925 3.6116 3.6116 3.6348 3.6348 6.5072 6.5072 6.5986 6.5986 6.9473 6.9473 6.9609 6.9609 7.2121 7.2121 7.3081 7.3081 8.1520 8.1520 8.1808 8.1808 8.5361 8.5361 8.5738 8.5738 8.6450 8.6450 8.6534 8.6534 10.1877 10.1877 10.2397 10.2397 10.5059 10.5059 10.6301 10.6301 11.3357 11.3357 k = 0.5000 0.3662 0.2466 ( 4620 PWs) bands (ev): -2.3216 -2.3216 -2.3207 -2.3207 -1.5382 -1.5382 -1.5373 -1.5373 3.2614 3.2614 3.2672 3.2672 3.5897 3.5897 3.6087 3.6087 6.5325 6.5325 6.6064 6.6064 6.9773 6.9773 6.9915 6.9915 7.2988 7.2988 7.3971 7.3971 8.1187 8.1187 8.1541 8.1541 8.5428 8.5428 8.5756 8.5756 8.6469 8.6469 8.6540 8.6540 10.2436 10.2436 10.2969 10.2969 10.4966 10.4966 10.5986 10.5986 11.2532 11.2532 k = 0.5000 0.3662 0.2589 ( 4616 PWs) bands (ev): -2.3171 -2.3171 -2.3164 -2.3164 -1.5402 -1.5402 -1.5394 -1.5394 3.2418 3.2418 3.2464 3.2464 3.5717 3.5717 3.5867 3.5867 6.5539 6.5539 6.6115 6.6115 6.9997 6.9997 7.0116 7.0116 7.3879 7.3879 7.4824 7.4824 8.0821 8.0821 8.1232 8.1232 8.5493 8.5493 8.5763 8.5763 8.6489 8.6489 8.6545 8.6545 10.2942 10.2942 10.3359 10.3359 10.5127 10.5127 10.5798 10.5798 11.1703 11.1703 k = 0.5000 0.3662 0.2712 ( 4608 PWs) bands (ev): -2.3135 -2.3135 -2.3130 -2.3130 -1.5417 -1.5417 -1.5411 -1.5411 3.2268 3.2268 3.2301 3.2301 3.5580 3.5580 3.5691 3.5691 6.5716 6.5716 6.6139 6.6139 7.0163 7.0163 7.0251 7.0251 7.4734 7.4734 7.5588 7.5588 8.0446 8.0446 8.0886 8.0886 8.5553 8.5553 8.5760 8.5760 8.6509 8.6509 8.6549 8.6549 10.3314 10.3314 10.3508 10.3508 10.5585 10.5585 10.5815 10.5815 11.0903 11.0903 k = 0.5000 0.3662 0.2835 ( 4616 PWs) bands (ev): -2.3109 -2.3109 -2.3105 -2.3105 -1.5428 -1.5428 -1.5424 -1.5424 3.2162 3.2162 3.2184 3.2184 3.5486 3.5486 3.5559 3.5559 6.5859 6.5859 6.6137 6.6137 7.0281 7.0281 7.0338 7.0338 7.5503 7.5503 7.6192 7.6192 8.0111 8.0111 8.0519 8.0519 8.5607 8.5607 8.5746 8.5746 8.6525 8.6525 8.6551 8.6551 10.3498 10.3498 10.3528 10.3528 10.6074 10.6074 10.6177 10.6177 11.0191 11.0191 k = 0.5000 0.3662 0.2959 ( 4620 PWs) bands (ev): -2.3092 -2.3092 -2.3090 -2.3090 -1.5435 -1.5435 -1.5433 -1.5433 3.2100 3.2100 3.2111 3.2111 3.5436 3.5436 3.5472 3.5472 6.5971 6.5971 6.6109 6.6109 7.0354 7.0354 7.0382 7.0382 7.6125 7.6125 7.6533 7.6533 7.9908 7.9908 8.0174 8.0174 8.5653 8.5653 8.5723 8.5723 8.6538 8.6538 8.6550 8.6550 10.3525 10.3525 10.3542 10.3542 10.6472 10.6472 10.6664 10.6664 10.9714 10.9714 k = 0.5000 0.3662 0.3082 ( 4616 PWs) bands (ev): -2.3086 -2.3086 -2.3086 -2.3086 -1.5436 -1.5436 -1.5436 -1.5436 3.2083 3.2083 3.2083 3.2083 3.5431 3.5431 3.5431 3.5431 6.6054 6.6054 6.6054 6.6054 7.0388 7.0388 7.0388 7.0388 7.6506 7.6506 7.6506 7.6506 7.9935 7.9935 7.9935 7.9935 8.5692 8.5692 8.5692 8.5692 8.6546 8.6546 8.6546 8.6546 10.3533 10.3533 10.3533 10.3533 10.6768 10.6768 10.6768 10.6768 10.9723 10.9723 Writing output data file CoTe2.save init_run : 0.59s CPU 0.87s WALL ( 1 calls) electrons : 448.44s CPU 452.37s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.05s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 448.43s CPU 452.36s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.04s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.02s WALL ( 1 calls) newd : 0.21s CPU 0.21s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.06s WALL ( 396 calls) cegterg : 421.71s CPU 425.14s WALL ( 884 calls) Called by sum_band: Called by *egterg: h_psi : 249.95s CPU 258.74s WALL ( 15140 calls) s_psi : 33.44s CPU 33.62s WALL ( 15140 calls) g_psi : 0.53s CPU 0.64s WALL ( 13860 calls) cdiaghg : 102.78s CPU 97.53s WALL ( 14256 calls) cegterg:over : 24.11s CPU 22.11s WALL ( 13860 calls) cegterg:upda : 6.69s CPU 10.79s WALL ( 13860 calls) cegterg:last : 6.73s CPU 7.86s WALL ( 2503 calls) Called by h_psi: h_psi:vloc : 209.12s CPU 215.63s WALL ( 15140 calls) h_psi:vnl : 40.67s CPU 42.67s WALL ( 15140 calls) add_vuspsi : 20.04s CPU 23.43s WALL ( 15140 calls) General routines calbec : 20.59s CPU 19.19s WALL ( 15140 calls) fft : 0.02s CPU 0.06s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 206.05s CPU 207.70s WALL ( 1546320 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.02s CPU 0.14s WALL ( 792 calls) Parallel routines fft_scatter : 186.20s CPU 148.92s WALL ( 1546343 calls) PWSCF : 7m59.98s CPU 8m14.65s WALL This run was terminated on: 16:44:39 16Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=