Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 19:40:58 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 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 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: ./AlPPt5.save/ file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 52 19 6 2950 674 111 Max 53 20 8 2956 702 118 Sum 1877 709 221 106361 24729 4161 bravais-lattice index = 14 lattice parameter (alat) = 7.3624 a.u. unit-cell volume = 698.3794 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 41.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.362372 celldm(2)= 1.000000 celldm(3)= 1.750000 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 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.750000 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.571429 ) PseudoPot. # 1 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 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 Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 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 Al 3.00 26.98150 Al( 1.00) Pt 10.00 195.08400 Pt( 1.00) P 5.00 30.97380 P( 1.00) 16 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 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 = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 361 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 2) = ( 0.0000000 0.0121951 -0.0000000), wk = 0.0027701 k( 3) = ( 0.0000000 0.0243902 -0.0000000), wk = 0.0027701 k( 4) = ( 0.0000000 0.0365854 -0.0000000), wk = 0.0027701 k( 5) = ( 0.0000000 0.0487805 -0.0000000), wk = 0.0027701 k( 6) = ( 0.0000000 0.0609756 -0.0000000), wk = 0.0027701 k( 7) = ( 0.0000000 0.0731707 -0.0000000), wk = 0.0027701 k( 8) = ( 0.0000000 0.0853658 -0.0000000), wk = 0.0027701 k( 9) = ( 0.0000000 0.0975610 -0.0000000), wk = 0.0027701 k( 10) = ( 0.0000000 0.1097561 -0.0000000), wk = 0.0027701 k( 11) = ( 0.0000000 0.1219512 -0.0000000), wk = 0.0027701 k( 12) = ( 0.0000000 0.1341463 -0.0000000), wk = 0.0027701 k( 13) = ( 0.0000000 0.1463415 -0.0000000), wk = 0.0027701 k( 14) = ( 0.0000000 0.1585366 -0.0000000), wk = 0.0027701 k( 15) = ( 0.0000000 0.1707317 -0.0000000), wk = 0.0027701 k( 16) = ( 0.0000000 0.1829268 -0.0000000), wk = 0.0027701 k( 17) = ( 0.0000000 0.1951219 -0.0000000), wk = 0.0027701 k( 18) = ( 0.0000000 0.2073171 -0.0000000), wk = 0.0027701 k( 19) = ( 0.0000000 0.2195122 -0.0000000), wk = 0.0027701 k( 20) = ( 0.0000000 0.2317073 -0.0000000), wk = 0.0027701 k( 21) = ( 0.0000000 0.2439024 -0.0000000), wk = 0.0027701 k( 22) = ( 0.0000000 0.2560976 -0.0000000), wk = 0.0027701 k( 23) = ( 0.0000000 0.2682927 -0.0000000), wk = 0.0027701 k( 24) = ( 0.0000000 0.2804878 -0.0000000), wk = 0.0027701 k( 25) = ( 0.0000000 0.2926829 -0.0000000), wk = 0.0027701 k( 26) = ( 0.0000000 0.3048781 -0.0000000), wk = 0.0027701 k( 27) = ( 0.0000000 0.3170732 -0.0000000), wk = 0.0027701 k( 28) = ( 0.0000000 0.3292683 -0.0000000), wk = 0.0027701 k( 29) = ( 0.0000000 0.3414634 -0.0000000), wk = 0.0027701 k( 30) = ( 0.0000000 0.3536585 -0.0000000), wk = 0.0027701 k( 31) = ( 0.0000000 0.3658537 -0.0000000), wk = 0.0027701 k( 32) = ( 0.0000000 0.3780488 -0.0000000), wk = 0.0027701 k( 33) = ( 0.0000000 0.3902439 -0.0000000), wk = 0.0027701 k( 34) = ( 0.0000000 0.4024390 -0.0000000), wk = 0.0027701 k( 35) = ( 0.0000000 0.4146341 -0.0000000), wk = 0.0027701 k( 36) = ( 0.0000000 0.4268293 -0.0000000), wk = 0.0027701 k( 37) = ( 0.0000000 0.4390244 -0.0000000), wk = 0.0027701 k( 38) = ( 0.0000000 0.4512195 -0.0000000), wk = 0.0027701 k( 39) = ( 0.0000000 0.4634146 -0.0000000), wk = 0.0027701 k( 40) = ( 0.0000000 0.4756098 -0.0000000), wk = 0.0027701 k( 41) = ( 0.0000000 0.4878049 -0.0000000), wk = 0.0027701 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027701 k( 43) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027701 k( 44) = ( 0.0121951 0.5000000 -0.0000000), wk = 0.0027701 k( 45) = ( 0.0243902 0.5000000 -0.0000000), wk = 0.0027701 k( 46) = ( 0.0365854 0.5000000 -0.0000000), wk = 0.0027701 k( 47) = ( 0.0487805 0.5000000 -0.0000000), wk = 0.0027701 k( 48) = ( 0.0609756 0.5000000 -0.0000000), wk = 0.0027701 k( 49) = ( 0.0731707 0.5000000 -0.0000000), wk = 0.0027701 k( 50) = ( 0.0853658 0.5000000 -0.0000000), wk = 0.0027701 k( 51) = ( 0.0975610 0.5000000 -0.0000000), wk = 0.0027701 k( 52) = ( 0.1097561 0.5000000 -0.0000000), wk = 0.0027701 k( 53) = ( 0.1219512 0.5000000 -0.0000000), wk = 0.0027701 k( 54) = ( 0.1341463 0.5000000 -0.0000000), wk = 0.0027701 k( 55) = ( 0.1463415 0.5000000 -0.0000000), wk = 0.0027701 k( 56) = ( 0.1585366 0.5000000 -0.0000000), wk = 0.0027701 k( 57) = ( 0.1707317 0.5000000 -0.0000000), wk = 0.0027701 k( 58) = ( 0.1829268 0.5000000 -0.0000000), wk = 0.0027701 k( 59) = ( 0.1951219 0.5000000 -0.0000000), wk = 0.0027701 k( 60) = ( 0.2073171 0.5000000 -0.0000000), wk = 0.0027701 k( 61) = ( 0.2195122 0.5000000 -0.0000000), wk = 0.0027701 k( 62) = ( 0.2317073 0.5000000 -0.0000000), wk = 0.0027701 k( 63) = ( 0.2439024 0.5000000 -0.0000000), wk = 0.0027701 k( 64) = ( 0.2560976 0.5000000 -0.0000000), wk = 0.0027701 k( 65) = ( 0.2682927 0.5000000 -0.0000000), wk = 0.0027701 k( 66) = ( 0.2804878 0.5000000 -0.0000000), wk = 0.0027701 k( 67) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0027701 k( 68) = ( 0.3048781 0.5000000 -0.0000000), wk = 0.0027701 k( 69) = ( 0.3170732 0.5000000 -0.0000000), wk = 0.0027701 k( 70) = ( 0.3292683 0.5000000 -0.0000000), wk = 0.0027701 k( 71) = ( 0.3414634 0.5000000 -0.0000000), wk = 0.0027701 k( 72) = ( 0.3536585 0.5000000 -0.0000000), wk = 0.0027701 k( 73) = ( 0.3658537 0.5000000 -0.0000000), wk = 0.0027701 k( 74) = ( 0.3780488 0.5000000 -0.0000000), wk = 0.0027701 k( 75) = ( 0.3902439 0.5000000 -0.0000000), wk = 0.0027701 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0027701 k( 77) = ( 0.4146341 0.5000000 -0.0000000), wk = 0.0027701 k( 78) = ( 0.4268293 0.5000000 -0.0000000), wk = 0.0027701 k( 79) = ( 0.4390244 0.5000000 -0.0000000), wk = 0.0027701 k( 80) = ( 0.4512195 0.5000000 -0.0000000), wk = 0.0027701 k( 81) = ( 0.4634146 0.5000000 -0.0000000), wk = 0.0027701 k( 82) = ( 0.4756098 0.5000000 -0.0000000), wk = 0.0027701 k( 83) = ( 0.4878049 0.5000000 -0.0000000), wk = 0.0027701 k( 84) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 85) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 86) = ( 0.4913793 0.4913793 -0.0000000), wk = 0.0027701 k( 87) = ( 0.4827586 0.4827586 -0.0000000), wk = 0.0027701 k( 88) = ( 0.4741379 0.4741379 -0.0000000), wk = 0.0027701 k( 89) = ( 0.4655172 0.4655172 -0.0000000), wk = 0.0027701 k( 90) = ( 0.4568966 0.4568965 -0.0000000), wk = 0.0027701 k( 91) = ( 0.4482759 0.4482759 -0.0000000), wk = 0.0027701 k( 92) = ( 0.4396552 0.4396552 -0.0000000), wk = 0.0027701 k( 93) = ( 0.4310345 0.4310345 -0.0000000), wk = 0.0027701 k( 94) = ( 0.4224138 0.4224138 -0.0000000), wk = 0.0027701 k( 95) = ( 0.4137931 0.4137931 -0.0000000), wk = 0.0027701 k( 96) = ( 0.4051724 0.4051724 -0.0000000), wk = 0.0027701 k( 97) = ( 0.3965517 0.3965517 -0.0000000), wk = 0.0027701 k( 98) = ( 0.3879310 0.3879310 -0.0000000), wk = 0.0027701 k( 99) = ( 0.3793103 0.3793103 -0.0000000), wk = 0.0027701 k( 100) = ( 0.3706897 0.3706897 -0.0000000), wk = 0.0027701 k( 101) = ( 0.3620690 0.3620690 -0.0000000), wk = 0.0027701 k( 102) = ( 0.3534483 0.3534483 -0.0000000), wk = 0.0027701 k( 103) = ( 0.3448276 0.3448276 -0.0000000), wk = 0.0027701 k( 104) = ( 0.3362069 0.3362069 -0.0000000), wk = 0.0027701 k( 105) = ( 0.3275862 0.3275862 -0.0000000), wk = 0.0027701 k( 106) = ( 0.3189655 0.3189655 -0.0000000), wk = 0.0027701 k( 107) = ( 0.3103448 0.3103448 -0.0000000), wk = 0.0027701 k( 108) = ( 0.3017241 0.3017241 -0.0000000), wk = 0.0027701 k( 109) = ( 0.2931034 0.2931034 -0.0000000), wk = 0.0027701 k( 110) = ( 0.2844828 0.2844828 -0.0000000), wk = 0.0027701 k( 111) = ( 0.2758621 0.2758621 -0.0000000), wk = 0.0027701 k( 112) = ( 0.2672414 0.2672414 -0.0000000), wk = 0.0027701 k( 113) = ( 0.2586207 0.2586207 -0.0000000), wk = 0.0027701 k( 114) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0027701 k( 115) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0027701 k( 116) = ( 0.2327586 0.2327586 -0.0000000), wk = 0.0027701 k( 117) = ( 0.2241379 0.2241379 -0.0000000), wk = 0.0027701 k( 118) = ( 0.2155172 0.2155172 -0.0000000), wk = 0.0027701 k( 119) = ( 0.2068966 0.2068965 -0.0000000), wk = 0.0027701 k( 120) = ( 0.1982759 0.1982759 -0.0000000), wk = 0.0027701 k( 121) = ( 0.1896552 0.1896552 -0.0000000), wk = 0.0027701 k( 122) = ( 0.1810345 0.1810345 -0.0000000), wk = 0.0027701 k( 123) = ( 0.1724138 0.1724138 -0.0000000), wk = 0.0027701 k( 124) = ( 0.1637931 0.1637931 -0.0000000), wk = 0.0027701 k( 125) = ( 0.1551724 0.1551724 -0.0000000), wk = 0.0027701 k( 126) = ( 0.1465517 0.1465517 -0.0000000), wk = 0.0027701 k( 127) = ( 0.1379310 0.1379310 -0.0000000), wk = 0.0027701 k( 128) = ( 0.1293103 0.1293103 -0.0000000), wk = 0.0027701 k( 129) = ( 0.1206897 0.1206897 -0.0000000), wk = 0.0027701 k( 130) = ( 0.1120690 0.1120690 -0.0000000), wk = 0.0027701 k( 131) = ( 0.1034483 0.1034483 -0.0000000), wk = 0.0027701 k( 132) = ( 0.0948276 0.0948276 -0.0000000), wk = 0.0027701 k( 133) = ( 0.0862069 0.0862069 -0.0000000), wk = 0.0027701 k( 134) = ( 0.0775862 0.0775862 -0.0000000), wk = 0.0027701 k( 135) = ( 0.0689655 0.0689655 -0.0000000), wk = 0.0027701 k( 136) = ( 0.0603448 0.0603448 -0.0000000), wk = 0.0027701 k( 137) = ( 0.0517241 0.0517241 -0.0000000), wk = 0.0027701 k( 138) = ( 0.0431035 0.0431034 -0.0000000), wk = 0.0027701 k( 139) = ( 0.0344828 0.0344828 -0.0000000), wk = 0.0027701 k( 140) = ( 0.0258621 0.0258621 -0.0000000), wk = 0.0027701 k( 141) = ( 0.0172414 0.0172414 -0.0000000), wk = 0.0027701 k( 142) = ( 0.0086207 0.0086207 -0.0000000), wk = 0.0027701 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 145) = ( 0.0000000 0.0000000 0.0119048), wk = 0.0027701 k( 146) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0027701 k( 147) = ( 0.0000000 0.0000000 0.0357143), wk = 0.0027701 k( 148) = ( 0.0000000 0.0000000 0.0476190), wk = 0.0027701 k( 149) = ( 0.0000000 0.0000000 0.0595238), wk = 0.0027701 k( 150) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0027701 k( 151) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0027701 k( 152) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0027701 k( 153) = ( 0.0000000 0.0000000 0.1071429), wk = 0.0027701 k( 154) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0027701 k( 155) = ( 0.0000000 0.0000000 0.1309524), wk = 0.0027701 k( 156) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0027701 k( 157) = ( 0.0000000 0.0000000 0.1547619), wk = 0.0027701 k( 158) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0027701 k( 159) = ( 0.0000000 0.0000000 0.1785714), wk = 0.0027701 k( 160) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0027701 k( 161) = ( 0.0000000 0.0000000 0.2023810), wk = 0.0027701 k( 162) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0027701 k( 163) = ( 0.0000000 0.0000000 0.2261905), wk = 0.0027701 k( 164) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0027701 k( 165) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027701 k( 166) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0027701 k( 167) = ( 0.0000000 0.0000000 0.2738095), wk = 0.0027701 k( 168) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0027701 k( 169) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0027701 k( 170) = ( 0.0000000 0.0121951 0.2857143), wk = 0.0027701 k( 171) = ( 0.0000000 0.0243902 0.2857143), wk = 0.0027701 k( 172) = ( 0.0000000 0.0365854 0.2857143), wk = 0.0027701 k( 173) = ( 0.0000000 0.0487805 0.2857143), wk = 0.0027701 k( 174) = ( 0.0000000 0.0609756 0.2857143), wk = 0.0027701 k( 175) = ( 0.0000000 0.0731707 0.2857143), wk = 0.0027701 k( 176) = ( 0.0000000 0.0853658 0.2857143), wk = 0.0027701 k( 177) = ( 0.0000000 0.0975610 0.2857143), wk = 0.0027701 k( 178) = ( 0.0000000 0.1097561 0.2857143), wk = 0.0027701 k( 179) = ( 0.0000000 0.1219512 0.2857143), wk = 0.0027701 k( 180) = ( 0.0000000 0.1341463 0.2857143), wk = 0.0027701 k( 181) = ( 0.0000000 0.1463415 0.2857143), wk = 0.0027701 k( 182) = ( 0.0000000 0.1585366 0.2857143), wk = 0.0027701 k( 183) = ( 0.0000000 0.1707317 0.2857143), wk = 0.0027701 k( 184) = ( 0.0000000 0.1829268 0.2857143), wk = 0.0027701 k( 185) = ( 0.0000000 0.1951219 0.2857143), wk = 0.0027701 k( 186) = ( 0.0000000 0.2073171 0.2857143), wk = 0.0027701 k( 187) = ( 0.0000000 0.2195122 0.2857143), wk = 0.0027701 k( 188) = ( 0.0000000 0.2317073 0.2857143), wk = 0.0027701 k( 189) = ( 0.0000000 0.2439024 0.2857143), wk = 0.0027701 k( 190) = ( 0.0000000 0.2560976 0.2857143), wk = 0.0027701 k( 191) = ( 0.0000000 0.2682927 0.2857143), wk = 0.0027701 k( 192) = ( 0.0000000 0.2804878 0.2857143), wk = 0.0027701 k( 193) = ( 0.0000000 0.2926829 0.2857143), wk = 0.0027701 k( 194) = ( 0.0000000 0.3048781 0.2857143), wk = 0.0027701 k( 195) = ( 0.0000000 0.3170732 0.2857143), wk = 0.0027701 k( 196) = ( 0.0000000 0.3292683 0.2857143), wk = 0.0027701 k( 197) = ( 0.0000000 0.3414634 0.2857143), wk = 0.0027701 k( 198) = ( 0.0000000 0.3536585 0.2857143), wk = 0.0027701 k( 199) = ( 0.0000000 0.3658537 0.2857143), wk = 0.0027701 k( 200) = ( 0.0000000 0.3780488 0.2857143), wk = 0.0027701 k( 201) = ( 0.0000000 0.3902439 0.2857143), wk = 0.0027701 k( 202) = ( 0.0000000 0.4024390 0.2857143), wk = 0.0027701 k( 203) = ( 0.0000000 0.4146341 0.2857143), wk = 0.0027701 k( 204) = ( 0.0000000 0.4268293 0.2857143), wk = 0.0027701 k( 205) = ( 0.0000000 0.4390244 0.2857143), wk = 0.0027701 k( 206) = ( 0.0000000 0.4512195 0.2857143), wk = 0.0027701 k( 207) = ( 0.0000000 0.4634146 0.2857143), wk = 0.0027701 k( 208) = ( 0.0000000 0.4756098 0.2857143), wk = 0.0027701 k( 209) = ( 0.0000000 0.4878049 0.2857143), wk = 0.0027701 k( 210) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0027701 k( 211) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0027701 k( 212) = ( 0.0121951 0.5000000 0.2857143), wk = 0.0027701 k( 213) = ( 0.0243902 0.5000000 0.2857143), wk = 0.0027701 k( 214) = ( 0.0365854 0.5000000 0.2857143), wk = 0.0027701 k( 215) = ( 0.0487805 0.5000000 0.2857143), wk = 0.0027701 k( 216) = ( 0.0609756 0.5000000 0.2857143), wk = 0.0027701 k( 217) = ( 0.0731707 0.5000000 0.2857143), wk = 0.0027701 k( 218) = ( 0.0853658 0.5000000 0.2857143), wk = 0.0027701 k( 219) = ( 0.0975610 0.5000000 0.2857143), wk = 0.0027701 k( 220) = ( 0.1097561 0.5000000 0.2857143), wk = 0.0027701 k( 221) = ( 0.1219512 0.5000000 0.2857143), wk = 0.0027701 k( 222) = ( 0.1341463 0.5000000 0.2857143), wk = 0.0027701 k( 223) = ( 0.1463415 0.5000000 0.2857143), wk = 0.0027701 k( 224) = ( 0.1585366 0.5000000 0.2857143), wk = 0.0027701 k( 225) = ( 0.1707317 0.5000000 0.2857143), wk = 0.0027701 k( 226) = ( 0.1829268 0.5000000 0.2857143), wk = 0.0027701 k( 227) = ( 0.1951219 0.5000000 0.2857143), wk = 0.0027701 k( 228) = ( 0.2073171 0.5000000 0.2857143), wk = 0.0027701 k( 229) = ( 0.2195122 0.5000000 0.2857143), wk = 0.0027701 k( 230) = ( 0.2317073 0.5000000 0.2857143), wk = 0.0027701 k( 231) = ( 0.2439024 0.5000000 0.2857143), wk = 0.0027701 k( 232) = ( 0.2560976 0.5000000 0.2857143), wk = 0.0027701 k( 233) = ( 0.2682927 0.5000000 0.2857143), wk = 0.0027701 k( 234) = ( 0.2804878 0.5000000 0.2857143), wk = 0.0027701 k( 235) = ( 0.2926829 0.5000000 0.2857143), wk = 0.0027701 k( 236) = ( 0.3048781 0.5000000 0.2857143), wk = 0.0027701 k( 237) = ( 0.3170732 0.5000000 0.2857143), wk = 0.0027701 k( 238) = ( 0.3292683 0.5000000 0.2857143), wk = 0.0027701 k( 239) = ( 0.3414634 0.5000000 0.2857143), wk = 0.0027701 k( 240) = ( 0.3536585 0.5000000 0.2857143), wk = 0.0027701 k( 241) = ( 0.3658537 0.5000000 0.2857143), wk = 0.0027701 k( 242) = ( 0.3780488 0.5000000 0.2857143), wk = 0.0027701 k( 243) = ( 0.3902439 0.5000000 0.2857143), wk = 0.0027701 k( 244) = ( 0.4024390 0.5000000 0.2857143), wk = 0.0027701 k( 245) = ( 0.4146341 0.5000000 0.2857143), wk = 0.0027701 k( 246) = ( 0.4268293 0.5000000 0.2857143), wk = 0.0027701 k( 247) = ( 0.4390244 0.5000000 0.2857143), wk = 0.0027701 k( 248) = ( 0.4512195 0.5000000 0.2857143), wk = 0.0027701 k( 249) = ( 0.4634146 0.5000000 0.2857143), wk = 0.0027701 k( 250) = ( 0.4756098 0.5000000 0.2857143), wk = 0.0027701 k( 251) = ( 0.4878049 0.5000000 0.2857143), wk = 0.0027701 k( 252) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0027701 k( 253) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0027701 k( 254) = ( 0.4913793 0.4913793 0.2857143), wk = 0.0027701 k( 255) = ( 0.4827586 0.4827586 0.2857143), wk = 0.0027701 k( 256) = ( 0.4741379 0.4741379 0.2857143), wk = 0.0027701 k( 257) = ( 0.4655172 0.4655172 0.2857143), wk = 0.0027701 k( 258) = ( 0.4568966 0.4568965 0.2857143), wk = 0.0027701 k( 259) = ( 0.4482759 0.4482759 0.2857143), wk = 0.0027701 k( 260) = ( 0.4396552 0.4396552 0.2857143), wk = 0.0027701 k( 261) = ( 0.4310345 0.4310345 0.2857143), wk = 0.0027701 k( 262) = ( 0.4224138 0.4224138 0.2857143), wk = 0.0027701 k( 263) = ( 0.4137931 0.4137931 0.2857143), wk = 0.0027701 k( 264) = ( 0.4051724 0.4051724 0.2857143), wk = 0.0027701 k( 265) = ( 0.3965517 0.3965517 0.2857143), wk = 0.0027701 k( 266) = ( 0.3879310 0.3879310 0.2857143), wk = 0.0027701 k( 267) = ( 0.3793103 0.3793103 0.2857143), wk = 0.0027701 k( 268) = ( 0.3706897 0.3706897 0.2857143), wk = 0.0027701 k( 269) = ( 0.3620690 0.3620690 0.2857143), wk = 0.0027701 k( 270) = ( 0.3534483 0.3534483 0.2857143), wk = 0.0027701 k( 271) = ( 0.3448276 0.3448276 0.2857143), wk = 0.0027701 k( 272) = ( 0.3362069 0.3362069 0.2857143), wk = 0.0027701 k( 273) = ( 0.3275862 0.3275862 0.2857143), wk = 0.0027701 k( 274) = ( 0.3189655 0.3189655 0.2857143), wk = 0.0027701 k( 275) = ( 0.3103448 0.3103448 0.2857143), wk = 0.0027701 k( 276) = ( 0.3017241 0.3017241 0.2857143), wk = 0.0027701 k( 277) = ( 0.2931034 0.2931034 0.2857143), wk = 0.0027701 k( 278) = ( 0.2844828 0.2844828 0.2857143), wk = 0.0027701 k( 279) = ( 0.2758621 0.2758621 0.2857143), wk = 0.0027701 k( 280) = ( 0.2672414 0.2672414 0.2857143), wk = 0.0027701 k( 281) = ( 0.2586207 0.2586207 0.2857143), wk = 0.0027701 k( 282) = ( 0.2500000 0.2500000 0.2857143), wk = 0.0027701 k( 283) = ( 0.2413793 0.2413793 0.2857143), wk = 0.0027701 k( 284) = ( 0.2327586 0.2327586 0.2857143), wk = 0.0027701 k( 285) = ( 0.2241379 0.2241379 0.2857143), wk = 0.0027701 k( 286) = ( 0.2155172 0.2155172 0.2857143), wk = 0.0027701 k( 287) = ( 0.2068966 0.2068965 0.2857143), wk = 0.0027701 k( 288) = ( 0.1982759 0.1982759 0.2857143), wk = 0.0027701 k( 289) = ( 0.1896552 0.1896552 0.2857143), wk = 0.0027701 k( 290) = ( 0.1810345 0.1810345 0.2857143), wk = 0.0027701 k( 291) = ( 0.1724138 0.1724138 0.2857143), wk = 0.0027701 k( 292) = ( 0.1637931 0.1637931 0.2857143), wk = 0.0027701 k( 293) = ( 0.1551724 0.1551724 0.2857143), wk = 0.0027701 k( 294) = ( 0.1465517 0.1465517 0.2857143), wk = 0.0027701 k( 295) = ( 0.1379310 0.1379310 0.2857143), wk = 0.0027701 k( 296) = ( 0.1293103 0.1293103 0.2857143), wk = 0.0027701 k( 297) = ( 0.1206897 0.1206897 0.2857143), wk = 0.0027701 k( 298) = ( 0.1120690 0.1120690 0.2857143), wk = 0.0027701 k( 299) = ( 0.1034483 0.1034483 0.2857143), wk = 0.0027701 k( 300) = ( 0.0948276 0.0948276 0.2857143), wk = 0.0027701 k( 301) = ( 0.0862069 0.0862069 0.2857143), wk = 0.0027701 k( 302) = ( 0.0775862 0.0775862 0.2857143), wk = 0.0027701 k( 303) = ( 0.0689655 0.0689655 0.2857143), wk = 0.0027701 k( 304) = ( 0.0603448 0.0603448 0.2857143), wk = 0.0027701 k( 305) = ( 0.0517241 0.0517241 0.2857143), wk = 0.0027701 k( 306) = ( 0.0431035 0.0431034 0.2857143), wk = 0.0027701 k( 307) = ( 0.0344828 0.0344828 0.2857143), wk = 0.0027701 k( 308) = ( 0.0258621 0.0258621 0.2857143), wk = 0.0027701 k( 309) = ( 0.0172414 0.0172414 0.2857143), wk = 0.0027701 k( 310) = ( 0.0086207 0.0086207 0.2857143), wk = 0.0027701 k( 311) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0027701 k( 312) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027701 k( 313) = ( 0.0000000 0.5000000 0.0119048), wk = 0.0027701 k( 314) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0027701 k( 315) = ( 0.0000000 0.5000000 0.0357143), wk = 0.0027701 k( 316) = ( 0.0000000 0.5000000 0.0476190), wk = 0.0027701 k( 317) = ( 0.0000000 0.5000000 0.0595238), wk = 0.0027701 k( 318) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0027701 k( 319) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0027701 k( 320) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0027701 k( 321) = ( 0.0000000 0.5000000 0.1071429), wk = 0.0027701 k( 322) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0027701 k( 323) = ( 0.0000000 0.5000000 0.1309524), wk = 0.0027701 k( 324) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0027701 k( 325) = ( 0.0000000 0.5000000 0.1547619), wk = 0.0027701 k( 326) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0027701 k( 327) = ( 0.0000000 0.5000000 0.1785714), wk = 0.0027701 k( 328) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0027701 k( 329) = ( 0.0000000 0.5000000 0.2023810), wk = 0.0027701 k( 330) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0027701 k( 331) = ( 0.0000000 0.5000000 0.2261905), wk = 0.0027701 k( 332) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0027701 k( 333) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0027701 k( 334) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0027701 k( 335) = ( 0.0000000 0.5000000 0.2738095), wk = 0.0027701 k( 336) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0027701 k( 337) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 338) = ( 0.5000000 0.5000000 0.0119048), wk = 0.0027701 k( 339) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0027701 k( 340) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0027701 k( 341) = ( 0.5000000 0.5000000 0.0476190), wk = 0.0027701 k( 342) = ( 0.5000000 0.5000000 0.0595238), wk = 0.0027701 k( 343) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0027701 k( 344) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0027701 k( 345) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0027701 k( 346) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0027701 k( 347) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0027701 k( 348) = ( 0.5000000 0.5000000 0.1309524), wk = 0.0027701 k( 349) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0027701 k( 350) = ( 0.5000000 0.5000000 0.1547619), wk = 0.0027701 k( 351) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0027701 k( 352) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0027701 k( 353) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0027701 k( 354) = ( 0.5000000 0.5000000 0.2023810), wk = 0.0027701 k( 355) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0027701 k( 356) = ( 0.5000000 0.5000000 0.2261905), wk = 0.0027701 k( 357) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0027701 k( 358) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0027701 k( 359) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0027701 k( 360) = ( 0.5000000 0.5000000 0.2738095), wk = 0.0027701 k( 361) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0027701 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 2) = ( 0.0000000 0.0121951 0.0000000), wk = 0.0027701 k( 3) = ( 0.0000000 0.0243902 0.0000000), wk = 0.0027701 k( 4) = ( 0.0000000 0.0365854 0.0000000), wk = 0.0027701 k( 5) = ( 0.0000000 0.0487805 0.0000000), wk = 0.0027701 k( 6) = ( 0.0000000 0.0609756 0.0000000), wk = 0.0027701 k( 7) = ( 0.0000000 0.0731707 0.0000000), wk = 0.0027701 k( 8) = ( 0.0000000 0.0853658 -0.0000000), wk = 0.0027701 k( 9) = ( 0.0000000 0.0975610 0.0000000), wk = 0.0027701 k( 10) = ( 0.0000000 0.1097561 0.0000000), wk = 0.0027701 k( 11) = ( 0.0000000 0.1219512 0.0000000), wk = 0.0027701 k( 12) = ( 0.0000000 0.1341463 0.0000000), wk = 0.0027701 k( 13) = ( 0.0000000 0.1463415 0.0000000), wk = 0.0027701 k( 14) = ( 0.0000000 0.1585366 0.0000000), wk = 0.0027701 k( 15) = ( 0.0000000 0.1707317 0.0000000), wk = 0.0027701 k( 16) = ( 0.0000000 0.1829268 0.0000000), wk = 0.0027701 k( 17) = ( 0.0000000 0.1951219 0.0000000), wk = 0.0027701 k( 18) = ( 0.0000000 0.2073171 -0.0000000), wk = 0.0027701 k( 19) = ( 0.0000000 0.2195122 0.0000000), wk = 0.0027701 k( 20) = ( 0.0000000 0.2317073 -0.0000000), wk = 0.0027701 k( 21) = ( 0.0000000 0.2439024 0.0000000), wk = 0.0027701 k( 22) = ( 0.0000000 0.2560976 -0.0000000), wk = 0.0027701 k( 23) = ( 0.0000000 0.2682927 0.0000000), wk = 0.0027701 k( 24) = ( 0.0000000 0.2804878 0.0000000), wk = 0.0027701 k( 25) = ( 0.0000000 0.2926829 0.0000000), wk = 0.0027701 k( 26) = ( 0.0000000 0.3048781 0.0000000), wk = 0.0027701 k( 27) = ( 0.0000000 0.3170732 0.0000000), wk = 0.0027701 k( 28) = ( 0.0000000 0.3292683 -0.0000000), wk = 0.0027701 k( 29) = ( 0.0000000 0.3414634 -0.0000000), wk = 0.0027701 k( 30) = ( 0.0000000 0.3536585 0.0000000), wk = 0.0027701 k( 31) = ( 0.0000000 0.3658537 0.0000000), wk = 0.0027701 k( 32) = ( 0.0000000 0.3780488 0.0000000), wk = 0.0027701 k( 33) = ( 0.0000000 0.3902439 0.0000000), wk = 0.0027701 k( 34) = ( 0.0000000 0.4024390 0.0000000), wk = 0.0027701 k( 35) = ( 0.0000000 0.4146341 0.0000000), wk = 0.0027701 k( 36) = ( 0.0000000 0.4268293 -0.0000000), wk = 0.0027701 k( 37) = ( 0.0000000 0.4390244 0.0000000), wk = 0.0027701 k( 38) = ( 0.0000000 0.4512195 0.0000000), wk = 0.0027701 k( 39) = ( 0.0000000 0.4634146 0.0000000), wk = 0.0027701 k( 40) = ( 0.0000000 0.4756098 0.0000000), wk = 0.0027701 k( 41) = ( 0.0000000 0.4878049 0.0000000), wk = 0.0027701 k( 42) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027701 k( 43) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027701 k( 44) = ( 0.0121951 0.5000000 -0.0000000), wk = 0.0027701 k( 45) = ( 0.0243902 0.5000000 0.0000000), wk = 0.0027701 k( 46) = ( 0.0365854 0.5000000 0.0000000), wk = 0.0027701 k( 47) = ( 0.0487805 0.5000000 0.0000000), wk = 0.0027701 k( 48) = ( 0.0609756 0.5000000 0.0000000), wk = 0.0027701 k( 49) = ( 0.0731707 0.5000000 0.0000000), wk = 0.0027701 k( 50) = ( 0.0853658 0.5000000 0.0000000), wk = 0.0027701 k( 51) = ( 0.0975610 0.5000000 0.0000000), wk = 0.0027701 k( 52) = ( 0.1097561 0.5000000 0.0000000), wk = 0.0027701 k( 53) = ( 0.1219512 0.5000000 0.0000000), wk = 0.0027701 k( 54) = ( 0.1341463 0.5000000 -0.0000000), wk = 0.0027701 k( 55) = ( 0.1463415 0.5000000 -0.0000000), wk = 0.0027701 k( 56) = ( 0.1585366 0.5000000 0.0000000), wk = 0.0027701 k( 57) = ( 0.1707317 0.5000000 -0.0000000), wk = 0.0027701 k( 58) = ( 0.1829268 0.5000000 0.0000000), wk = 0.0027701 k( 59) = ( 0.1951219 0.5000000 0.0000000), wk = 0.0027701 k( 60) = ( 0.2073171 0.5000000 0.0000000), wk = 0.0027701 k( 61) = ( 0.2195122 0.5000000 0.0000000), wk = 0.0027701 k( 62) = ( 0.2317073 0.5000000 0.0000000), wk = 0.0027701 k( 63) = ( 0.2439024 0.5000000 0.0000000), wk = 0.0027701 k( 64) = ( 0.2560976 0.5000000 0.0000000), wk = 0.0027701 k( 65) = ( 0.2682927 0.5000000 -0.0000000), wk = 0.0027701 k( 66) = ( 0.2804878 0.5000000 0.0000000), wk = 0.0027701 k( 67) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0027701 k( 68) = ( 0.3048781 0.5000000 0.0000000), wk = 0.0027701 k( 69) = ( 0.3170732 0.5000000 0.0000000), wk = 0.0027701 k( 70) = ( 0.3292683 0.5000000 0.0000000), wk = 0.0027701 k( 71) = ( 0.3414634 0.5000000 -0.0000000), wk = 0.0027701 k( 72) = ( 0.3536585 0.5000000 -0.0000000), wk = 0.0027701 k( 73) = ( 0.3658537 0.5000000 0.0000000), wk = 0.0027701 k( 74) = ( 0.3780488 0.5000000 0.0000000), wk = 0.0027701 k( 75) = ( 0.3902439 0.5000000 0.0000000), wk = 0.0027701 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0027701 k( 77) = ( 0.4146341 0.5000000 0.0000000), wk = 0.0027701 k( 78) = ( 0.4268293 0.5000000 0.0000000), wk = 0.0027701 k( 79) = ( 0.4390244 0.5000000 0.0000000), wk = 0.0027701 k( 80) = ( 0.4512195 0.5000000 -0.0000000), wk = 0.0027701 k( 81) = ( 0.4634146 0.5000000 -0.0000000), wk = 0.0027701 k( 82) = ( 0.4756098 0.5000000 -0.0000000), wk = 0.0027701 k( 83) = ( 0.4878049 0.5000000 0.0000000), wk = 0.0027701 k( 84) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0027701 k( 85) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0027701 k( 86) = ( 0.4913793 0.4913793 0.0000000), wk = 0.0027701 k( 87) = ( 0.4827586 0.4827586 -0.0000000), wk = 0.0027701 k( 88) = ( 0.4741379 0.4741379 0.0000000), wk = 0.0027701 k( 89) = ( 0.4655172 0.4655172 0.0000000), wk = 0.0027701 k( 90) = ( 0.4568966 0.4568966 0.0000000), wk = 0.0027701 k( 91) = ( 0.4482759 0.4482759 -0.0000000), wk = 0.0027701 k( 92) = ( 0.4396552 0.4396552 0.0000000), wk = 0.0027701 k( 93) = ( 0.4310345 0.4310345 0.0000000), wk = 0.0027701 k( 94) = ( 0.4224138 0.4224138 -0.0000000), wk = 0.0027701 k( 95) = ( 0.4137931 0.4137931 0.0000000), wk = 0.0027701 k( 96) = ( 0.4051724 0.4051724 -0.0000000), wk = 0.0027701 k( 97) = ( 0.3965517 0.3965517 0.0000000), wk = 0.0027701 k( 98) = ( 0.3879310 0.3879310 0.0000000), wk = 0.0027701 k( 99) = ( 0.3793103 0.3793103 0.0000000), wk = 0.0027701 k( 100) = ( 0.3706897 0.3706897 -0.0000000), wk = 0.0027701 k( 101) = ( 0.3620690 0.3620690 0.0000000), wk = 0.0027701 k( 102) = ( 0.3534483 0.3534483 0.0000000), wk = 0.0027701 k( 103) = ( 0.3448276 0.3448276 -0.0000000), wk = 0.0027701 k( 104) = ( 0.3362069 0.3362069 -0.0000000), wk = 0.0027701 k( 105) = ( 0.3275862 0.3275862 -0.0000000), wk = 0.0027701 k( 106) = ( 0.3189655 0.3189655 -0.0000000), wk = 0.0027701 k( 107) = ( 0.3103448 0.3103448 0.0000000), wk = 0.0027701 k( 108) = ( 0.3017241 0.3017241 0.0000000), wk = 0.0027701 k( 109) = ( 0.2931034 0.2931034 0.0000000), wk = 0.0027701 k( 110) = ( 0.2844828 0.2844828 0.0000000), wk = 0.0027701 k( 111) = ( 0.2758621 0.2758621 0.0000000), wk = 0.0027701 k( 112) = ( 0.2672414 0.2672414 0.0000000), wk = 0.0027701 k( 113) = ( 0.2586207 0.2586207 0.0000000), wk = 0.0027701 k( 114) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0027701 k( 115) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0027701 k( 116) = ( 0.2327586 0.2327586 0.0000000), wk = 0.0027701 k( 117) = ( 0.2241379 0.2241379 -0.0000000), wk = 0.0027701 k( 118) = ( 0.2155172 0.2155172 0.0000000), wk = 0.0027701 k( 119) = ( 0.2068966 0.2068966 0.0000000), wk = 0.0027701 k( 120) = ( 0.1982759 0.1982759 0.0000000), wk = 0.0027701 k( 121) = ( 0.1896552 0.1896552 0.0000000), wk = 0.0027701 k( 122) = ( 0.1810345 0.1810345 -0.0000000), wk = 0.0027701 k( 123) = ( 0.1724138 0.1724138 0.0000000), wk = 0.0027701 k( 124) = ( 0.1637931 0.1637931 0.0000000), wk = 0.0027701 k( 125) = ( 0.1551724 0.1551724 0.0000000), wk = 0.0027701 k( 126) = ( 0.1465517 0.1465517 -0.0000000), wk = 0.0027701 k( 127) = ( 0.1379310 0.1379310 0.0000000), wk = 0.0027701 k( 128) = ( 0.1293103 0.1293103 0.0000000), wk = 0.0027701 k( 129) = ( 0.1206897 0.1206897 0.0000000), wk = 0.0027701 k( 130) = ( 0.1120690 0.1120690 0.0000000), wk = 0.0027701 k( 131) = ( 0.1034483 0.1034483 0.0000000), wk = 0.0027701 k( 132) = ( 0.0948276 0.0948276 -0.0000000), wk = 0.0027701 k( 133) = ( 0.0862069 0.0862069 0.0000000), wk = 0.0027701 k( 134) = ( 0.0775862 0.0775862 -0.0000000), wk = 0.0027701 k( 135) = ( 0.0689655 0.0689655 0.0000000), wk = 0.0027701 k( 136) = ( 0.0603448 0.0603448 0.0000000), wk = 0.0027701 k( 137) = ( 0.0517241 0.0517241 0.0000000), wk = 0.0027701 k( 138) = ( 0.0431035 0.0431035 0.0000000), wk = 0.0027701 k( 139) = ( 0.0344828 0.0344828 0.0000000), wk = 0.0027701 k( 140) = ( 0.0258621 0.0258621 0.0000000), wk = 0.0027701 k( 141) = ( 0.0172414 0.0172414 0.0000000), wk = 0.0027701 k( 142) = ( 0.0086207 0.0086207 0.0000000), wk = 0.0027701 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 145) = ( 0.0000000 0.0000000 0.0208333), wk = 0.0027701 k( 146) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0027701 k( 147) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0027701 k( 148) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0027701 k( 149) = ( 0.0000000 0.0000000 0.1041667), wk = 0.0027701 k( 150) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0027701 k( 151) = ( 0.0000000 0.0000000 0.1458333), wk = 0.0027701 k( 152) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0027701 k( 153) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0027701 k( 154) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0027701 k( 155) = ( 0.0000000 0.0000000 0.2291667), wk = 0.0027701 k( 156) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027701 k( 157) = ( 0.0000000 0.0000000 0.2708333), wk = 0.0027701 k( 158) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0027701 k( 159) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0027701 k( 160) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0027701 k( 161) = ( 0.0000000 0.0000000 0.3541667), wk = 0.0027701 k( 162) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0027701 k( 163) = ( 0.0000000 0.0000000 0.3958333), wk = 0.0027701 k( 164) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0027701 k( 165) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0027701 k( 166) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0027701 k( 167) = ( 0.0000000 0.0000000 0.4791667), wk = 0.0027701 k( 168) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 169) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 170) = ( 0.0000000 0.0121951 0.5000000), wk = 0.0027701 k( 171) = ( 0.0000000 0.0243902 0.5000000), wk = 0.0027701 k( 172) = ( 0.0000000 0.0365854 0.5000000), wk = 0.0027701 k( 173) = ( 0.0000000 0.0487805 0.5000000), wk = 0.0027701 k( 174) = ( 0.0000000 0.0609756 0.5000000), wk = 0.0027701 k( 175) = ( 0.0000000 0.0731707 0.5000000), wk = 0.0027701 k( 176) = ( 0.0000000 0.0853658 0.5000000), wk = 0.0027701 k( 177) = ( 0.0000000 0.0975610 0.5000000), wk = 0.0027701 k( 178) = ( 0.0000000 0.1097561 0.5000000), wk = 0.0027701 k( 179) = ( 0.0000000 0.1219512 0.5000000), wk = 0.0027701 k( 180) = ( 0.0000000 0.1341463 0.5000000), wk = 0.0027701 k( 181) = ( 0.0000000 0.1463415 0.5000000), wk = 0.0027701 k( 182) = ( 0.0000000 0.1585366 0.5000000), wk = 0.0027701 k( 183) = ( 0.0000000 0.1707317 0.5000000), wk = 0.0027701 k( 184) = ( 0.0000000 0.1829268 0.5000000), wk = 0.0027701 k( 185) = ( 0.0000000 0.1951219 0.5000000), wk = 0.0027701 k( 186) = ( 0.0000000 0.2073171 0.5000000), wk = 0.0027701 k( 187) = ( 0.0000000 0.2195122 0.5000000), wk = 0.0027701 k( 188) = ( 0.0000000 0.2317073 0.5000000), wk = 0.0027701 k( 189) = ( 0.0000000 0.2439024 0.5000000), wk = 0.0027701 k( 190) = ( 0.0000000 0.2560976 0.5000000), wk = 0.0027701 k( 191) = ( 0.0000000 0.2682927 0.5000000), wk = 0.0027701 k( 192) = ( 0.0000000 0.2804878 0.5000000), wk = 0.0027701 k( 193) = ( 0.0000000 0.2926829 0.5000000), wk = 0.0027701 k( 194) = ( 0.0000000 0.3048781 0.5000000), wk = 0.0027701 k( 195) = ( 0.0000000 0.3170732 0.5000000), wk = 0.0027701 k( 196) = ( 0.0000000 0.3292683 0.5000000), wk = 0.0027701 k( 197) = ( 0.0000000 0.3414634 0.5000000), wk = 0.0027701 k( 198) = ( 0.0000000 0.3536585 0.5000000), wk = 0.0027701 k( 199) = ( 0.0000000 0.3658537 0.5000000), wk = 0.0027701 k( 200) = ( 0.0000000 0.3780488 0.5000000), wk = 0.0027701 k( 201) = ( 0.0000000 0.3902439 0.5000000), wk = 0.0027701 k( 202) = ( 0.0000000 0.4024390 0.5000000), wk = 0.0027701 k( 203) = ( 0.0000000 0.4146341 0.5000000), wk = 0.0027701 k( 204) = ( 0.0000000 0.4268293 0.5000000), wk = 0.0027701 k( 205) = ( 0.0000000 0.4390244 0.5000000), wk = 0.0027701 k( 206) = ( 0.0000000 0.4512195 0.5000000), wk = 0.0027701 k( 207) = ( 0.0000000 0.4634146 0.5000000), wk = 0.0027701 k( 208) = ( 0.0000000 0.4756098 0.5000000), wk = 0.0027701 k( 209) = ( 0.0000000 0.4878049 0.5000000), wk = 0.0027701 k( 210) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027701 k( 211) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027701 k( 212) = ( 0.0121951 0.5000000 0.5000000), wk = 0.0027701 k( 213) = ( 0.0243902 0.5000000 0.5000000), wk = 0.0027701 k( 214) = ( 0.0365854 0.5000000 0.5000000), wk = 0.0027701 k( 215) = ( 0.0487805 0.5000000 0.5000000), wk = 0.0027701 k( 216) = ( 0.0609756 0.5000000 0.5000000), wk = 0.0027701 k( 217) = ( 0.0731707 0.5000000 0.5000000), wk = 0.0027701 k( 218) = ( 0.0853658 0.5000000 0.5000000), wk = 0.0027701 k( 219) = ( 0.0975610 0.5000000 0.5000000), wk = 0.0027701 k( 220) = ( 0.1097561 0.5000000 0.5000000), wk = 0.0027701 k( 221) = ( 0.1219512 0.5000000 0.5000000), wk = 0.0027701 k( 222) = ( 0.1341463 0.5000000 0.5000000), wk = 0.0027701 k( 223) = ( 0.1463415 0.5000000 0.5000000), wk = 0.0027701 k( 224) = ( 0.1585366 0.5000000 0.5000000), wk = 0.0027701 k( 225) = ( 0.1707317 0.5000000 0.5000000), wk = 0.0027701 k( 226) = ( 0.1829268 0.5000000 0.5000000), wk = 0.0027701 k( 227) = ( 0.1951219 0.5000000 0.5000000), wk = 0.0027701 k( 228) = ( 0.2073171 0.5000000 0.5000000), wk = 0.0027701 k( 229) = ( 0.2195122 0.5000000 0.5000000), wk = 0.0027701 k( 230) = ( 0.2317073 0.5000000 0.5000000), wk = 0.0027701 k( 231) = ( 0.2439024 0.5000000 0.5000000), wk = 0.0027701 k( 232) = ( 0.2560976 0.5000000 0.5000000), wk = 0.0027701 k( 233) = ( 0.2682927 0.5000000 0.5000000), wk = 0.0027701 k( 234) = ( 0.2804878 0.5000000 0.5000000), wk = 0.0027701 k( 235) = ( 0.2926829 0.5000000 0.5000000), wk = 0.0027701 k( 236) = ( 0.3048781 0.5000000 0.5000000), wk = 0.0027701 k( 237) = ( 0.3170732 0.5000000 0.5000000), wk = 0.0027701 k( 238) = ( 0.3292683 0.5000000 0.5000000), wk = 0.0027701 k( 239) = ( 0.3414634 0.5000000 0.5000000), wk = 0.0027701 k( 240) = ( 0.3536585 0.5000000 0.5000000), wk = 0.0027701 k( 241) = ( 0.3658537 0.5000000 0.5000000), wk = 0.0027701 k( 242) = ( 0.3780488 0.5000000 0.5000000), wk = 0.0027701 k( 243) = ( 0.3902439 0.5000000 0.5000000), wk = 0.0027701 k( 244) = ( 0.4024390 0.5000000 0.5000000), wk = 0.0027701 k( 245) = ( 0.4146341 0.5000000 0.5000000), wk = 0.0027701 k( 246) = ( 0.4268293 0.5000000 0.5000000), wk = 0.0027701 k( 247) = ( 0.4390244 0.5000000 0.5000000), wk = 0.0027701 k( 248) = ( 0.4512195 0.5000000 0.5000000), wk = 0.0027701 k( 249) = ( 0.4634146 0.5000000 0.5000000), wk = 0.0027701 k( 250) = ( 0.4756098 0.5000000 0.5000000), wk = 0.0027701 k( 251) = ( 0.4878049 0.5000000 0.5000000), wk = 0.0027701 k( 252) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027701 k( 253) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027701 k( 254) = ( 0.4913793 0.4913793 0.5000000), wk = 0.0027701 k( 255) = ( 0.4827586 0.4827586 0.5000000), wk = 0.0027701 k( 256) = ( 0.4741379 0.4741379 0.5000000), wk = 0.0027701 k( 257) = ( 0.4655172 0.4655172 0.5000000), wk = 0.0027701 k( 258) = ( 0.4568966 0.4568966 0.5000000), wk = 0.0027701 k( 259) = ( 0.4482759 0.4482759 0.5000000), wk = 0.0027701 k( 260) = ( 0.4396552 0.4396552 0.5000000), wk = 0.0027701 k( 261) = ( 0.4310345 0.4310345 0.5000000), wk = 0.0027701 k( 262) = ( 0.4224138 0.4224138 0.5000000), wk = 0.0027701 k( 263) = ( 0.4137931 0.4137931 0.5000000), wk = 0.0027701 k( 264) = ( 0.4051724 0.4051724 0.5000000), wk = 0.0027701 k( 265) = ( 0.3965517 0.3965517 0.5000000), wk = 0.0027701 k( 266) = ( 0.3879310 0.3879310 0.5000000), wk = 0.0027701 k( 267) = ( 0.3793103 0.3793103 0.5000000), wk = 0.0027701 k( 268) = ( 0.3706897 0.3706897 0.5000000), wk = 0.0027701 k( 269) = ( 0.3620690 0.3620690 0.5000000), wk = 0.0027701 k( 270) = ( 0.3534483 0.3534483 0.5000000), wk = 0.0027701 k( 271) = ( 0.3448276 0.3448276 0.5000000), wk = 0.0027701 k( 272) = ( 0.3362069 0.3362069 0.5000000), wk = 0.0027701 k( 273) = ( 0.3275862 0.3275862 0.5000000), wk = 0.0027701 k( 274) = ( 0.3189655 0.3189655 0.5000000), wk = 0.0027701 k( 275) = ( 0.3103448 0.3103448 0.5000000), wk = 0.0027701 k( 276) = ( 0.3017241 0.3017241 0.5000000), wk = 0.0027701 k( 277) = ( 0.2931034 0.2931034 0.5000000), wk = 0.0027701 k( 278) = ( 0.2844828 0.2844828 0.5000000), wk = 0.0027701 k( 279) = ( 0.2758621 0.2758621 0.5000000), wk = 0.0027701 k( 280) = ( 0.2672414 0.2672414 0.5000000), wk = 0.0027701 k( 281) = ( 0.2586207 0.2586207 0.5000000), wk = 0.0027701 k( 282) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0027701 k( 283) = ( 0.2413793 0.2413793 0.5000000), wk = 0.0027701 k( 284) = ( 0.2327586 0.2327586 0.5000000), wk = 0.0027701 k( 285) = ( 0.2241379 0.2241379 0.5000000), wk = 0.0027701 k( 286) = ( 0.2155172 0.2155172 0.5000000), wk = 0.0027701 k( 287) = ( 0.2068966 0.2068966 0.5000000), wk = 0.0027701 k( 288) = ( 0.1982759 0.1982759 0.5000000), wk = 0.0027701 k( 289) = ( 0.1896552 0.1896552 0.5000000), wk = 0.0027701 k( 290) = ( 0.1810345 0.1810345 0.5000000), wk = 0.0027701 k( 291) = ( 0.1724138 0.1724138 0.5000000), wk = 0.0027701 k( 292) = ( 0.1637931 0.1637931 0.5000000), wk = 0.0027701 k( 293) = ( 0.1551724 0.1551724 0.5000000), wk = 0.0027701 k( 294) = ( 0.1465517 0.1465517 0.5000000), wk = 0.0027701 k( 295) = ( 0.1379310 0.1379310 0.5000000), wk = 0.0027701 k( 296) = ( 0.1293103 0.1293103 0.5000000), wk = 0.0027701 k( 297) = ( 0.1206897 0.1206897 0.5000000), wk = 0.0027701 k( 298) = ( 0.1120690 0.1120690 0.5000000), wk = 0.0027701 k( 299) = ( 0.1034483 0.1034483 0.5000000), wk = 0.0027701 k( 300) = ( 0.0948276 0.0948276 0.5000000), wk = 0.0027701 k( 301) = ( 0.0862069 0.0862069 0.5000000), wk = 0.0027701 k( 302) = ( 0.0775862 0.0775862 0.5000000), wk = 0.0027701 k( 303) = ( 0.0689655 0.0689655 0.5000000), wk = 0.0027701 k( 304) = ( 0.0603448 0.0603448 0.5000000), wk = 0.0027701 k( 305) = ( 0.0517241 0.0517241 0.5000000), wk = 0.0027701 k( 306) = ( 0.0431035 0.0431035 0.5000000), wk = 0.0027701 k( 307) = ( 0.0344828 0.0344828 0.5000000), wk = 0.0027701 k( 308) = ( 0.0258621 0.0258621 0.5000000), wk = 0.0027701 k( 309) = ( 0.0172414 0.0172414 0.5000000), wk = 0.0027701 k( 310) = ( 0.0086207 0.0086207 0.5000000), wk = 0.0027701 k( 311) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 312) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027701 k( 313) = ( 0.0000000 0.5000000 0.0208333), wk = 0.0027701 k( 314) = ( 0.0000000 0.5000000 0.0416667), wk = 0.0027701 k( 315) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0027701 k( 316) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0027701 k( 317) = ( 0.0000000 0.5000000 0.1041667), wk = 0.0027701 k( 318) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0027701 k( 319) = ( 0.0000000 0.5000000 0.1458333), wk = 0.0027701 k( 320) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0027701 k( 321) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0027701 k( 322) = ( 0.0000000 0.5000000 0.2083333), wk = 0.0027701 k( 323) = ( 0.0000000 0.5000000 0.2291667), wk = 0.0027701 k( 324) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0027701 k( 325) = ( 0.0000000 0.5000000 0.2708333), wk = 0.0027701 k( 326) = ( 0.0000000 0.5000000 0.2916667), wk = 0.0027701 k( 327) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0027701 k( 328) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0027701 k( 329) = ( 0.0000000 0.5000000 0.3541667), wk = 0.0027701 k( 330) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0027701 k( 331) = ( 0.0000000 0.5000000 0.3958333), wk = 0.0027701 k( 332) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0027701 k( 333) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0027701 k( 334) = ( 0.0000000 0.5000000 0.4583333), wk = 0.0027701 k( 335) = ( 0.0000000 0.5000000 0.4791667), wk = 0.0027701 k( 336) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027701 k( 337) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0027701 k( 338) = ( 0.5000000 0.5000000 0.0208333), wk = 0.0027701 k( 339) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0027701 k( 340) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0027701 k( 341) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0027701 k( 342) = ( 0.5000000 0.5000000 0.1041667), wk = 0.0027701 k( 343) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0027701 k( 344) = ( 0.5000000 0.5000000 0.1458333), wk = 0.0027701 k( 345) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0027701 k( 346) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0027701 k( 347) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0027701 k( 348) = ( 0.5000000 0.5000000 0.2291667), wk = 0.0027701 k( 349) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0027701 k( 350) = ( 0.5000000 0.5000000 0.2708333), wk = 0.0027701 k( 351) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0027701 k( 352) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0027701 k( 353) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0027701 k( 354) = ( 0.5000000 0.5000000 0.3541667), wk = 0.0027701 k( 355) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0027701 k( 356) = ( 0.5000000 0.5000000 0.3958333), wk = 0.0027701 k( 357) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0027701 k( 358) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0027701 k( 359) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0027701 k( 360) = ( 0.5000000 0.5000000 0.4791667), wk = 0.0027701 k( 361) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027701 Dense grid: 106361 G-vectors FFT dimensions: ( 50, 50, 90) Smooth grid: 24729 G-vectors FFT dimensions: ( 32, 32, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 190, 70) NL pseudopotentials 0.35 Mb ( 95, 238) Each V/rho on FFT grid 0.11 Mb ( 7500) Each G-vector array 0.02 Mb ( 2956) G-vector shells 0.01 Mb ( 1195) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.81 Mb ( 190, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.51 Mb ( 238, 2, 70) The potential is recalculated from file : ./AlPPt5.save/charge-density.dat Starting wfc are 106 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.6 secs Computing kpt #: 2 total cpu time spent up to now is 4.4 secs Computing kpt #: 3 total cpu time spent up to now is 5.3 secs Computing kpt #: 4 total cpu time spent up to now is 6.2 secs Computing kpt #: 5 total cpu time spent up to now is 7.2 secs Computing kpt #: 6 total cpu time spent up to now is 8.2 secs Computing kpt #: 7 total cpu time spent up to now is 9.1 secs Computing kpt #: 8 total cpu time spent up to now is 10.1 secs Computing kpt #: 9 total cpu time spent up to now is 11.1 secs Computing kpt #: 10 total cpu time spent up to now is 12.0 secs Computing kpt #: 11 total cpu time spent up to now is 12.9 secs Computing kpt #: 12 total cpu time spent up to now is 13.7 secs Computing kpt #: 13 total cpu time spent up to now is 14.6 secs Computing kpt #: 14 total cpu time spent up to now is 15.4 secs Computing kpt #: 15 total cpu time spent up to now is 16.2 secs Computing kpt #: 16 total cpu time spent up to now is 17.0 secs Computing kpt #: 17 total cpu time spent up to now is 17.8 secs Computing kpt #: 18 total cpu time spent up to now is 18.5 secs Computing kpt #: 19 total cpu time spent up to now is 19.3 secs Computing kpt #: 20 total cpu time spent up to now is 20.1 secs Computing kpt #: 21 total cpu time spent up to now is 20.8 secs Computing kpt #: 22 total cpu time spent up to now is 21.6 secs Computing kpt #: 23 total cpu time spent up to now is 22.4 secs Computing kpt #: 24 total cpu time spent up to now is 23.2 secs Computing kpt #: 25 total cpu time spent up to now is 24.0 secs Computing kpt #: 26 total cpu time spent up to now is 24.8 secs Computing kpt #: 27 total cpu time spent up to now is 25.6 secs Computing kpt #: 28 total cpu time spent up to now is 26.4 secs Computing kpt #: 29 total cpu time spent up to now is 27.4 secs Computing kpt #: 30 total cpu time spent up to now is 28.3 secs Computing kpt #: 31 total cpu time spent up to now is 29.3 secs Computing kpt #: 32 total cpu time spent up to now is 30.2 secs Computing kpt #: 33 total cpu time spent up to now is 31.1 secs Computing kpt #: 34 total cpu time spent up to now is 32.0 secs Computing kpt #: 35 total cpu time spent up to now is 32.9 secs Computing kpt #: 36 total cpu time spent up to now is 33.8 secs Computing kpt #: 37 total cpu time spent up to now is 34.7 secs Computing kpt #: 38 total cpu time spent up to now is 35.6 secs Computing kpt #: 39 total cpu time spent up to now is 36.5 secs Computing kpt #: 40 total cpu time spent up to now is 37.3 secs Computing kpt #: 41 total cpu time spent up to now is 38.2 secs Computing kpt #: 42 total cpu time spent up to now is 39.1 secs Computing kpt #: 43 total cpu time spent up to now is 40.0 secs Computing kpt #: 44 total cpu time spent up to now is 40.8 secs Computing kpt #: 45 total cpu time spent up to now is 41.7 secs Computing kpt #: 46 total cpu time spent up to now is 42.5 secs Computing kpt #: 47 total cpu time spent up to now is 43.4 secs Computing kpt #: 48 total cpu time spent up to now is 44.3 secs Computing kpt #: 49 total cpu time spent up to now is 45.2 secs Computing kpt #: 50 total cpu time spent up to now is 46.0 secs Computing kpt #: 51 total cpu time spent up to now is 46.9 secs Computing kpt #: 52 total cpu time spent up to now is 47.7 secs Computing kpt #: 53 total cpu time spent up to now is 48.6 secs Computing kpt #: 54 total cpu time spent up to now is 49.5 secs Computing kpt #: 55 total cpu time spent up to now is 50.3 secs Computing kpt #: 56 total cpu time spent up to now is 51.2 secs Computing kpt #: 57 total cpu time spent up to now is 52.2 secs Computing kpt #: 58 total cpu time spent up to now is 53.1 secs Computing kpt #: 59 total cpu time spent up to now is 54.1 secs Computing kpt #: 60 total cpu time spent up to now is 55.1 secs Computing kpt #: 61 total cpu time spent up to now is 56.0 secs Computing kpt #: 62 total cpu time spent up to now is 56.9 secs Computing kpt #: 63 total cpu time spent up to now is 57.8 secs Computing kpt #: 64 total cpu time spent up to now is 58.7 secs Computing kpt #: 65 total cpu time spent up to now is 59.6 secs Computing kpt #: 66 total cpu time spent up to now is 60.5 secs Computing kpt #: 67 total cpu time spent up to now is 61.4 secs Computing kpt #: 68 total cpu time spent up to now is 62.3 secs Computing kpt #: 69 total cpu time spent up to now is 63.1 secs Computing kpt #: 70 total cpu time spent up to now is 64.0 secs Computing kpt #: 71 total cpu time spent up to now is 64.9 secs Computing kpt #: 72 total cpu time spent up to now is 65.8 secs Computing kpt #: 73 total cpu time spent up to now is 66.6 secs Computing kpt #: 74 total cpu time spent up to now is 68.4 secs Computing kpt #: 75 total cpu time spent up to now is 69.3 secs Computing kpt #: 76 total cpu time spent up to now is 70.1 secs Computing kpt #: 77 total cpu time spent up to now is 71.0 secs Computing kpt #: 78 total cpu time spent up to now is 71.9 secs Computing kpt #: 79 total cpu time spent up to now is 72.8 secs Computing kpt #: 80 total cpu time spent up to now is 73.7 secs Computing kpt #: 81 total cpu time spent up to now is 74.6 secs Computing kpt #: 82 total cpu time spent up to now is 75.5 secs Computing kpt #: 83 total cpu time spent up to now is 76.4 secs Computing kpt #: 84 total cpu time spent up to now is 77.3 secs Computing kpt #: 85 total cpu time spent up to now is 78.2 secs Computing kpt #: 86 total cpu time spent up to now is 79.1 secs Computing kpt #: 87 total cpu time spent up to now is 80.0 secs Computing kpt #: 88 total cpu time spent up to now is 80.9 secs Computing kpt #: 89 total cpu time spent up to now is 81.8 secs Computing kpt #: 90 total cpu time spent up to now is 82.7 secs Computing kpt #: 91 total cpu time spent up to now is 83.6 secs Computing kpt #: 92 total cpu time spent up to now is 84.5 secs Computing kpt #: 93 total cpu time spent up to now is 85.3 secs Computing kpt #: 94 total cpu time spent up to now is 86.1 secs Computing kpt #: 95 total cpu time spent up to now is 86.9 secs Computing kpt #: 96 total cpu time spent up to now is 87.7 secs Computing kpt #: 97 total cpu time spent up to now is 88.6 secs Computing kpt #: 98 total cpu time spent up to now is 89.4 secs Computing kpt #: 99 total cpu time spent up to now is 90.2 secs Computing kpt #: 100 total cpu time spent up to now is 91.0 secs Computing kpt #: 101 total cpu time spent up to now is 91.7 secs Computing kpt #: 102 total cpu time spent up to now is 92.5 secs Computing kpt #: 103 total cpu time spent up to now is 93.3 secs Computing kpt #: 104 total cpu time spent up to now is 94.1 secs Computing kpt #: 105 total cpu time spent up to now is 94.8 secs Computing kpt #: 106 total cpu time spent up to now is 95.6 secs Computing kpt #: 107 total cpu time spent up to now is 96.4 secs Computing kpt #: 108 total cpu time spent up to now is 97.1 secs Computing kpt #: 109 total cpu time spent up to now is 97.9 secs Computing kpt #: 110 total cpu time spent up to now is 98.8 secs Computing kpt #: 111 total cpu time spent up to now is 99.7 secs Computing kpt #: 112 total cpu time spent up to now is 100.5 secs Computing kpt #: 113 total cpu time spent up to now is 101.4 secs Computing kpt #: 114 total cpu time spent up to now is 102.3 secs Computing kpt #: 115 total cpu time spent up to now is 103.2 secs Computing kpt #: 116 total cpu time spent up to now is 104.1 secs Computing kpt #: 117 total cpu time spent up to now is 105.2 secs Computing kpt #: 118 total cpu time spent up to now is 106.3 secs Computing kpt #: 119 total cpu time spent up to now is 107.4 secs Computing kpt #: 120 total cpu time spent up to now is 108.5 secs Computing kpt #: 121 total cpu time spent up to now is 109.5 secs Computing kpt #: 122 total cpu time spent up to now is 110.5 secs Computing kpt #: 123 total cpu time spent up to now is 111.5 secs Computing kpt #: 124 total cpu time spent up to now is 112.5 secs Computing kpt #: 125 total cpu time spent up to now is 113.6 secs Computing kpt #: 126 total cpu time spent up to now is 114.6 secs Computing kpt #: 127 total cpu time spent up to now is 115.6 secs Computing kpt #: 128 total cpu time spent up to now is 116.7 secs Computing kpt #: 129 total cpu time spent up to now is 117.9 secs Computing kpt #: 130 total cpu time spent up to now is 119.0 secs Computing kpt #: 131 total cpu time spent up to now is 120.1 secs Computing kpt #: 132 total cpu time spent up to now is 121.3 secs Computing kpt #: 133 total cpu time spent up to now is 122.2 secs Computing kpt #: 134 total cpu time spent up to now is 123.2 secs Computing kpt #: 135 total cpu time spent up to now is 124.1 secs Computing kpt #: 136 total cpu time spent up to now is 125.0 secs Computing kpt #: 137 total cpu time spent up to now is 126.0 secs Computing kpt #: 138 total cpu time spent up to now is 126.9 secs Computing kpt #: 139 total cpu time spent up to now is 127.8 secs Computing kpt #: 140 total cpu time spent up to now is 128.8 secs Computing kpt #: 141 total cpu time spent up to now is 129.6 secs Computing kpt #: 142 total cpu time spent up to now is 130.5 secs Computing kpt #: 143 total cpu time spent up to now is 131.3 secs Computing kpt #: 144 total cpu time spent up to now is 132.2 secs Computing kpt #: 145 total cpu time spent up to now is 133.0 secs Computing kpt #: 146 total cpu time spent up to now is 133.9 secs Computing kpt #: 147 total cpu time spent up to now is 134.8 secs Computing kpt #: 148 total cpu time spent up to now is 135.7 secs Computing kpt #: 149 total cpu time spent up to now is 136.6 secs Computing kpt #: 150 total cpu time spent up to now is 137.4 secs Computing kpt #: 151 total cpu time spent up to now is 138.3 secs Computing kpt #: 152 total cpu time spent up to now is 139.2 secs Computing kpt #: 153 total cpu time spent up to now is 140.0 secs Computing kpt #: 154 total cpu time spent up to now is 140.8 secs Computing kpt #: 155 total cpu time spent up to now is 141.7 secs Computing kpt #: 156 total cpu time spent up to now is 142.6 secs Computing kpt #: 157 total cpu time spent up to now is 143.7 secs Computing kpt #: 158 total cpu time spent up to now is 144.9 secs Computing kpt #: 159 total cpu time spent up to now is 146.0 secs Computing kpt #: 160 total cpu time spent up to now is 147.1 secs Computing kpt #: 161 total cpu time spent up to now is 148.3 secs Computing kpt #: 162 total cpu time spent up to now is 149.5 secs Computing kpt #: 163 total cpu time spent up to now is 150.6 secs Computing kpt #: 164 total cpu time spent up to now is 151.7 secs Computing kpt #: 165 total cpu time spent up to now is 152.8 secs Computing kpt #: 166 total cpu time spent up to now is 153.9 secs Computing kpt #: 167 total cpu time spent up to now is 155.0 secs Computing kpt #: 168 total cpu time spent up to now is 156.2 secs Computing kpt #: 169 total cpu time spent up to now is 157.4 secs Computing kpt #: 170 total cpu time spent up to now is 158.5 secs Computing kpt #: 171 total cpu time spent up to now is 159.6 secs Computing kpt #: 172 total cpu time spent up to now is 160.7 secs Computing kpt #: 173 total cpu time spent up to now is 161.8 secs Computing kpt #: 174 total cpu time spent up to now is 163.5 secs Computing kpt #: 175 total cpu time spent up to now is 164.6 secs Computing kpt #: 176 total cpu time spent up to now is 165.6 secs Computing kpt #: 177 total cpu time spent up to now is 166.6 secs Computing kpt #: 178 total cpu time spent up to now is 167.5 secs Computing kpt #: 179 total cpu time spent up to now is 168.5 secs Computing kpt #: 180 total cpu time spent up to now is 169.4 secs Computing kpt #: 181 total cpu time spent up to now is 170.2 secs Computing kpt #: 182 total cpu time spent up to now is 171.1 secs Computing kpt #: 183 total cpu time spent up to now is 171.9 secs Computing kpt #: 184 total cpu time spent up to now is 172.7 secs Computing kpt #: 185 total cpu time spent up to now is 173.4 secs Computing kpt #: 186 total cpu time spent up to now is 174.1 secs Computing kpt #: 187 total cpu time spent up to now is 174.9 secs Computing kpt #: 188 total cpu time spent up to now is 175.6 secs Computing kpt #: 189 total cpu time spent up to now is 176.3 secs Computing kpt #: 190 total cpu time spent up to now is 177.1 secs Computing kpt #: 191 total cpu time spent up to now is 177.9 secs Computing kpt #: 192 total cpu time spent up to now is 178.7 secs Computing kpt #: 193 total cpu time spent up to now is 179.5 secs Computing kpt #: 194 total cpu time spent up to now is 180.3 secs Computing kpt #: 195 total cpu time spent up to now is 181.1 secs Computing kpt #: 196 total cpu time spent up to now is 182.0 secs Computing kpt #: 197 total cpu time spent up to now is 182.9 secs Computing kpt #: 198 total cpu time spent up to now is 183.9 secs Computing kpt #: 199 total cpu time spent up to now is 184.9 secs Computing kpt #: 200 total cpu time spent up to now is 186.0 secs Computing kpt #: 201 total cpu time spent up to now is 187.0 secs Computing kpt #: 202 total cpu time spent up to now is 188.0 secs Computing kpt #: 203 total cpu time spent up to now is 188.9 secs Computing kpt #: 204 total cpu time spent up to now is 189.8 secs Computing kpt #: 205 total cpu time spent up to now is 190.7 secs Computing kpt #: 206 total cpu time spent up to now is 191.6 secs Computing kpt #: 207 total cpu time spent up to now is 192.5 secs Computing kpt #: 208 total cpu time spent up to now is 193.3 secs Computing kpt #: 209 total cpu time spent up to now is 194.2 secs Computing kpt #: 210 total cpu time spent up to now is 195.1 secs Computing kpt #: 211 total cpu time spent up to now is 195.9 secs Computing kpt #: 212 total cpu time spent up to now is 196.8 secs Computing kpt #: 213 total cpu time spent up to now is 197.6 secs Computing kpt #: 214 total cpu time spent up to now is 198.5 secs Computing kpt #: 215 total cpu time spent up to now is 199.4 secs Computing kpt #: 216 total cpu time spent up to now is 200.4 secs Computing kpt #: 217 total cpu time spent up to now is 201.5 secs Computing kpt #: 218 total cpu time spent up to now is 202.5 secs Computing kpt #: 219 total cpu time spent up to now is 203.5 secs Computing kpt #: 220 total cpu time spent up to now is 204.4 secs Computing kpt #: 221 total cpu time spent up to now is 205.4 secs Computing kpt #: 222 total cpu time spent up to now is 206.4 secs Computing kpt #: 223 total cpu time spent up to now is 207.3 secs Computing kpt #: 224 total cpu time spent up to now is 208.3 secs Computing kpt #: 225 total cpu time spent up to now is 209.3 secs Computing kpt #: 226 total cpu time spent up to now is 210.2 secs Computing kpt #: 227 total cpu time spent up to now is 211.2 secs Computing kpt #: 228 total cpu time spent up to now is 212.2 secs Computing kpt #: 229 total cpu time spent up to now is 213.1 secs Computing kpt #: 230 total cpu time spent up to now is 214.0 secs Computing kpt #: 231 total cpu time spent up to now is 215.0 secs Computing kpt #: 232 total cpu time spent up to now is 216.0 secs Computing kpt #: 233 total cpu time spent up to now is 216.9 secs Computing kpt #: 234 total cpu time spent up to now is 217.9 secs Computing kpt #: 235 total cpu time spent up to now is 218.9 secs Computing kpt #: 236 total cpu time spent up to now is 219.9 secs Computing kpt #: 237 total cpu time spent up to now is 220.8 secs Computing kpt #: 238 total cpu time spent up to now is 221.8 secs Computing kpt #: 239 total cpu time spent up to now is 222.8 secs Computing kpt #: 240 total cpu time spent up to now is 223.9 secs Computing kpt #: 241 total cpu time spent up to now is 225.0 secs Computing kpt #: 242 total cpu time spent up to now is 226.1 secs Computing kpt #: 243 total cpu time spent up to now is 227.2 secs Computing kpt #: 244 total cpu time spent up to now is 228.1 secs Computing kpt #: 245 total cpu time spent up to now is 229.0 secs Computing kpt #: 246 total cpu time spent up to now is 229.9 secs Computing kpt #: 247 total cpu time spent up to now is 230.9 secs Computing kpt #: 248 total cpu time spent up to now is 231.8 secs Computing kpt #: 249 total cpu time spent up to now is 232.8 secs Computing kpt #: 250 total cpu time spent up to now is 233.7 secs Computing kpt #: 251 total cpu time spent up to now is 234.6 secs Computing kpt #: 252 total cpu time spent up to now is 235.5 secs Computing kpt #: 253 total cpu time spent up to now is 236.4 secs Computing kpt #: 254 total cpu time spent up to now is 237.3 secs Computing kpt #: 255 total cpu time spent up to now is 238.2 secs Computing kpt #: 256 total cpu time spent up to now is 239.2 secs Computing kpt #: 257 total cpu time spent up to now is 240.1 secs Computing kpt #: 258 total cpu time spent up to now is 241.0 secs Computing kpt #: 259 total cpu time spent up to now is 241.9 secs Computing kpt #: 260 total cpu time spent up to now is 242.9 secs Computing kpt #: 261 total cpu time spent up to now is 244.0 secs Computing kpt #: 262 total cpu time spent up to now is 244.9 secs Computing kpt #: 263 total cpu time spent up to now is 245.8 secs Computing kpt #: 264 total cpu time spent up to now is 246.7 secs Computing kpt #: 265 total cpu time spent up to now is 247.6 secs Computing kpt #: 266 total cpu time spent up to now is 248.4 secs Computing kpt #: 267 total cpu time spent up to now is 249.2 secs Computing kpt #: 268 total cpu time spent up to now is 250.0 secs Computing kpt #: 269 total cpu time spent up to now is 250.7 secs Computing kpt #: 270 total cpu time spent up to now is 251.5 secs Computing kpt #: 271 total cpu time spent up to now is 252.3 secs Computing kpt #: 272 total cpu time spent up to now is 253.1 secs Computing kpt #: 273 total cpu time spent up to now is 253.9 secs Computing kpt #: 274 total cpu time spent up to now is 254.7 secs Computing kpt #: 275 total cpu time spent up to now is 255.4 secs Computing kpt #: 276 total cpu time spent up to now is 256.2 secs Computing kpt #: 277 total cpu time spent up to now is 257.0 secs Computing kpt #: 278 total cpu time spent up to now is 257.7 secs Computing kpt #: 279 total cpu time spent up to now is 258.5 secs Computing kpt #: 280 total cpu time spent up to now is 259.2 secs Computing kpt #: 281 total cpu time spent up to now is 260.0 secs Computing kpt #: 282 total cpu time spent up to now is 260.8 secs Computing kpt #: 283 total cpu time spent up to now is 261.5 secs Computing kpt #: 284 total cpu time spent up to now is 262.3 secs Computing kpt #: 285 total cpu time spent up to now is 263.1 secs Computing kpt #: 286 total cpu time spent up to now is 263.8 secs Computing kpt #: 287 total cpu time spent up to now is 264.6 secs Computing kpt #: 288 total cpu time spent up to now is 265.3 secs Computing kpt #: 289 total cpu time spent up to now is 266.0 secs Computing kpt #: 290 total cpu time spent up to now is 266.8 secs Computing kpt #: 291 total cpu time spent up to now is 267.5 secs Computing kpt #: 292 total cpu time spent up to now is 268.2 secs Computing kpt #: 293 total cpu time spent up to now is 269.0 secs Computing kpt #: 294 total cpu time spent up to now is 269.8 secs Computing kpt #: 295 total cpu time spent up to now is 270.6 secs Computing kpt #: 296 total cpu time spent up to now is 271.4 secs Computing kpt #: 297 total cpu time spent up to now is 272.3 secs Computing kpt #: 298 total cpu time spent up to now is 273.1 secs Computing kpt #: 299 total cpu time spent up to now is 274.1 secs Computing kpt #: 300 total cpu time spent up to now is 275.0 secs Computing kpt #: 301 total cpu time spent up to now is 275.9 secs Computing kpt #: 302 total cpu time spent up to now is 276.9 secs Computing kpt #: 303 total cpu time spent up to now is 277.9 secs Computing kpt #: 304 total cpu time spent up to now is 278.9 secs Computing kpt #: 305 total cpu time spent up to now is 280.0 secs Computing kpt #: 306 total cpu time spent up to now is 281.1 secs Computing kpt #: 307 total cpu time spent up to now is 282.2 secs Computing kpt #: 308 total cpu time spent up to now is 283.2 secs Computing kpt #: 309 total cpu time spent up to now is 284.3 secs Computing kpt #: 310 total cpu time spent up to now is 285.4 secs Computing kpt #: 311 total cpu time spent up to now is 286.8 secs Computing kpt #: 312 total cpu time spent up to now is 287.6 secs Computing kpt #: 313 total cpu time spent up to now is 288.5 secs Computing kpt #: 314 total cpu time spent up to now is 289.5 secs Computing kpt #: 315 total cpu time spent up to now is 290.5 secs Computing kpt #: 316 total cpu time spent up to now is 291.4 secs Computing kpt #: 317 total cpu time spent up to now is 292.2 secs Computing kpt #: 318 total cpu time spent up to now is 293.1 secs Computing kpt #: 319 total cpu time spent up to now is 294.0 secs Computing kpt #: 320 total cpu time spent up to now is 294.8 secs Computing kpt #: 321 total cpu time spent up to now is 295.7 secs Computing kpt #: 322 total cpu time spent up to now is 296.5 secs Computing kpt #: 323 total cpu time spent up to now is 297.3 secs Computing kpt #: 324 total cpu time spent up to now is 298.1 secs Computing kpt #: 325 total cpu time spent up to now is 298.9 secs Computing kpt #: 326 total cpu time spent up to now is 299.7 secs Computing kpt #: 327 total cpu time spent up to now is 300.6 secs Computing kpt #: 328 total cpu time spent up to now is 301.4 secs Computing kpt #: 329 total cpu time spent up to now is 302.2 secs Computing kpt #: 330 total cpu time spent up to now is 303.0 secs Computing kpt #: 331 total cpu time spent up to now is 303.9 secs Computing kpt #: 332 total cpu time spent up to now is 304.7 secs Computing kpt #: 333 total cpu time spent up to now is 305.6 secs Computing kpt #: 334 total cpu time spent up to now is 306.5 secs Computing kpt #: 335 total cpu time spent up to now is 307.3 secs Computing kpt #: 336 total cpu time spent up to now is 308.2 secs Computing kpt #: 337 total cpu time spent up to now is 309.1 secs Computing kpt #: 338 total cpu time spent up to now is 310.0 secs Computing kpt #: 339 total cpu time spent up to now is 310.9 secs Computing kpt #: 340 total cpu time spent up to now is 311.8 secs Computing kpt #: 341 total cpu time spent up to now is 312.7 secs Computing kpt #: 342 total cpu time spent up to now is 313.6 secs Computing kpt #: 343 total cpu time spent up to now is 314.5 secs Computing kpt #: 344 total cpu time spent up to now is 315.3 secs Computing kpt #: 345 total cpu time spent up to now is 316.3 secs Computing kpt #: 346 total cpu time spent up to now is 317.2 secs Computing kpt #: 347 total cpu time spent up to now is 318.1 secs Computing kpt #: 348 total cpu time spent up to now is 319.1 secs Computing kpt #: 349 total cpu time spent up to now is 320.1 secs Computing kpt #: 350 total cpu time spent up to now is 321.0 secs Computing kpt #: 351 total cpu time spent up to now is 322.0 secs Computing kpt #: 352 total cpu time spent up to now is 323.0 secs Computing kpt #: 353 total cpu time spent up to now is 324.0 secs Computing kpt #: 354 total cpu time spent up to now is 325.0 secs Computing kpt #: 355 total cpu time spent up to now is 326.5 secs Computing kpt #: 356 total cpu time spent up to now is 327.4 secs Computing kpt #: 357 total cpu time spent up to now is 328.4 secs Computing kpt #: 358 total cpu time spent up to now is 329.3 secs Computing kpt #: 359 total cpu time spent up to now is 330.2 secs Computing kpt #: 360 total cpu time spent up to now is 331.1 secs Computing kpt #: 361 total cpu time spent up to now is 332.0 secs ethr = 1.72E-08, avg # of iterations = 28.1 total cpu time spent up to now is 332.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3099 PWs) bands (ev): 1.7582 1.7582 6.4832 6.4832 6.9536 6.9536 8.4238 8.4238 8.6728 8.6728 9.5801 9.5801 9.5882 9.5882 9.7092 9.7092 9.9030 9.9030 10.0480 10.0480 10.1324 10.1324 10.6822 10.6822 10.7339 10.7339 12.3389 12.3389 12.7467 12.7467 12.8482 12.8482 13.0705 13.0705 13.4692 13.4692 13.5207 13.5207 13.9663 13.9663 14.0847 14.0847 14.5169 14.5169 14.5533 14.5533 14.6207 14.6207 15.0750 15.0750 15.0825 15.0825 15.3092 15.3092 15.3711 15.3711 16.2738 16.2738 16.2940 16.2940 18.6065 18.6065 18.7280 18.7280 20.1304 20.1304 20.5822 20.5822 20.6384 20.6384 k = 0.0000 0.0122-0.0000 ( 3099 PWs) bands (ev): 1.7592 1.7592 6.4850 6.4850 6.9542 6.9542 8.4236 8.4236 8.6724 8.6724 9.5811 9.5811 9.5896 9.5896 9.7106 9.7106 9.9042 9.9042 10.0481 10.0481 10.1334 10.1334 10.6826 10.6826 10.7344 10.7344 12.3370 12.3370 12.7383 12.7383 12.8552 12.8552 13.0716 13.0716 13.4658 13.4658 13.5220 13.5220 13.9663 13.9663 14.0845 14.0845 14.5113 14.5113 14.5537 14.5537 14.6181 14.6181 15.0659 15.0659 15.0885 15.0885 15.3048 15.3048 15.3683 15.3683 16.2784 16.2784 16.2921 16.2921 18.6101 18.6101 18.7257 18.7257 20.1251 20.1251 20.5823 20.5823 20.6381 20.6381 k = 0.0000 0.0244-0.0000 ( 3099 PWs) bands (ev): 1.7622 1.7622 6.4903 6.4903 6.9559 6.9559 8.4230 8.4230 8.6713 8.6713 9.5839 9.5839 9.5937 9.5937 9.7145 9.7145 9.9076 9.9076 10.0486 10.0486 10.1363 10.1363 10.6839 10.6839 10.7358 10.7358 12.3313 12.3313 12.7180 12.7180 12.8711 12.8711 13.0750 13.0750 13.4562 13.4562 13.5250 13.5250 13.9661 13.9661 14.0839 14.0839 14.4963 14.4963 14.5531 14.5531 14.6105 14.6105 15.0492 15.0492 15.0957 15.0957 15.2920 15.2920 15.3602 15.3602 16.2760 16.2760 16.3025 16.3025 18.6209 18.6209 18.7188 18.7188 20.1092 20.1092 20.5825 20.5825 20.6373 20.6373 k = 0.0000 0.0366-0.0000 ( 3095 PWs) bands (ev): 1.7672 1.7672 6.4991 6.4991 6.9589 6.9589 8.4220 8.4220 8.6695 8.6695 9.5885 9.5885 9.6005 9.6005 9.7211 9.7211 9.9132 9.9132 10.0496 10.0496 10.1412 10.1412 10.6862 10.6862 10.7380 10.7380 12.3215 12.3215 12.6929 12.6929 12.8892 12.8892 13.0806 13.0806 13.4419 13.4419 13.5285 13.5285 13.9655 13.9655 14.0831 14.0831 14.4744 14.4744 14.5487 14.5487 14.5986 14.5986 15.0264 15.0264 15.1027 15.1027 15.2715 15.2715 15.3473 15.3473 16.2595 16.2595 16.3314 16.3314 18.6388 18.6388 18.7071 18.7071 20.0821 20.0821 20.5811 20.5811 20.6367 20.6367 k = 0.0000 0.0488-0.0000 ( 3097 PWs) bands (ev): 1.7741 1.7741 6.5114 6.5114 6.9629 6.9629 8.4207 8.4207 8.6673 8.6673 9.5948 9.5948 9.6101 9.6101 9.7301 9.7301 9.9207 9.9207 10.0512 10.0512 10.1481 10.1481 10.6892 10.6892 10.7412 10.7412 12.3072 12.3072 12.6668 12.6668 12.9061 12.9061 13.0882 13.0882 13.4236 13.4236 13.5317 13.5317 13.9640 13.9640 14.0821 14.0821 14.4472 14.4472 14.5386 14.5386 14.5838 14.5838 14.9973 14.9973 15.1092 15.1092 15.2449 15.2449 15.3300 15.3300 16.2358 16.2358 16.3706 16.3706 18.6636 18.6636 18.6906 18.6906 20.0440 20.0440 20.5738 20.5738 20.6374 20.6374 k = 0.0000 0.0610-0.0000 ( 3097 PWs) bands (ev): 1.7830 1.7830 6.5272 6.5272 6.9681 6.9681 8.4192 8.4192 8.6648 8.6648 9.6026 9.6026 9.6223 9.6223 9.7415 9.7415 9.9298 9.9298 10.0537 10.0537 10.1569 10.1569 10.6932 10.6932 10.7454 10.7454 12.2881 12.2881 12.6417 12.6417 12.9204 12.9204 13.0974 13.0974 13.4017 13.4017 13.5343 13.5343 13.9612 13.9612 14.0808 14.0808 14.4159 14.4159 14.5210 14.5210 14.5680 14.5680 14.9624 14.9624 15.1145 15.1145 15.2146 15.2146 15.3086 15.3086 16.2061 16.2061 16.4179 16.4179 18.6692 18.6692 18.6952 18.6952 19.9952 19.9952 20.5525 20.5525 20.6415 20.6415 k = 0.0000 0.0732-0.0000 ( 3099 PWs) bands (ev): 1.7938 1.7938 6.5465 6.5465 6.9744 6.9744 8.4174 8.4174 8.6622 8.6622 9.6118 9.6118 9.6372 9.6372 9.7552 9.7552 9.9398 9.9398 10.0576 10.0576 10.1677 10.1677 10.6981 10.6981 10.7504 10.7504 12.2639 12.2639 12.6188 12.6188 12.9311 12.9311 13.1079 13.1079 13.3765 13.3765 13.5363 13.5363 13.9565 13.9565 14.0792 14.0792 14.3817 14.3817 14.4956 14.4956 14.5517 14.5517 14.9221 14.9221 15.1158 15.1158 15.1846 15.1846 15.2831 15.2831 16.1712 16.1712 16.4717 16.4717 18.6429 18.6429 18.7330 18.7330 19.9364 19.9364 20.5092 20.5092 20.6500 20.6500 k = 0.0000 0.0854-0.0000 ( 3099 PWs) bands (ev): 1.8064 1.8064 6.5691 6.5691 6.9816 6.9816 8.4157 8.4157 8.6596 8.6596 9.6221 9.6221 9.6546 9.6546 9.7708 9.7708 9.9500 9.9500 10.0637 10.0637 10.1804 10.1804 10.7038 10.7038 10.7564 10.7564 12.2346 12.2346 12.5988 12.5988 12.9379 12.9379 13.1191 13.1191 13.3482 13.3482 13.5376 13.5376 13.9491 13.9491 14.0768 14.0768 14.3462 14.3462 14.4638 14.4638 14.5342 14.5342 14.8774 14.8774 15.1057 15.1057 15.1630 15.1630 15.2539 15.2539 16.1318 16.1318 16.5307 16.5307 18.6114 18.6114 18.7768 18.7768 19.8681 19.8681 20.4413 20.4413 20.6623 20.6623 k = 0.0000 0.0976-0.0000 ( 3097 PWs) bands (ev): 1.8208 1.8208 6.5952 6.5952 6.9899 6.9899 8.4140 8.4140 8.6574 8.6574 9.6333 9.6333 9.6746 9.6746 9.7883 9.7883 9.9596 9.9596 10.0727 10.0727 10.1950 10.1950 10.7104 10.7104 10.7633 10.7633 12.2005 12.2005 12.5819 12.5819 12.9402 12.9402 13.1304 13.1304 13.3170 13.3170 13.5382 13.5382 13.9387 13.9387 14.0726 14.0726 14.3109 14.3109 14.4272 14.4272 14.5143 14.5143 14.8289 14.8289 15.0794 15.0794 15.1548 15.1548 15.2219 15.2219 16.0889 16.0889 16.5940 16.5940 18.5747 18.5747 18.8259 18.8259 19.7902 19.7902 20.3535 20.3535 20.6777 20.6777 k = 0.0000 0.1098-0.0000 ( 3093 PWs) bands (ev): 1.8370 1.8370 6.6247 6.6247 6.9990 6.9990 8.4125 8.4125 8.6557 8.6557 9.6450 9.6450 9.6970 9.6970 9.8072 9.8072 9.9679 9.9679 10.0854 10.0854 10.2115 10.2115 10.7180 10.7180 10.7712 10.7712 12.1621 12.1621 12.5681 12.5681 12.9374 12.9374 13.1413 13.1413 13.2833 13.2833 13.5383 13.5383 13.9248 13.9248 14.0654 14.0654 14.2773 14.2773 14.3882 14.3882 14.4913 14.4913 14.7777 14.7777 15.0449 15.0449 15.1490 15.1490 15.1907 15.1907 16.0434 16.0434 16.6607 16.6607 18.5327 18.5327 18.8795 18.8795 19.7024 19.7024 20.2545 20.2545 20.6956 20.6956 k = 0.0000 0.1220-0.0000 ( 3097 PWs) bands (ev): 1.8548 1.8548 6.6574 6.6574 7.0089 7.0089 8.4115 8.4115 8.6547 8.6547 9.6569 9.6569 9.7218 9.7218 9.8271 9.8271 9.9747 9.9747 10.1023 10.1023 10.2299 10.2299 10.7265 10.7265 10.7800 10.7800 12.1200 12.1200 12.5570 12.5570 12.9289 12.9289 13.1512 13.1512 13.2475 13.2475 13.5379 13.5379 13.9072 13.9072 14.0539 14.0539 14.2458 14.2458 14.3495 14.3495 14.4649 14.4649 14.7244 14.7244 15.0078 15.0078 15.1277 15.1277 15.1730 15.1730 15.9960 15.9960 16.7301 16.7301 18.4854 18.4854 18.9361 18.9361 19.6044 19.6044 20.1534 20.1534 20.7158 20.7158 k = 0.0000 0.1341-0.0000 ( 3103 PWs) bands (ev): 1.8743 1.8743 6.6933 6.6933 7.0197 7.0197 8.4112 8.4112 8.6544 8.6544 9.6685 9.6685 9.7489 9.7489 9.8472 9.8472 9.9806 9.9806 10.1231 10.1231 10.2501 10.2501 10.7359 10.7359 10.7898 10.7898 12.0751 12.0751 12.5482 12.5482 12.9139 12.9139 13.1591 13.1591 13.2107 13.2107 13.5369 13.5369 13.8858 13.8858 14.0373 14.0373 14.2134 14.2134 14.3163 14.3163 14.4348 14.4348 14.6699 14.6699 14.9697 14.9697 15.0901 15.0901 15.1686 15.1686 15.9477 15.9477 16.8017 16.8017 18.4327 18.4327 18.9928 18.9928 19.4982 19.4982 20.0572 20.0572 20.7380 20.7380 k = 0.0000 0.1463-0.0000 ( 3107 PWs) bands (ev): 1.8952 1.8952 6.7324 6.7324 7.0312 7.0312 8.4117 8.4117 8.6550 8.6550 9.6795 9.6795 9.7779 9.7779 9.8666 9.8666 9.9871 9.9871 10.1476 10.1476 10.2722 10.2722 10.7465 10.7465 10.8006 10.8006 12.0280 12.0280 12.5413 12.5413 12.8915 12.8915 13.1596 13.1596 13.1783 13.1783 13.5356 13.5356 13.8612 13.8612 14.0159 14.0159 14.1755 14.1755 14.2940 14.2940 14.4013 14.4013 14.6146 14.6146 14.9306 14.9306 15.0477 15.0477 15.1665 15.1665 15.8991 15.8991 16.8752 16.8752 18.3748 18.3748 19.0414 19.0414 19.3920 19.3920 19.9700 19.9700 20.7622 20.7622 k = 0.0000 0.1585-0.0000 ( 3111 PWs) bands (ev): 1.9176 1.9176 6.7745 6.7745 7.0433 7.0433 8.4132 8.4132 8.6566 8.6566 9.6892 9.6892 9.8084 9.8084 9.8840 9.8840 9.9959 9.9959 10.1752 10.1752 10.2961 10.2961 10.7581 10.7581 10.8123 10.8123 11.9793 11.9793 12.5360 12.5360 12.8612 12.8612 13.1293 13.1293 13.1737 13.1737 13.5341 13.5341 13.8344 13.8344 13.9906 13.9906 14.1302 14.1302 14.2832 14.2832 14.3650 14.3650 14.5590 14.5590 14.8900 14.8900 15.0043 15.0043 15.1636 15.1636 15.8509 15.8509 16.9500 16.9500 18.3117 18.3117 19.0539 19.0539 19.3157 19.3157 19.8932 19.8932 20.7883 20.7883 k = 0.0000 0.1707-0.0000 ( 3107 PWs) bands (ev): 1.9412 1.9412 6.8195 6.8195 7.0562 7.0562 8.4160 8.4160 8.6592 8.6592 9.6970 9.6970 9.8392 9.8392 9.8993 9.8993 10.0090 10.0090 10.2055 10.2055 10.3218 10.3218 10.7708 10.7708 10.8251 10.8251 11.9296 11.9296 12.5319 12.5319 12.8229 12.8229 13.0907 13.0907 13.1741 13.1741 13.5324 13.5324 13.8063 13.8063 13.9617 13.9617 14.0802 14.0802 14.2795 14.2795 14.3283 14.3283 14.5030 14.5030 14.8470 14.8470 14.9621 14.9621 15.1590 15.1590 15.8037 15.8037 17.0260 17.0260 18.2436 18.2436 18.9867 18.9867 19.3154 19.3154 19.8264 19.8264 20.8162 20.8162 k = 0.0000 0.1829-0.0000 ( 3111 PWs) bands (ev): 1.9661 1.9661 6.8673 6.8673 7.0698 7.0698 8.4202 8.4202 8.6628 8.6628 9.7019 9.7019 9.8667 9.8667 9.9155 9.9155 10.0271 10.0271 10.2380 10.2380 10.3493 10.3493 10.7848 10.7848 10.8388 10.8388 11.8792 11.8792 12.5288 12.5288 12.7771 12.7771 13.0507 13.0507 13.1720 13.1720 13.5306 13.5306 13.7780 13.7780 13.9289 13.9289 14.0280 14.0280 14.2702 14.2702 14.3015 14.3015 14.4467 14.4467 14.8011 14.8011 14.9224 14.9224 15.1526 15.1526 15.7580 15.7580 17.1028 17.1028 18.1707 18.1707 18.8659 18.8659 19.3674 19.3674 19.7686 19.7686 20.8458 20.8458 k = 0.0000 0.1951-0.0000 ( 3115 PWs) bands (ev): 1.9921 1.9921 6.9176 6.9176 7.0842 7.0842 8.4260 8.4260 8.6674 8.6674 9.7032 9.7032 9.8840 9.8840 9.9404 9.9404 10.0496 10.0496 10.2725 10.2725 10.3785 10.3785 10.8002 10.8002 10.8537 10.8537 11.8287 11.8287 12.5262 12.5262 12.7247 12.7247 13.0093 13.0093 13.1670 13.1670 13.5285 13.5285 13.7498 13.7498 13.8918 13.8918 13.9759 13.9759 14.2396 14.2396 14.2983 14.2983 14.3914 14.3914 14.7523 14.7523 14.8860 14.8860 15.1440 15.1440 15.7141 15.7141 17.1800 17.1800 18.0933 18.0933 18.7280 18.7280 19.4373 19.4373 19.7187 19.7187 20.8772 20.8772 k = 0.0000 0.2073-0.0000 ( 3111 PWs) bands (ev): 2.0190 2.0190 6.9699 6.9699 7.0998 7.0998 8.4334 8.4334 8.6731 8.6731 9.6998 9.6998 9.8917 9.8917 9.9752 9.9752 10.0753 10.0753 10.3086 10.3086 10.4093 10.4093 10.8169 10.8169 10.8698 10.8698 11.7784 11.7784 12.5237 12.5237 12.6673 12.6673 12.9662 12.9662 13.1593 13.1593 13.5257 13.5257 13.7210 13.7210 13.8510 13.8510 13.9248 13.9248 14.2046 14.2046 14.2918 14.2918 14.3468 14.3468 14.7017 14.7017 14.8527 14.8527 15.1330 15.1330 15.6722 15.6722 17.2573 17.2573 18.0118 18.0118 18.5858 18.5858 19.5141 19.5141 19.6762 19.6762 20.9104 20.9104 k = 0.0000 0.2195-0.0000 ( 3115 PWs) bands (ev): 2.0467 2.0467 7.0233 7.0233 7.1175 7.1175 8.4426 8.4426 8.6799 8.6799 9.6911 9.6911 9.8956 9.8956 10.0151 10.0151 10.1027 10.1027 10.3461 10.3461 10.4418 10.4418 10.8350 10.8350 10.8872 10.8872 11.7287 11.7287 12.5202 12.5202 12.6070 12.6070 12.9209 12.9209 13.1490 13.1490 13.5212 13.5212 13.6897 13.6897 13.8090 13.8090 13.8748 13.8748 14.1712 14.1712 14.2510 14.2510 14.3379 14.3379 14.6505 14.6505 14.8220 14.8220 15.1196 15.1196 15.6327 15.6327 17.3342 17.3342 17.9266 17.9266 18.4442 18.4442 19.5912 19.5912 19.6429 19.6429 20.9452 20.9452 k = 0.0000 0.2317-0.0000 ( 3109 PWs) bands (ev): 2.0751 2.0751 7.0744 7.0744 7.1404 7.1404 8.4534 8.4534 8.6877 8.6877 9.6767 9.6767 9.8987 9.8987 10.0581 10.0581 10.1310 10.1310 10.3845 10.3845 10.4758 10.4758 10.8545 10.8545 10.9060 10.9060 11.6798 11.6798 12.5097 12.5097 12.5509 12.5509 12.8736 12.8736 13.1368 13.1368 13.5134 13.5134 13.6535 13.6535 13.7697 13.7697 13.8258 13.8258 14.1377 14.1377 14.1964 14.1964 14.3455 14.3455 14.6002 14.6002 14.7934 14.7934 15.1037 15.1037 15.5957 15.5957 17.4100 17.4100 17.8386 17.8386 18.3060 18.3060 19.6026 19.6026 19.6827 19.6827 20.9818 20.9818 k = 0.0000 0.2439-0.0000 ( 3113 PWs) bands (ev): 2.1040 2.1040 7.1149 7.1149 7.1767 7.1767 8.4659 8.4659 8.6965 8.6965 9.6566 9.6566 9.9019 9.9019 10.1029 10.1029 10.1597 10.1597 10.4235 10.4235 10.5114 10.5114 10.8753 10.8753 10.9266 10.9266 11.6322 11.6322 12.4646 12.4646 12.5272 12.5272 12.8247 12.8247 13.1230 13.1230 13.4989 13.4989 13.6130 13.6130 13.7334 13.7334 13.7800 13.7800 14.0946 14.0946 14.1515 14.1515 14.3542 14.3542 14.5531 14.5531 14.7666 14.7666 15.0851 15.0851 15.5612 15.5612 17.4823 17.4823 17.7499 17.7499 18.1731 18.1731 19.5780 19.5780 19.7645 19.7645 21.0201 21.0201 k = 0.0000 0.2561-0.0000 ( 3105 PWs) bands (ev): 2.1333 2.1333 7.1416 7.1416 7.2295 7.2295 8.4799 8.4799 8.7064 8.7064 9.6312 9.6312 9.9054 9.9054 10.1483 10.1483 10.1890 10.1890 10.4627 10.4627 10.5485 10.5485 10.8972 10.8972 10.9493 10.9493 11.5863 11.5863 12.4012 12.4012 12.5203 12.5203 12.7750 12.7750 13.1078 13.1078 13.4717 13.4717 13.5748 13.5748 13.6940 13.6940 13.7425 13.7425 14.0366 14.0366 14.1241 14.1241 14.3584 14.3584 14.5126 14.5126 14.7416 14.7416 15.0640 15.0640 15.5294 15.5294 17.5395 17.5395 17.6722 17.6722 18.0470 18.0470 19.5566 19.5566 19.8479 19.8479 21.0602 21.0602 k = 0.0000 0.2683-0.0000 ( 3105 PWs) bands (ev): 2.1627 2.1627 7.1623 7.1623 7.2907 7.2907 8.4952 8.4952 8.7172 8.7172 9.6010 9.6010 9.9091 9.9091 10.1905 10.1905 10.2217 10.2217 10.5016 10.5016 10.5871 10.5871 10.9199 10.9199 10.9745 10.9745 11.5425 11.5425 12.3360 12.3360 12.5137 12.5137 12.7253 12.7253 13.0916 13.0916 13.4274 13.4274 13.5445 13.5445 13.6491 13.6491 13.7139 13.7139 13.9740 13.9740 14.1060 14.1060 14.3511 14.3511 14.4845 14.4845 14.7186 14.7186 15.0404 15.0404 15.5004 15.5004 17.5168 17.5168 17.6694 17.6694 17.9294 17.9294 19.5392 19.5392 19.9312 19.9312 21.1022 21.1022 k = 0.0000 0.2805-0.0000 ( 3105 PWs) bands (ev): 2.1922 2.1922 7.1816 7.1816 7.3559 7.3559 8.5116 8.5116 8.7290 8.7290 9.5665 9.5665 9.9125 9.9125 10.2227 10.2227 10.2639 10.2639 10.5396 10.5396 10.6272 10.6272 10.9428 10.9428 11.0024 11.0024 11.5013 11.5013 12.2715 12.2715 12.5047 12.5047 12.6771 12.6771 13.0743 13.0743 13.3703 13.3703 13.5168 13.5168 13.6054 13.6054 13.6859 13.6859 13.9148 13.9148 14.0923 14.0923 14.3282 14.3282 14.4717 14.4717 14.6986 14.6986 15.0147 15.0147 15.4741 15.4741 17.4291 17.4291 17.7205 17.7205 17.8274 17.8274 19.5258 19.5258 20.0137 20.0137 21.1459 21.1459 k = 0.0000 0.2927-0.0000 ( 3105 PWs) bands (ev): 2.2215 2.2215 7.2006 7.2006 7.4234 7.4234 8.5288 8.5288 8.7417 8.7417 9.5285 9.5285 9.9155 9.9155 10.2465 10.2465 10.3135 10.3135 10.5763 10.5763 10.6685 10.6685 10.9654 10.9654 11.0333 11.0334 11.4635 11.4635 12.2088 12.2088 12.4913 12.4913 12.6320 12.6320 13.0561 13.0561 13.3068 13.3068 13.4823 13.4823 13.5707 13.5707 13.6509 13.6509 13.8651 13.8651 14.0807 14.0807 14.2945 14.2945 14.4673 14.4673 14.6835 14.6835 14.9872 14.9872 15.4506 15.4506 17.3305 17.3305 17.6952 17.6952 17.8178 17.8178 19.5161 19.5161 20.0948 20.0948 21.1915 21.1915 k = 0.0000 0.3049-0.0000 ( 3101 PWs) bands (ev): 2.2505 2.2505 7.2201 7.2201 7.4925 7.4925 8.5464 8.5464 8.7551 8.7551 9.4876 9.4876 9.9178 9.9178 10.2654 10.2654 10.3663 10.3663 10.6113 10.6113 10.7109 10.7109 10.9871 10.9871 11.0673 11.0673 11.4299 11.4299 12.1486 12.1486 12.4715 12.4715 12.5921 12.5921 13.0368 13.0368 13.2410 13.2410 13.4377 13.4377 13.5460 13.5460 13.6049 13.6049 13.8295 13.8295 14.0698 14.0698 14.2573 14.2573 14.4613 14.4613 14.6758 14.6758 14.9587 14.9587 15.4296 15.4296 17.2291 17.2291 17.6070 17.6070 17.8796 17.8796 19.5098 19.5098 20.1741 20.1741 21.2389 21.2389 k = 0.0000 0.3171-0.0000 ( 3101 PWs) bands (ev): 2.2789 2.2789 7.2401 7.2401 7.5626 7.5626 8.5642 8.5642 8.7690 8.7690 9.4448 9.4448 9.9192 9.9192 10.2802 10.2802 10.4207 10.4207 10.6443 10.6443 10.7541 10.7541 11.0069 11.0069 11.1041 11.1041 11.4018 11.4018 12.0917 12.0917 12.4442 12.4442 12.5585 12.5585 13.0159 13.0159 13.1751 13.1751 13.3873 13.3873 13.5182 13.5182 13.5575 13.5575 13.8073 13.8073 14.0581 14.0581 14.2210 14.2210 14.4474 14.4474 14.6776 14.6776 14.9300 14.9300 15.4111 15.4111 17.1272 17.1272 17.5212 17.5212 17.9456 17.9456 19.5067 19.5067 20.2512 20.2512 21.2880 21.2880 k = 0.0000 0.3293-0.0000 ( 3095 PWs) bands (ev): 2.3067 2.3067 7.2608 7.2608 7.6334 7.6334 8.5817 8.5817 8.7830 8.7830 9.4010 9.4010 9.9196 9.9196 10.2910 10.2910 10.4762 10.4762 10.6751 10.6751 10.7975 10.7975 11.0233 11.0233 11.1435 11.1435 11.3807 11.3807 12.0386 12.0386 12.4109 12.4109 12.5298 12.5298 12.9926 12.9926 13.1115 13.1115 13.3352 13.3352 13.4620 13.4620 13.5348 13.5348 13.7946 13.7946 14.0438 14.0438 14.1888 14.1888 14.4236 14.4236 14.6887 14.6887 14.9020 14.9020 15.3949 15.3949 17.0259 17.0259 17.4422 17.4422 18.0105 18.0105 19.5066 19.5066 20.3257 20.3257 21.3386 21.3386 k = 0.0000 0.3415-0.0000 ( 3099 PWs) bands (ev): 2.3335 2.3335 7.2823 7.2823 7.7043 7.7043 8.5985 8.5985 8.7964 8.7964 9.3574 9.3574 9.9190 9.9190 10.2978 10.2978 10.5323 10.5323 10.7038 10.7038 10.8408 10.8408 11.0351 11.0351 11.1850 11.1850 11.3680 11.3680 11.9897 11.9897 12.3748 12.3748 12.5028 12.5028 12.9648 12.9648 13.0529 13.0529 13.2835 13.2835 13.3916 13.3916 13.5249 13.5249 13.7878 13.7878 14.0251 14.0251 14.1626 14.1626 14.3908 14.3908 14.7068 14.7068 14.8759 14.8759 15.3806 15.3806 16.9261 16.9261 17.3703 17.3703 18.0731 18.0731 19.5092 19.5092 20.3971 20.3971 21.3898 21.3898 k = 0.0000 0.3537-0.0000 ( 3087 PWs) bands (ev): 2.3593 2.3593 7.3045 7.3045 7.7748 7.7748 8.6144 8.6144 8.8085 8.8085 9.3154 9.3154 9.9174 9.9174 10.3005 10.3005 10.5882 10.5882 10.7305 10.7305 10.8835 10.8835 11.0410 11.0410 11.2283 11.2283 11.3647 11.3647 11.9458 11.9458 12.3388 12.3388 12.4746 12.4746 12.9289 12.9289 13.0037 13.0037 13.2335 13.2335 13.3181 13.3181 13.5192 13.5192 13.7847 13.7847 14.0016 14.0016 14.1435 14.1435 14.3511 14.3511 14.7284 14.7284 14.8533 14.8533 15.3680 15.3680 16.8285 16.8285 17.3056 17.3056 18.1328 18.1328 19.5141 19.5141 20.4651 20.4651 21.4365 21.4365 k = 0.0000 0.3659-0.0000 ( 3091 PWs) bands (ev): 2.3838 2.3838 7.3273 7.3273 7.8443 7.8443 8.6289 8.6289 8.8182 8.8182 9.2769 9.2769 9.9146 9.9146 10.2991 10.2991 10.6431 10.6431 10.7555 10.7555 10.9251 10.9251 11.0413 11.0413 11.2728 11.2728 11.3704 11.3704 11.9075 11.9075 12.3049 12.3049 12.4433 12.4433 12.8837 12.8837 12.9654 12.9654 13.1859 13.1859 13.2451 13.2451 13.5160 13.5160 13.7838 13.7838 13.9739 13.9739 14.1306 14.1306 14.3067 14.3067 14.7485 14.7485 14.8376 14.8376 15.3567 15.3567 16.7338 16.7338 17.2478 17.2478 18.1892 18.1892 19.5211 19.5211 20.5293 20.5293 21.4342 21.4342 k = 0.0000 0.3780-0.0000 ( 3083 PWs) bands (ev): 2.4068 2.4068 7.3507 7.3507 7.9122 7.9122 8.6416 8.6416 8.8241 8.8241 9.2437 9.2437 9.9109 9.9109 10.2937 10.2937 10.6952 10.6952 10.7798 10.7798 10.9649 10.9649 11.0378 11.0378 11.3178 11.3178 11.3830 11.3830 11.8754 11.8754 12.2743 12.2743 12.4082 12.4082 12.8337 12.8337 12.9337 12.9337 13.1393 13.1393 13.1768 13.1768 13.5149 13.5149 13.7841 13.7841 13.9440 13.9440 14.1220 14.1220 14.2596 14.2596 14.7580 14.7580 14.8370 14.8370 15.3464 15.3464 16.6427 16.6427 17.1966 17.1966 18.2419 18.2419 19.5299 19.5299 20.5893 20.5893 21.3906 21.3906 k = 0.0000 0.3902-0.0000 ( 3083 PWs) bands (ev): 2.4283 2.4283 7.3743 7.3743 7.9778 7.9778 8.6520 8.6520 8.8253 8.8253 9.2176 9.2176 9.9062 9.9062 10.2848 10.2848 10.7409 10.7409 10.8054 10.8054 11.0019 11.0019 11.0341 11.0341 11.3618 11.3618 11.4005 11.4005 11.8502 11.8502 12.2480 12.2480 12.3690 12.3690 12.7833 12.7833 12.9042 12.9042 13.0853 13.0853 13.1236 13.1236 13.5155 13.5155 13.7849 13.7849 13.9135 13.9135 14.1159 14.1159 14.2123 14.2123 14.7525 14.7525 14.8549 14.8549 15.3368 15.3368 16.5559 16.5559 17.1517 17.1517 18.2905 18.2905 19.5400 19.5400 20.6446 20.6446 21.3439 21.3439 k = 0.0000 0.4024-0.0000 ( 3091 PWs) bands (ev): 2.4479 2.4479 7.3979 7.3979 8.0403 8.0403 8.6594 8.6594 8.8216 8.8216 9.1999 9.1999 9.9008 9.9008 10.2728 10.2728 10.7758 10.7758 10.8342 10.8342 11.0271 11.0271 11.0431 11.0431 11.3986 11.3986 11.4252 11.4252 11.8327 11.8327 12.2263 12.2263 12.3265 12.3265 12.7342 12.7342 12.8752 12.8752 13.0230 13.0230 13.0881 13.0881 13.5175 13.5175 13.7848 13.7848 13.8842 13.8842 14.1094 14.1094 14.1683 14.1683 14.7399 14.7399 14.8826 14.8826 15.3276 15.3276 16.4743 16.4743 17.1127 17.1127 18.3348 18.3348 19.5510 19.5510 20.6948 20.6948 21.2986 21.2986 k = 0.0000 0.4146-0.0000 ( 3089 PWs) bands (ev): 2.4657 2.4657 7.4211 7.4211 8.0988 8.0988 8.6629 8.6629 8.8142 8.8142 9.1904 9.1904 9.8949 9.8949 10.2584 10.2584 10.7994 10.7994 10.8620 10.8620 11.0379 11.0379 11.0727 11.0727 11.4184 11.4184 11.4628 11.4628 11.8235 11.8235 12.2094 12.2094 12.2818 12.2818 12.6868 12.6868 12.8467 12.8467 12.9617 12.9617 13.0622 13.0622 13.5206 13.5206 13.7818 13.7818 13.8581 13.8581 14.0948 14.0948 14.1368 14.1368 14.7260 14.7260 14.9139 14.9139 15.3184 15.3184 16.3986 16.3986 17.0793 17.0793 18.3746 18.3746 19.5626 19.5626 20.7395 20.7395 21.2563 21.2563 k = 0.0000 0.4268-0.0000 ( 3087 PWs) bands (ev): 2.4814 2.4814 7.4432 7.4432 8.1523 8.1523 8.6614 8.6614 8.8058 8.8058 9.1880 9.1880 9.8888 9.8888 10.2424 10.2424 10.8159 10.8159 10.8805 10.8805 11.0601 11.0601 11.1011 11.1011 11.4276 11.4276 11.5038 11.5038 11.8227 11.8227 12.1968 12.1968 12.2367 12.2367 12.6414 12.6414 12.8196 12.8196 12.9049 12.9049 13.0429 13.0429 13.5242 13.5242 13.7725 13.7725 13.8387 13.8387 14.0654 14.0654 14.1258 14.1258 14.7126 14.7126 14.9462 14.9462 15.3089 15.3089 16.3297 16.3297 17.0511 17.0511 18.4095 18.4095 19.5741 19.5741 20.7784 20.7784 21.2180 21.2180 k = 0.0000 0.4390-0.0000 ( 3085 PWs) bands (ev): 2.4948 2.4948 7.4638 7.4638 8.1998 8.1998 8.6546 8.6546 8.7990 8.7990 9.1904 9.1904 9.8827 9.8827 10.2260 10.2260 10.8282 10.8282 10.8878 10.8878 11.0951 11.0951 11.1259 11.1259 11.4292 11.4292 11.5427 11.5427 11.8297 11.8297 12.1844 12.1844 12.1964 12.1964 12.5985 12.5985 12.7948 12.7948 12.8541 12.8541 13.0289 13.0289 13.5279 13.5279 13.7555 13.7555 13.8279 13.8279 14.0341 14.0341 14.1233 14.1233 14.7005 14.7005 14.9780 14.9780 15.2989 15.2989 16.2688 16.2688 17.0279 17.0279 18.4394 18.4394 19.5851 19.5851 20.8109 20.8109 21.1848 21.1848 k = 0.0000 0.4512-0.0000 ( 3081 PWs) bands (ev): 2.5060 2.5060 7.4822 7.4822 8.2405 8.2405 8.6439 8.6439 8.7951 8.7951 9.1956 9.1956 9.8770 9.8770 10.2102 10.2102 10.8377 10.8377 10.8881 10.8881 11.1373 11.1373 11.1468 11.1468 11.4237 11.4237 11.5773 11.5773 11.8429 11.8429 12.1497 12.1497 12.1842 12.1842 12.5595 12.5595 12.7733 12.7733 12.8103 12.8103 13.0193 13.0193 13.5314 13.5314 13.7346 13.7346 13.8225 13.8225 14.0077 14.0077 14.1233 14.1233 14.6901 14.6901 15.0082 15.0082 15.2885 15.2885 16.2169 16.2169 17.0093 17.0093 18.4642 18.4642 19.5951 19.5951 20.8369 20.8369 21.1573 21.1573 k = 0.0000 0.4634-0.0000 ( 3079 PWs) bands (ev): 2.5148 2.5148 7.4975 7.4975 8.2733 8.2733 8.6315 8.6315 8.7937 8.7937 9.2015 9.2015 9.8720 9.8720 10.1964 10.1964 10.8447 10.8447 10.8856 10.8856 11.1626 11.1626 11.1821 11.1821 11.4115 11.4115 11.6061 11.6061 11.8597 11.8597 12.1152 12.1152 12.1784 12.1784 12.5264 12.5264 12.7556 12.7556 12.7747 12.7747 13.0130 13.0130 13.5343 13.5343 13.7145 13.7145 13.8194 13.8194 13.9878 13.9878 14.1240 14.1240 14.6817 14.6817 15.0354 15.0354 15.2779 15.2779 16.1751 16.1751 16.9950 16.9950 18.4835 18.4835 19.6034 19.6034 20.8563 20.8563 21.1361 21.1361 k = 0.0000 0.4756-0.0000 ( 3075 PWs) bands (ev): 2.5212 2.5212 7.5090 7.5090 8.2974 8.2974 8.6204 8.6204 8.7938 8.7938 9.2068 9.2068 9.8682 9.8682 10.1855 10.1855 10.8496 10.8496 10.8826 10.8826 11.1744 11.1744 11.2241 11.2241 11.3940 11.3940 11.6280 11.6280 11.8763 11.8763 12.0888 12.0888 12.1730 12.1730 12.5013 12.5013 12.7411 12.7411 12.7497 12.7497 13.0093 13.0093 13.5363 13.5363 13.6984 13.6984 13.8171 13.8171 13.9743 13.9743 14.1248 14.1248 14.6755 14.6755 15.0578 15.0578 15.2681 15.2681 16.1444 16.1444 16.9850 16.9850 18.4975 18.4975 19.6098 19.6098 20.8694 20.8694 21.1214 21.1214 k = 0.0000 0.4878-0.0000 ( 3065 PWs) bands (ev): 2.5250 2.5250 7.5163 7.5163 8.3122 8.3122 8.6127 8.6127 8.7943 8.7943 9.2104 9.2104 9.8658 9.8658 10.1786 10.1786 10.8525 10.8525 10.8804 10.8804 11.1814 11.1814 11.2589 11.2589 11.3747 11.3747 11.6417 11.6417 11.8884 11.8884 12.0727 12.0727 12.1683 12.1683 12.4859 12.4859 12.7279 12.7279 12.7383 12.7383 13.0073 13.0073 13.5373 13.5373 13.6880 13.6880 13.8156 13.8156 13.9666 13.9666 14.1255 14.1255 14.6717 14.6717 15.0731 15.0731 15.2608 15.2608 16.1256 16.1256 16.9791 16.9791 18.5059 18.5059 19.6138 19.6138 20.8768 20.8768 21.1129 21.1129 k = 0.0000 0.5000-0.0000 ( 3068 PWs) bands (ev): 2.5263 2.5263 7.5187 7.5187 8.3172 8.3172 8.6100 8.6100 8.7946 8.7946 9.2117 9.2117 9.8650 9.8650 10.1762 10.1762 10.8534 10.8534 10.8797 10.8797 11.1838 11.1838 11.2745 11.2745 11.3643 11.3643 11.6464 11.6464 11.8929 11.8929 12.0673 12.0673 12.1663 12.1663 12.4808 12.4808 12.7226 12.7226 12.7353 12.7353 13.0067 13.0067 13.5377 13.5377 13.6845 13.6845 13.8150 13.8150 13.9641 13.9641 14.1257 14.1257 14.6704 14.6704 15.0785 15.0785 15.2580 15.2580 16.1193 16.1193 16.9771 16.9771 18.5087 18.5087 19.6152 19.6152 20.8792 20.8792 21.1101 21.1101 k = 0.0000 0.5000-0.0000 ( 3068 PWs) bands (ev): 2.5263 2.5263 7.5187 7.5187 8.3172 8.3172 8.6100 8.6100 8.7946 8.7946 9.2117 9.2117 9.8650 9.8650 10.1762 10.1762 10.8534 10.8534 10.8797 10.8797 11.1838 11.1838 11.2745 11.2745 11.3643 11.3643 11.6464 11.6464 11.8929 11.8929 12.0673 12.0673 12.1663 12.1663 12.4808 12.4808 12.7226 12.7226 12.7353 12.7353 13.0067 13.0067 13.5377 13.5377 13.6845 13.6845 13.8150 13.8150 13.9641 13.9641 14.1257 14.1257 14.6704 14.6704 15.0785 15.0785 15.2580 15.2580 16.1193 16.1193 16.9771 16.9771 18.5087 18.5087 19.6152 19.6152 20.8792 20.8792 21.1101 21.1101 k = 0.0122 0.5000-0.0000 ( 3066 PWs) bands (ev): 2.5269 2.5269 7.5188 7.5188 8.3172 8.3172 8.5925 8.5925 8.8141 8.8141 9.2107 9.2107 9.8658 9.8658 10.1756 10.1756 10.8540 10.8540 10.8810 10.8810 11.1820 11.1820 11.2717 11.2717 11.3655 11.3655 11.6466 11.6466 11.8891 11.8891 12.0619 12.0619 12.1709 12.1709 12.4811 12.4811 12.7272 12.7272 12.7366 12.7366 13.0087 13.0087 13.5366 13.5366 13.6850 13.6850 13.8150 13.8150 13.9662 13.9662 14.1271 14.1271 14.6702 14.6702 15.0742 15.0742 15.2625 15.2625 16.1187 16.1187 16.9770 16.9770 18.4926 18.4926 19.6341 19.6341 20.8779 20.8779 21.1006 21.1006 k = 0.0244 0.5000-0.0000 ( 3078 PWs) bands (ev): 2.5290 2.5290 7.5191 7.5191 8.3166 8.3166 8.5537 8.5537 8.8589 8.8589 9.2079 9.2079 9.8682 9.8682 10.1738 10.1738 10.8555 10.8555 10.8848 10.8848 11.1758 11.1758 11.2654 11.2654 11.3678 11.3678 11.6470 11.6470 11.8780 11.8780 12.0483 12.0483 12.1819 12.1819 12.4826 12.4826 12.7390 12.7390 12.7415 12.7415 13.0150 13.0150 13.5335 13.5335 13.6868 13.6868 13.8147 13.8147 13.9725 13.9725 14.1312 14.1312 14.6694 14.6694 15.0625 15.0625 15.2748 15.2748 16.1171 16.1171 16.9769 16.9769 18.4477 18.4477 19.6876 19.6876 20.8728 20.8728 21.0732 21.0732 k = 0.0366 0.5000-0.0000 ( 3086 PWs) bands (ev): 2.5325 2.5325 7.5196 7.5196 8.3140 8.3140 8.5105 8.5105 8.9130 8.9130 9.2041 9.2041 9.8722 9.8722 10.1708 10.1708 10.8581 10.8581 10.8912 10.8912 11.1634 11.1634 11.2601 11.2601 11.3691 11.3691 11.6472 11.6472 11.8606 11.8606 12.0309 12.0309 12.1951 12.1951 12.4865 12.4865 12.7460 12.7460 12.7592 12.7592 13.0264 13.0264 13.5280 13.5280 13.6904 13.6904 13.8141 13.8141 13.9824 13.9824 14.1381 14.1381 14.6682 14.6682 15.0459 15.0459 15.2925 15.2925 16.1144 16.1144 16.9766 16.9766 18.3811 18.3811 19.7681 19.7681 20.8599 20.8599 21.0328 21.0328 k = 0.0488 0.5000-0.0000 ( 3086 PWs) bands (ev): 2.5372 2.5372 7.5203 7.5203 8.3057 8.3057 8.4726 8.4726 8.9686 8.9686 9.2014 9.2014 9.8777 9.8777 10.1666 10.1666 10.8617 10.8617 10.8997 10.8997 11.1441 11.1441 11.2587 11.2587 11.3678 11.3678 11.6462 11.6462 11.8382 11.8382 12.0122 12.0122 12.2078 12.2078 12.4942 12.4942 12.7539 12.7539 12.7804 12.7804 13.0440 13.0440 13.5204 13.5204 13.6964 13.6964 13.8132 13.8132 13.9954 13.9954 14.1477 14.1477 14.6664 14.6664 15.0264 15.0264 15.3133 15.3133 16.1106 16.1106 16.9762 16.9762 18.3007 18.3007 19.8675 19.8675 20.8287 20.8287 20.9914 20.9914 k = 0.0610 0.5000-0.0000 ( 3082 PWs) bands (ev): 2.5434 2.5434 7.5211 7.5211 8.2867 8.2867 8.4473 8.4473 9.0188 9.0188 9.2043 9.2043 9.8846 9.8846 10.1611 10.1611 10.8663 10.8663 10.9100 10.9100 11.1193 11.1193 11.2614 11.2614 11.3632 11.3632 11.6433 11.6433 11.8121 11.8121 11.9939 11.9939 12.2192 12.2192 12.5063 12.5063 12.7631 12.7631 12.8008 12.8008 13.0689 13.0689 13.5110 13.5110 13.7053 13.7053 13.8118 13.8118 14.0107 14.0107 14.1601 14.1601 14.6643 14.6643 15.0055 15.0055 15.3359 15.3359 16.1057 16.1057 16.9756 16.9756 18.2126 18.2126 19.9787 19.9787 20.7667 20.7667 20.9641 20.9641 k = 0.0732 0.5000-0.0000 ( 3086 PWs) bands (ev): 2.5508 2.5508 7.5220 7.5220 8.2549 8.2549 8.4375 8.4375 9.0539 9.0539 9.2217 9.2217 9.8929 9.8929 10.1543 10.1543 10.8718 10.8718 10.9215 10.9215 11.0913 11.0913 11.2671 11.2671 11.3554 11.3554 11.6378 11.6378 11.7836 11.7836 11.9768 11.9768 12.2291 12.2291 12.5226 12.5226 12.7733 12.7733 12.8182 12.8182 13.1018 13.1018 13.5003 13.5003 13.7171 13.7171 13.8098 13.8098 14.0278 14.0278 14.1752 14.1752 14.6617 14.6617 14.9841 14.9841 15.3593 15.3593 16.0998 16.0998 16.9749 16.9749 18.1209 18.1209 20.0962 20.0962 20.6759 20.6759 20.9521 20.9521 k = 0.0854 0.5000-0.0000 ( 3088 PWs) bands (ev): 2.5595 2.5595 7.5231 7.5231 8.2141 8.2141 8.4401 8.4401 9.0667 9.0667 9.2606 9.2606 9.9023 9.9023 10.1463 10.1463 10.8780 10.8780 10.9332 10.9332 11.0624 11.0624 11.2742 11.2742 11.3449 11.3449 11.6296 11.6296 11.7537 11.7537 11.9617 11.9617 12.2378 12.2378 12.5429 12.5429 12.7840 12.7840 12.8315 12.8315 13.1419 13.1419 13.4892 13.4892 13.7316 13.7316 13.8073 13.8073 14.0464 14.0464 14.1927 14.1927 14.6588 14.6588 14.9628 14.9628 15.3828 15.3828 16.0929 16.0929 16.9741 16.9741 18.0286 18.0286 20.2149 20.2149 20.5665 20.5665 20.9487 20.9487 k = 0.0976 0.5000-0.0000 ( 3084 PWs) bands (ev): 2.5694 2.5694 7.5242 7.5242 8.1691 8.1691 8.4507 8.4507 9.0620 9.0620 9.3160 9.3160 9.9125 9.9125 10.1371 10.1371 10.8845 10.8845 10.9429 10.9429 11.0363 11.0363 11.2799 11.2799 11.3338 11.3338 11.6186 11.6186 11.7235 11.7235 11.9489 11.9489 12.2456 12.2456 12.5664 12.5664 12.7948 12.7948 12.8407 12.8407 13.1873 13.1873 13.4789 13.4789 13.7482 13.7482 13.8048 13.8048 14.0662 14.0662 14.2124 14.2124 14.6555 14.6555 14.9419 14.9419 15.4060 15.4060 16.0849 16.0849 16.9731 16.9731 17.9378 17.9378 20.3294 20.3294 20.4454 20.4454 20.9506 20.9506 k = 0.1098 0.5000-0.0000 ( 3090 PWs) bands (ev): 2.5804 2.5804 7.5253 7.5253 8.1227 8.1227 8.4664 8.4664 9.0480 9.0480 9.3796 9.3796 9.9234 9.9234 10.1268 10.1268 10.8900 10.8900 10.9457 10.9457 11.0192 11.0192 11.2787 11.2787 11.3276 11.3276 11.6056 11.6056 11.6937 11.6937 11.9384 11.9384 12.2528 12.2528 12.5924 12.5924 12.8053 12.8053 12.8465 12.8465 13.2351 13.2351 13.4711 13.4711 13.7650 13.7650 13.8038 13.8038 14.0872 14.0872 14.2341 14.2341 14.6520 14.6520 14.9215 14.9215 15.4288 15.4288 16.0760 16.0760 16.9719 16.9719 17.8496 17.8496 20.3168 20.3168 20.4328 20.4328 20.9577 20.9577 k = 0.1220 0.5000-0.0000 ( 3090 PWs) bands (ev): 2.5926 2.5926 7.5265 7.5265 8.0764 8.0764 8.4859 8.4859 9.0289 9.0289 9.4472 9.4472 9.9345 9.9345 10.1159 10.1159 10.8904 10.8904 10.9397 10.9397 11.0174 11.0174 11.2657 11.2657 11.3305 11.3305 11.5913 11.5913 11.6652 11.6652 11.9302 11.9302 12.2596 12.2596 12.6202 12.6202 12.8154 12.8154 12.8497 12.8497 13.2807 13.2807 13.4693 13.4693 13.7758 13.7758 13.8106 13.8106 14.1094 14.1094 14.2574 14.2574 14.6484 14.6484 14.9018 14.9018 15.4508 15.4508 16.0660 16.0660 16.9704 16.9704 17.7652 17.7652 20.1834 20.1834 20.5160 20.5160 20.9715 20.9715 k = 0.1341 0.5000-0.0000 ( 3082 PWs) bands (ev): 2.6058 2.6058 7.5276 7.5276 8.0310 8.0310 8.5084 8.5084 9.0069 9.0069 9.5167 9.5167 9.9450 9.9450 10.1047 10.1047 10.8776 10.8776 10.9372 10.9372 11.0265 11.0265 11.2446 11.2446 11.3387 11.3387 11.5768 11.5768 11.6388 11.6388 11.9241 11.9241 12.2660 12.2660 12.6494 12.6494 12.8245 12.8245 12.8508 12.8508 13.3170 13.3170 13.4789 13.4789 13.7756 13.7756 13.8301 13.8301 14.1329 14.1329 14.2818 14.2818 14.6445 14.6445 14.8827 14.8827 15.4719 15.4719 16.0550 16.0550 16.9687 16.9687 17.6851 17.6851 20.0470 20.0470 20.5698 20.5698 20.9916 20.9916 k = 0.1463 0.5000-0.0000 ( 3090 PWs) bands (ev): 2.6199 2.6199 7.5287 7.5287 7.9871 7.9871 8.5335 8.5335 8.9829 8.9829 9.5869 9.5869 9.9540 9.9540 10.0941 10.0941 10.8533 10.8533 10.9430 10.9430 11.0395 11.0395 11.2196 11.2196 11.3477 11.3477 11.5633 11.5633 11.6154 11.6154 11.9197 11.9197 12.2719 12.2719 12.6795 12.6795 12.8324 12.8324 12.8509 12.8509 13.3373 13.3373 13.5052 13.5052 13.7701 13.7701 13.8571 13.8571 14.1580 14.1580 14.3071 14.3071 14.6407 14.6407 14.8643 14.8643 15.4919 15.4919 16.0429 16.0429 16.9667 16.9667 17.6098 17.6098 19.9088 19.9088 20.5892 20.5892 21.0106 21.0106 k = 0.1585 0.5000-0.0000 ( 3086 PWs) bands (ev): 2.6350 2.6350 7.5296 7.5296 7.9449 7.9449 8.5609 8.5609 8.9578 8.9578 9.6572 9.6572 9.9601 9.9601 10.0855 10.0855 10.8248 10.8248 10.9523 10.9523 11.0535 11.0535 11.1928 11.1928 11.3554 11.3554 11.5518 11.5518 11.5958 11.5958 11.9168 11.9168 12.2774 12.2774 12.7100 12.7100 12.8376 12.8376 12.8515 12.8515 13.3432 13.3432 13.5454 13.5454 13.7626 13.7626 13.8887 13.8887 14.1846 14.1846 14.3329 14.3329 14.6369 14.6369 14.8464 14.8464 15.5109 15.5109 16.0297 16.0297 16.9642 16.9642 17.5396 17.5396 19.7699 19.7699 20.5759 20.5759 21.0141 21.0141 k = 0.1707 0.5000-0.0000 ( 3086 PWs) bands (ev): 2.6509 2.6509 7.5303 7.5303 7.9047 7.9047 8.5902 8.5902 8.9320 8.9320 9.7269 9.7269 9.9614 9.9614 10.0804 10.0804 10.7952 10.7952 10.9621 10.9621 11.0668 11.0668 11.1660 11.1660 11.3607 11.3607 11.5427 11.5427 11.5815 11.5815 11.9151 11.9151 12.2824 12.2824 12.7408 12.7408 12.8379 12.8379 12.8551 12.8551 13.3409 13.3409 13.5913 13.5913 13.7542 13.7542 13.9247 13.9247 14.2129 14.2129 14.3590 14.3590 14.6332 14.6332 14.8291 14.8291 15.5286 15.5286 16.0154 16.0154 16.9611 16.9611 17.4749 17.4749 19.6310 19.6310 20.5348 20.5348 20.9924 20.9924 k = 0.1829 0.5000-0.0000 ( 3086 PWs) bands (ev): 2.6675 2.6675 7.5308 7.5308 7.8665 7.8665 8.6212 8.6212 8.9059 8.9059 9.7955 9.7955 9.9567 9.9567 10.0800 10.0800 10.7658 10.7658 10.9700 10.9700 11.0770 11.0770 11.1433 11.1433 11.3632 11.3632 11.5357 11.5357 11.5736 11.5736 11.9141 11.9141 12.2870 12.2870 12.7716 12.7716 12.8346 12.8346 12.8609 12.8609 13.3350 13.3350 13.6368 13.6368 13.7455 13.7455 13.9651 13.9651 14.2429 14.2429 14.3850 14.3850 14.6300 14.6300 14.8124 14.8124 15.5449 15.5449 15.9999 15.9999 16.9573 16.9573 17.4156 17.4156 19.4926 19.4926 20.4705 20.4705 20.9486 20.9486 k = 0.1951 0.5000-0.0000 ( 3090 PWs) bands (ev): 2.6848 2.6848 7.5311 7.5311 7.8305 7.8305 8.6535 8.6535 8.8799 8.8799 9.8622 9.8622 9.9463 9.9463 10.0839 10.0839 10.7372 10.7372 10.9729 10.9729 11.0784 11.0784 11.1335 11.1335 11.3634 11.3634 11.5303 11.5303 11.5726 11.5726 11.9136 11.9136 12.2912 12.2912 12.8020 12.8020 12.8296 12.8296 12.8674 12.8674 13.3277 13.3277 13.6778 13.6778 13.7375 13.7375 14.0098 14.0098 14.2746 14.2746 14.4108 14.4108 14.6274 14.6274 14.7962 14.7962 15.5597 15.5597 15.9831 15.9831 16.9527 16.9527 17.3621 17.3621 19.3553 19.3553 20.3875 20.3875 20.8919 20.8919 k = 0.2073 0.5000-0.0000 ( 3090 PWs) bands (ev): 2.7026 2.7026 7.5311 7.5311 7.7968 7.7968 8.6866 8.6866 8.8548 8.8548 9.9209 9.9209 9.9372 9.9372 10.0905 10.0905 10.7096 10.7096 10.9669 10.9669 11.0708 11.0708 11.1413 11.1413 11.3621 11.3621 11.5272 11.5272 11.5771 11.5771 11.9133 11.9133 12.2950 12.2950 12.8203 12.8203 12.8350 12.8350 12.8746 12.8746 13.3199 13.3199 13.7075 13.7075 13.7358 13.7358 14.0577 14.0577 14.3081 14.3081 14.4361 14.4361 14.6261 14.6261 14.7807 14.7807 15.5726 15.5726 15.9651 15.9651 16.9468 16.9468 17.3144 17.3144 19.2195 19.2195 20.2906 20.2906 20.8295 20.8295 k = 0.2195 0.5000-0.0000 ( 3088 PWs) bands (ev): 2.7208 2.7208 7.5307 7.5307 7.7655 7.7655 8.7189 8.7189 8.8320 8.8320 9.9109 9.9109 9.9909 9.9909 10.0981 10.0981 10.6831 10.6831 10.9495 10.9495 11.0646 11.0646 11.1596 11.1596 11.3602 11.3602 11.5268 11.5268 11.5856 11.5856 11.9130 11.9130 12.2984 12.2984 12.8136 12.8136 12.8622 12.8622 12.8846 12.8846 13.3121 13.3121 13.7108 13.7108 13.7551 13.7551 14.1071 14.1071 14.3433 14.3433 14.4609 14.4609 14.6266 14.6266 14.7665 14.7665 15.5833 15.5833 15.9461 15.9461 16.9396 16.9396 17.2727 17.2727 19.0855 19.0855 20.1845 20.1845 20.7652 20.7652 k = 0.2317 0.5000-0.0000 ( 3088 PWs) bands (ev): 2.7393 2.7393 7.5299 7.5299 7.7367 7.7367 8.7447 8.7447 8.8173 8.8173 9.8908 9.8908 10.0494 10.0494 10.1053 10.1053 10.6577 10.6577 10.9234 10.9234 11.0633 11.0633 11.1839 11.1839 11.3586 11.3586 11.5292 11.5292 11.5966 11.5966 11.9124 11.9124 12.3016 12.3016 12.8048 12.8048 12.8807 12.8807 12.9051 12.9051 13.3047 13.3047 13.7046 13.7046 13.7786 13.7786 14.1549 14.1549 14.3800 14.3800 14.4853 14.4853 14.6294 14.6294 14.7544 14.7544 15.5911 15.5911 15.9263 15.9263 16.9305 16.9305 17.2370 17.2370 18.9537 18.9537 20.0736 20.0736 20.7002 20.7002 k = 0.2439 0.5000-0.0000 ( 3092 PWs) bands (ev): 2.7581 2.7581 7.5287 7.5287 7.7103 7.7103 8.7485 8.7485 8.8262 8.8262 9.8692 9.8692 10.1037 10.1037 10.1117 10.1117 10.6333 10.6333 10.8925 10.8925 11.0653 11.0653 11.2129 11.2129 11.3580 11.3580 11.5338 11.5338 11.6095 11.6095 11.9115 11.9115 12.3046 12.3046 12.7949 12.7949 12.8909 12.8909 12.9353 12.9353 13.2979 13.2979 13.6978 13.6978 13.7977 13.7977 14.1978 14.1978 14.4180 14.4180 14.5098 14.5098 14.6346 14.6346 14.7464 14.7464 15.5950 15.5950 15.9065 15.9065 16.9195 16.9195 17.2074 17.2074 18.8244 18.8244 19.9612 19.9612 20.6354 20.6354 k = 0.2561 0.5000-0.0000 ( 3090 PWs) bands (ev): 2.7770 2.7770 7.5270 7.5270 7.6865 7.6865 8.7326 8.7326 8.8564 8.8564 9.8467 9.8467 10.1143 10.1143 10.1552 10.1552 10.6097 10.6097 10.8600 10.8600 11.0697 11.0697 11.2460 11.2460 11.3590 11.3590 11.5395 11.5395 11.6240 11.6240 11.9102 11.9102 12.3074 12.3074 12.7842 12.7842 12.9000 12.9000 12.9682 12.9682 13.2918 13.2918 13.6916 13.6916 13.8117 13.8117 14.2322 14.2322 14.4558 14.4558 14.5352 14.5352 14.6411 14.6411 14.7462 14.7462 15.5937 15.5937 15.8877 15.8877 16.9063 16.9063 17.1837 17.1837 18.6978 18.6978 19.8501 19.8501 20.5711 20.5711 k = 0.2683 0.5000-0.0000 ( 3090 PWs) bands (ev): 2.7959 2.7959 7.5248 7.5248 7.6653 7.6653 8.7113 8.7113 8.8933 8.8933 9.8239 9.8239 10.1150 10.1150 10.2010 10.2010 10.5865 10.5865 10.8276 10.8276 11.0763 11.0763 11.2826 11.2826 11.3624 11.3624 11.5455 11.5455 11.6403 11.6403 11.9083 11.9083 12.3101 12.3101 12.7728 12.7728 12.9095 12.9095 13.0026 13.0026 13.2867 13.2867 13.6863 13.6863 13.8202 13.8202 14.2564 14.2564 14.4899 14.4899 14.5620 14.5620 14.6482 14.6482 14.7584 14.7584 15.5858 15.5858 15.8715 15.8715 16.8910 16.8910 17.1656 17.1656 18.5743 18.5743 19.7420 19.7420 20.5078 20.5078 k = 0.2805 0.5000-0.0000 ( 3082 PWs) bands (ev): 2.8147 2.8147 7.5220 7.5220 7.6467 7.6467 8.6891 8.6891 8.9326 8.9326 9.8011 9.8011 10.1123 10.1123 10.2417 10.2417 10.5633 10.5633 10.7968 10.7968 11.0850 11.0850 11.3210 11.3210 11.3696 11.3696 11.5509 11.5509 11.6583 11.6583 11.9060 11.9060 12.3128 12.3128 12.7610 12.7610 12.9196 12.9196 13.0384 13.0384 13.2829 13.2829 13.6818 13.6818 13.8231 13.8231 14.2706 14.2706 14.5146 14.5146 14.5889 14.5889 14.6591 14.6591 14.7856 14.7856 15.5699 15.5699 15.8593 15.8593 16.8738 16.8738 17.1523 17.1523 18.4541 18.4541 19.6382 19.6382 20.4461 20.4461 k = 0.2927 0.5000-0.0000 ( 3078 PWs) bands (ev): 2.8333 2.8333 7.5187 7.5187 7.6306 7.6306 8.6670 8.6670 8.9731 8.9731 9.7785 9.7785 10.1060 10.1060 10.2771 10.2771 10.5397 10.5397 10.7687 10.7687 11.0956 11.0956 11.3549 11.3549 11.3869 11.3869 11.5554 11.5554 11.6781 11.6781 11.9032 11.9032 12.3157 12.3157 12.7489 12.7489 12.9303 12.9303 13.0757 13.0757 13.2807 13.2807 13.6780 13.6780 13.8201 13.8201 14.2766 14.2766 14.5248 14.5248 14.6129 14.6129 14.6802 14.6802 14.8263 14.8263 15.5458 15.5458 15.8518 15.8518 16.8549 16.8549 17.1433 17.1433 18.3375 18.3375 19.5397 19.5397 20.3864 20.3864 k = 0.3049 0.5000-0.0000 ( 3078 PWs) bands (ev): 2.8515 2.8515 7.5150 7.5150 7.6169 7.6169 8.6456 8.6456 9.0142 9.0142 9.7564 9.7564 10.0961 10.0961 10.3068 10.3068 10.5155 10.5155 10.7442 10.7442 11.1077 11.1077 11.3747 11.3747 11.4232 11.4232 11.5595 11.5595 11.6994 11.6994 11.9002 11.9002 12.3189 12.3189 12.7368 12.7368 12.9415 12.9415 13.1145 13.1145 13.2804 13.2804 13.6745 13.6745 13.8111 13.8111 14.2769 14.2769 14.5210 14.5210 14.6342 14.6342 14.7112 14.7112 14.8769 14.8769 15.5143 15.5143 15.8489 15.8489 16.8345 16.8345 17.1378 17.1378 18.2248 18.2248 19.4472 19.4472 20.3294 20.3294 k = 0.3171 0.5000-0.0000 ( 3082 PWs) bands (ev): 2.8693 2.8693 7.5109 7.5109 7.6055 7.6055 8.6250 8.6250 9.0555 9.0555 9.7350 9.7350 10.0830 10.0830 10.3302 10.3302 10.4915 10.4915 10.7236 10.7236 11.1205 11.1205 11.3898 11.3898 11.4670 11.4670 11.5646 11.5646 11.7222 11.7222 11.8971 11.8971 12.3225 12.3225 12.7248 12.7248 12.9529 12.9529 13.1548 13.1548 13.2824 13.2824 13.6708 13.6708 13.7964 13.7964 14.2739 14.2739 14.5074 14.5074 14.6540 14.6540 14.7463 14.7463 14.9330 14.9330 15.4783 15.4783 15.8500 15.8500 16.8129 16.8129 17.1351 17.1351 18.1165 18.1165 19.3609 19.3609 20.2752 20.2752 k = 0.3293 0.5000-0.0000 ( 3078 PWs) bands (ev): 2.8865 2.8865 7.5066 7.5066 7.5961 7.5961 8.6054 8.6054 9.0968 9.0968 9.7146 9.7146 10.0669 10.0669 10.3452 10.3452 10.4697 10.4697 10.7072 10.7072 11.1335 11.1335 11.4051 11.4051 11.5078 11.5078 11.5757 11.5757 11.7462 11.7462 11.8943 11.8943 12.3268 12.3268 12.7133 12.7133 12.9642 12.9642 13.1964 13.1964 13.2871 13.2871 13.6654 13.6654 13.7773 13.7773 14.2690 14.2690 14.4882 14.4882 14.6725 14.6725 14.7814 14.7814 14.9896 14.9896 15.4419 15.4419 15.8540 15.8540 16.7900 16.7900 17.1344 17.1344 18.0127 18.0127 19.2813 19.2813 20.2244 20.2244 k = 0.3415 0.5000-0.0000 ( 3074 PWs) bands (ev): 2.9031 2.9031 7.5024 7.5024 7.5884 7.5884 8.5869 8.5869 9.1378 9.1378 9.6953 9.6953 10.0484 10.0484 10.3479 10.3479 10.4548 10.4548 10.6947 10.6947 11.1461 11.1461 11.4202 11.4202 11.5352 11.5352 11.6021 11.6021 11.7715 11.7715 11.8924 11.8924 12.3319 12.3319 12.7023 12.7023 12.9750 12.9750 13.2392 13.2392 13.2949 13.2949 13.6561 13.6561 13.7565 13.7565 14.2631 14.2631 14.4657 14.4657 14.6892 14.6892 14.8133 14.8133 15.0408 15.0408 15.4123 15.4123 15.8599 15.8599 16.7658 16.7658 17.1353 17.1353 17.9140 17.9140 19.2082 19.2082 20.1771 20.1771 k = 0.3537 0.5000-0.0000 ( 3080 PWs) bands (ev): 2.9189 2.9189 7.4983 7.4983 7.5823 7.5823 8.5695 8.5695 9.1783 9.1783 9.6772 9.6772 10.0281 10.0281 10.3353 10.3353 10.4508 10.4508 10.6855 10.6855 11.1579 11.1579 11.4330 11.4330 11.5514 11.5514 11.6414 11.6414 11.7985 11.7985 11.8924 11.8924 12.3380 12.3380 12.6920 12.6920 12.9848 12.9848 13.2824 13.2824 13.3068 13.3068 13.6386 13.6386 13.7389 13.7389 14.2563 14.2563 14.4415 14.4415 14.7034 14.7034 14.8384 14.8384 15.0793 15.0793 15.3995 15.3995 15.8670 15.8670 16.7402 16.7402 17.1372 17.1372 17.8207 17.8207 19.1418 19.1418 20.1335 20.1335 k = 0.3659 0.5000-0.0000 ( 3082 PWs) bands (ev): 2.9338 2.9338 7.4946 7.4946 7.5773 7.5773 8.5533 8.5533 9.2179 9.2179 9.6608 9.6608 10.0067 10.0067 10.3109 10.3109 10.4549 10.4549 10.6790 10.6790 11.1688 11.1688 11.4410 11.4410 11.5675 11.5675 11.6817 11.6817 11.8266 11.8266 11.8971 11.8971 12.3452 12.3452 12.6825 12.6825 12.9929 12.9929 13.3167 13.3167 13.3320 13.3320 13.6103 13.6103 13.7283 13.7283 14.2482 14.2482 14.4167 14.4167 14.7140 14.7140 14.8517 14.8517 15.1017 15.1017 15.4124 15.4124 15.8748 15.8748 16.7131 16.7131 17.1396 17.1396 17.7333 17.7333 19.0818 19.0818 20.0938 20.0938 k = 0.3780 0.5000-0.0000 ( 3082 PWs) bands (ev): 2.9478 2.9478 7.4914 7.4914 7.5733 7.5733 8.5384 8.5384 9.2564 9.2564 9.6460 9.6460 9.9848 9.9848 10.2803 10.2803 10.4624 10.4624 10.6747 10.6747 11.1788 11.1788 11.4433 11.4433 11.5877 11.5877 11.7161 11.7161 11.8508 11.8508 11.9136 11.9136 12.3536 12.3536 12.6739 12.6739 12.9987 12.9987 13.3368 13.3368 13.3751 13.3751 13.5734 13.5734 13.7247 13.7247 14.2375 14.2375 14.3928 14.3928 14.7182 14.7182 14.8498 14.8498 15.1149 15.1149 15.4500 15.4500 15.8828 15.8828 16.6843 16.6843 17.1420 17.1420 17.6523 17.6523 19.0281 19.0281 20.0578 20.0578 k = 0.3902 0.5000-0.0000 ( 3086 PWs) bands (ev): 2.9607 2.9607 7.4887 7.4887 7.5701 7.5701 8.5248 8.5248 9.2932 9.2932 9.6333 9.6333 9.9630 9.9630 10.2470 10.2470 10.4706 10.4706 10.6720 10.6720 11.1880 11.1880 11.4407 11.4407 11.6116 11.6116 11.7422 11.7422 11.8648 11.8648 11.9489 11.9489 12.3630 12.3630 12.6663 12.6663 13.0011 13.0011 13.3584 13.3584 13.4185 13.4185 13.5339 13.5339 13.7262 13.7262 14.2228 14.2228 14.3711 14.3711 14.7102 14.7102 14.8364 14.8364 15.1298 15.1298 15.5031 15.5031 15.8908 15.8908 16.6539 16.6539 17.1439 17.1439 17.5784 17.5784 18.9805 18.9805 20.0257 20.0257 k = 0.4024 0.5000-0.0000 ( 3078 PWs) bands (ev): 2.9724 2.9724 7.4865 7.4865 7.5675 7.5675 8.5126 8.5126 9.3279 9.3279 9.6230 9.6230 9.9420 9.9420 10.2128 10.2128 10.4785 10.4785 10.6706 10.6706 11.1966 11.1966 11.4347 11.4347 11.6373 11.6373 11.7602 11.7602 11.8730 11.8730 11.9977 11.9977 12.3734 12.3734 12.6595 12.6595 12.9993 12.9993 13.3805 13.3805 13.4495 13.4495 13.5082 13.5082 13.7314 13.7314 14.2027 14.2027 14.3525 14.3525 14.6817 14.6817 14.8243 14.8243 15.1500 15.1500 15.5637 15.5637 15.8986 15.8986 16.6219 16.6219 17.1445 17.1445 17.5123 17.5123 18.9387 18.9387 19.9974 19.9974 k = 0.4146 0.5000-0.0000 ( 3074 PWs) bands (ev): 2.9830 2.9830 7.4847 7.4847 7.5655 7.5655 8.5017 8.5017 9.3597 9.3597 9.6153 9.6153 9.9223 9.9223 10.1788 10.1788 10.4856 10.4856 10.6699 10.6699 11.2046 11.2046 11.4268 11.4268 11.6629 11.6629 11.7719 11.7719 11.8797 11.8797 12.0530 12.0530 12.3844 12.3844 12.6537 12.6537 12.9920 12.9920 13.3910 13.3910 13.4465 13.4465 13.5321 13.5321 13.7404 13.7404 14.1767 14.1767 14.3368 14.3368 14.6330 14.6330 14.8203 14.8203 15.1738 15.1738 15.6269 15.6269 15.9060 15.9060 16.5885 16.5885 17.1432 17.1432 17.4549 17.4549 18.9024 18.9024 19.9726 19.9726 k = 0.4268 0.5000-0.0000 ( 3070 PWs) bands (ev): 2.9923 2.9923 7.4834 7.4834 7.5640 7.5640 8.4922 8.4922 9.3879 9.3879 9.6108 9.6108 9.9044 9.9044 10.1457 10.1457 10.4919 10.4919 10.6697 10.6697 11.2120 11.2120 11.4180 11.4180 11.6869 11.6869 11.7792 11.7792 11.8863 11.8863 12.1111 12.1111 12.3956 12.3956 12.6488 12.6488 12.9781 12.9781 13.3700 13.3700 13.4604 13.4604 13.5761 13.5761 13.7538 13.7538 14.1454 14.1454 14.3219 14.3219 14.5735 14.5735 14.8218 14.8218 15.1984 15.1984 15.6895 15.6895 15.9132 15.9132 16.5542 16.5542 17.1395 17.1395 17.4068 17.4068 18.8715 18.8715 19.9514 19.9514 k = 0.4390 0.5000-0.0000 ( 3078 PWs) bands (ev): 3.0003 3.0003 7.4824 7.4824 7.5629 7.5629 8.4842 8.4842 9.4116 9.4116 9.6098 9.6098 9.8888 9.8888 10.1144 10.1144 10.4973 10.4973 10.6699 10.6699 11.2189 11.2189 11.4089 11.4089 11.7081 11.7081 11.7838 11.7838 11.8925 11.8925 12.1698 12.1698 12.4065 12.4065 12.6445 12.6445 12.9570 12.9570 13.3397 13.3397 13.4860 13.4860 13.6234 13.6234 13.7725 13.7725 14.1099 14.1099 14.3040 14.3040 14.5130 14.5130 14.8253 14.8253 15.2218 15.2218 15.7490 15.7490 15.9201 15.9201 16.5195 16.5195 17.1328 17.1328 17.3688 17.3688 18.8456 18.8456 19.9335 19.9335 k = 0.4512 0.5000-0.0000 ( 3078 PWs) bands (ev): 3.0068 3.0068 7.4817 7.4817 7.5620 7.5620 8.4776 8.4776 9.4301 9.4301 9.6120 9.6120 9.8760 9.8760 10.0859 10.0859 10.5017 10.5017 10.6702 10.6702 11.2251 11.2251 11.4004 11.4004 11.7257 11.7257 11.7870 11.7870 11.8979 11.8979 12.2268 12.2268 12.4165 12.4165 12.6410 12.6410 12.9294 12.9294 13.3137 13.3137 13.5112 13.5112 13.6722 13.6722 13.7972 13.7972 14.0713 14.0713 14.2773 14.2773 14.4612 14.4612 14.8293 14.8293 15.2427 15.2427 15.8028 15.8028 15.9275 15.9275 16.4857 16.4857 17.1236 17.1236 17.3407 17.3407 18.8248 18.8248 19.9186 19.9186 k = 0.4634 0.5000-0.0000 ( 3082 PWs) bands (ev): 3.0120 3.0120 7.4812 7.4812 7.5614 7.5614 8.4724 8.4724 9.4434 9.4434 9.6167 9.6167 9.8661 9.8661 10.0613 10.0613 10.5052 10.5052 10.6706 10.6706 11.2304 11.2304 11.3929 11.3929 11.7389 11.7389 11.7896 11.7896 11.9025 11.9025 12.2793 12.2793 12.4252 12.4252 12.6380 12.6380 12.8979 12.8979 13.2944 13.2944 13.5320 13.5320 13.7220 13.7220 13.8274 13.8274 14.0309 14.0309 14.2376 14.2376 14.4253 14.4253 14.8328 14.8328 15.2600 15.2600 15.8473 15.8473 15.9363 15.9363 16.4544 16.4544 17.1133 17.1133 17.3215 17.3215 18.8087 18.8087 19.9063 19.9063 k = 0.4756 0.5000-0.0000 ( 3074 PWs) bands (ev): 3.0157 3.0157 7.4809 7.4809 7.5611 7.5611 8.4687 8.4687 9.4520 9.4520 9.6223 9.6223 9.8594 9.8594 10.0421 10.0421 10.5077 10.5077 10.6709 10.6709 11.2346 11.2346 11.3871 11.3871 11.7478 11.7478 11.7920 11.7920 11.9058 11.9058 12.3235 12.3235 12.4320 12.4320 12.6354 12.6354 12.8675 12.8675 13.2815 13.2815 13.5469 13.5469 13.7720 13.7720 13.8596 13.8596 13.9910 13.9910 14.1892 14.1892 14.4054 14.4054 14.8355 14.8355 15.2728 15.2728 15.8779 15.8779 15.9480 15.9480 16.4281 16.4281 17.1039 17.1039 17.3096 17.3096 18.7973 18.7973 19.8958 19.8958 k = 0.4878 0.5000-0.0000 ( 3072 PWs) bands (ev): 3.0180 3.0180 7.4808 7.4808 7.5609 7.5609 8.4665 8.4665 9.4566 9.4566 9.6267 9.6267 9.8555 9.8555 10.0296 10.0296 10.5091 10.5091 10.6711 10.6711 11.2372 11.2372 11.3833 11.3833 11.7528 11.7528 11.7938 11.7938 11.9078 11.9078 12.3539 12.3539 12.4367 12.4367 12.6336 12.6336 12.8448 12.8448 13.2743 13.2743 13.5557 13.5557 13.8203 13.8203 13.8800 13.8800 13.9599 13.9599 14.1453 14.1453 14.3960 14.3960 14.8372 14.8372 15.2808 15.2808 15.8935 15.8935 15.9602 15.9602 16.4101 16.4101 17.0973 17.0973 17.3032 17.3032 18.7905 18.7905 19.8873 19.8873 k = 0.5000 0.5000-0.0000 ( 3076 PWs) bands (ev): 3.0187 3.0187 7.4807 7.4807 7.5608 7.5608 8.4657 8.4657 9.4581 9.4581 9.6283 9.6283 9.8542 9.8542 10.0253 10.0253 10.5096 10.5096 10.6712 10.6712 11.2381 11.2381 11.3820 11.3820 11.7543 11.7543 11.7944 11.7944 11.9085 11.9085 12.3648 12.3648 12.4385 12.4385 12.6329 12.6329 12.8362 12.8362 13.2720 13.2720 13.5586 13.5586 13.8575 13.8575 13.8674 13.8674 13.9521 13.9521 14.1260 14.1260 14.3932 14.3932 14.8377 14.8377 15.2835 15.2835 15.8979 15.8979 15.9656 15.9656 16.4036 16.4036 17.0950 17.0950 17.3012 17.3012 18.7882 18.7882 19.8839 19.8839 k = 0.5000 0.5000-0.0000 ( 3076 PWs) bands (ev): 3.0187 3.0187 7.4807 7.4807 7.5608 7.5608 8.4657 8.4657 9.4581 9.4581 9.6283 9.6283 9.8542 9.8542 10.0253 10.0253 10.5096 10.5096 10.6712 10.6712 11.2381 11.2381 11.3820 11.3820 11.7543 11.7543 11.7944 11.7944 11.9085 11.9085 12.3648 12.3648 12.4385 12.4385 12.6329 12.6329 12.8362 12.8362 13.2720 13.2720 13.5586 13.5586 13.8575 13.8575 13.8674 13.8674 13.9521 13.9521 14.1260 14.1260 14.3932 14.3932 14.8377 14.8377 15.2835 15.2835 15.8979 15.8979 15.9656 15.9656 16.4036 16.4036 17.0950 17.0950 17.3012 17.3012 18.7882 18.7882 19.8839 19.8839 k = 0.4914 0.4914-0.0000 ( 3068 PWs) bands (ev): 3.0180 3.0180 7.4807 7.4807 7.5609 7.5609 8.4665 8.4665 9.4566 9.4566 9.6267 9.6267 9.8555 9.8555 10.0296 10.0296 10.5091 10.5091 10.6711 10.6711 11.2372 11.2372 11.3833 11.3833 11.7527 11.7527 11.7938 11.7938 11.9078 11.9078 12.3539 12.3539 12.4367 12.4367 12.6336 12.6336 12.8448 12.8448 13.2743 13.2743 13.5557 13.5557 13.8170 13.8170 13.8872 13.8872 13.9554 13.9554 14.1458 14.1458 14.3960 14.3960 14.8372 14.8372 15.2808 15.2808 15.8934 15.8934 15.9604 15.9604 16.4101 16.4101 17.0973 17.0973 17.3032 17.3032 18.7905 18.7905 19.8870 19.8870 k = 0.4828 0.4828-0.0000 ( 3074 PWs) bands (ev): 3.0157 3.0157 7.4805 7.4805 7.5615 7.5615 8.4687 8.4687 9.4512 9.4512 9.6233 9.6233 9.8594 9.8594 10.0418 10.0418 10.5076 10.5076 10.6710 10.6710 11.2345 11.2345 11.3870 11.3870 11.7476 11.7476 11.7924 11.7924 11.9056 11.9056 12.3241 12.3241 12.4314 12.4314 12.6353 12.6353 12.8681 12.8681 13.2812 13.2812 13.5476 13.5476 13.7569 13.7569 13.8993 13.8993 13.9614 13.9614 14.1930 14.1930 14.4058 14.4058 14.8355 14.8355 15.2728 15.2728 15.8760 15.8760 15.9503 15.9503 16.4280 16.4280 17.1040 17.1040 17.3095 17.3095 18.7971 18.7971 19.8921 19.8921 k = 0.4741 0.4741-0.0000 ( 3074 PWs) bands (ev): 3.0120 3.0120 7.4791 7.4791 7.5636 7.5636 8.4723 8.4723 9.4398 9.4398 9.6213 9.6213 9.8661 9.8661 10.0604 10.0604 10.5047 10.5047 10.6711 10.6711 11.2302 11.2302 11.3929 11.3929 11.7379 11.7379 11.7916 11.7916 11.9014 11.9014 12.2812 12.2812 12.4232 12.4232 12.6374 12.6374 12.9006 12.9006 13.2927 13.2927 13.5350 13.5350 13.6907 13.6907 13.9069 13.9069 13.9683 13.9683 14.2462 14.2462 14.4281 14.4281 14.8328 14.8328 15.2598 15.2598 15.8408 15.8408 15.9443 15.9443 16.4542 16.4542 17.1139 17.1139 17.3211 17.3211 18.8081 18.8081 19.8952 19.8952 k = 0.4655 0.4655-0.0000 ( 3074 PWs) bands (ev): 3.0067 3.0067 7.4754 7.4754 7.5685 7.5685 8.4774 8.4774 9.4201 9.4201 9.6245 9.6245 9.8759 9.8759 10.0833 10.0833 10.5004 10.5004 10.6717 10.6717 11.2244 11.2244 11.4003 11.4003 11.7233 11.7233 11.7921 11.7921 11.8947 11.8947 12.2307 12.2307 12.4124 12.4124 12.6398 12.6398 12.9367 12.9367 13.3088 13.3088 13.5190 13.5190 13.6242 13.6242 13.9111 13.9111 13.9775 13.9775 14.2875 14.2875 14.4709 14.4709 14.8293 14.8293 15.2423 15.2423 15.7908 15.7908 15.9435 15.9435 16.4854 16.4854 17.1253 17.1253 17.3395 17.3395 18.8229 18.8229 19.8973 19.8973 k = 0.4569 0.4569-0.0000 ( 3078 PWs) bands (ev): 3.0000 3.0000 7.4686 7.4686 7.5771 7.5771 8.4838 8.4838 9.3913 9.3913 9.6351 9.6351 9.8885 9.8885 10.1091 10.1091 10.4943 10.4943 10.6732 10.6732 11.2173 11.2173 11.4087 11.4087 11.7045 11.7045 11.7938 11.7938 11.8850 11.8850 12.1768 12.1768 12.3997 12.3997 12.6424 12.6424 12.9725 12.9725 13.3290 13.3290 13.5005 13.5005 13.5607 13.5607 13.9117 13.9117 13.9893 13.9893 14.3115 14.3115 14.5346 14.5346 14.8254 14.8254 15.2212 15.2212 15.7319 15.7319 15.9461 15.9461 16.5198 16.5198 17.1366 17.1366 17.3661 17.3661 18.8412 18.8412 19.8991 19.8991 k = 0.4483 0.4483-0.0000 ( 3082 PWs) bands (ev): 2.9917 2.9917 7.4586 7.4586 7.5898 7.5898 8.4915 8.4915 9.3545 9.3545 9.6532 9.6532 9.9036 9.9036 10.1362 10.1362 10.4862 10.4862 10.6759 10.6759 11.2089 11.2089 11.4173 11.4173 11.6822 11.6822 11.7963 11.7963 11.8716 11.8716 12.1226 12.1226 12.3855 12.3855 12.6457 12.6457 13.0056 13.0056 13.3518 13.3518 13.4776 13.4776 13.5051 13.5051 13.9092 13.9092 14.0029 14.0029 14.3244 14.3244 14.6090 14.6090 14.8219 14.8219 15.1977 15.1977 15.6683 15.6683 15.9509 15.9509 16.5559 16.5559 17.1462 17.1462 17.4019 17.4019 18.8625 18.8625 19.9010 19.9010 k = 0.4397 0.4397-0.0000 ( 3090 PWs) bands (ev): 2.9820 2.9820 7.4456 7.4456 7.6064 7.6064 8.5004 8.5004 9.3112 9.3112 9.6780 9.6780 9.9207 9.9207 10.1638 10.1638 10.4762 10.4762 10.6801 10.6801 11.1989 11.1989 11.4254 11.4254 11.6576 11.6576 11.7990 11.7990 11.8542 11.8542 12.0703 12.0703 12.3704 12.3704 12.6497 12.6497 13.0348 13.0348 13.3741 13.3741 13.4368 13.4368 13.4742 13.4742 13.9041 13.9041 14.0168 14.0168 14.3318 14.3318 14.6823 14.6823 14.8216 14.8216 15.1742 15.1742 15.6035 15.6035 15.9574 15.9574 16.5933 16.5933 17.1538 17.1538 17.4471 17.4471 18.8863 18.8863 19.9031 19.9031 k = 0.4310 0.4310-0.0000 ( 3096 PWs) bands (ev): 2.9707 2.9707 7.4304 7.4304 7.6265 7.6265 8.5103 8.5103 9.2627 9.2627 9.7088 9.7088 9.9393 9.9393 10.1908 10.1908 10.4647 10.4647 10.6858 10.6858 11.1874 11.1874 11.4320 11.4320 11.6317 11.6317 11.8011 11.8011 11.8326 11.8326 12.0222 12.0222 12.3547 12.3547 12.6548 12.6548 13.0599 13.0599 13.3859 13.3859 13.3933 13.3933 13.4625 13.4625 13.8972 13.8972 14.0302 14.0302 14.3369 14.3369 14.7379 14.7379 14.8326 14.8326 15.1549 15.1549 15.5410 15.5410 15.9655 15.9655 16.6317 16.6317 17.1595 17.1595 17.5008 17.5008 18.9124 18.9124 19.9053 19.9053 k = 0.4224 0.4224-0.0000 ( 3096 PWs) bands (ev): 2.9579 2.9579 7.4133 7.4133 7.6497 7.6497 8.5211 8.5211 9.2101 9.2101 9.7448 9.7448 9.9588 9.9588 10.2162 10.2162 10.4522 10.4522 10.6928 10.6928 11.1740 11.1740 11.4361 11.4361 11.6055 11.6055 11.8012 11.8012 11.8072 11.8072 11.9805 11.9805 12.3387 12.3387 12.6612 12.6612 13.0811 13.0811 13.3469 13.3469 13.3902 13.3902 13.4659 13.4659 13.8886 13.8886 14.0423 14.0423 14.3408 14.3408 14.7592 14.7592 14.8611 14.8611 15.1469 15.1469 15.4850 15.4850 15.9754 15.9754 16.6713 16.6713 17.1637 17.1637 17.5620 17.5620 18.9406 18.9406 19.9077 19.9077 k = 0.4138 0.4138-0.0000 ( 3092 PWs) bands (ev): 2.9437 2.9437 7.3950 7.3950 7.6758 7.6758 8.5327 8.5327 9.1541 9.1541 9.7855 9.7855 9.9787 9.9787 10.2388 10.2388 10.4401 10.4401 10.7008 10.7008 11.1587 11.1587 11.4363 11.4363 11.5799 11.5799 11.7790 11.7790 11.7975 11.7975 11.9475 11.9475 12.3225 12.3225 12.6692 12.6692 13.0985 13.0985 13.3121 13.3121 13.3775 13.3775 13.4782 13.4782 13.8786 13.8786 14.0527 14.0527 14.3441 14.3441 14.7596 14.7596 14.8819 14.8819 15.1565 15.1565 15.4427 15.4427 15.9872 15.9872 16.7122 16.7122 17.1669 17.1669 17.6290 17.6290 18.9709 18.9709 19.9102 19.9102 k = 0.4052 0.4052-0.0000 ( 3082 PWs) bands (ev): 2.9279 2.9279 7.3759 7.3759 7.7044 7.7044 8.5448 8.5448 9.0952 9.0952 9.8305 9.8305 9.9982 9.9982 10.2569 10.2569 10.4301 10.4301 10.7093 10.7093 11.1416 11.1416 11.4314 11.4314 11.5552 11.5552 11.7504 11.7504 11.7876 11.7876 11.9253 11.9253 12.3064 12.3064 12.6787 12.6787 13.1118 13.1118 13.2858 13.2858 13.3603 13.3603 13.4898 13.4898 13.8672 13.8672 14.0614 14.0614 14.3470 14.3470 14.7532 14.7532 14.8788 14.8788 15.1744 15.1744 15.4265 15.4265 16.0017 16.0017 16.7547 16.7547 17.1696 17.1696 17.7004 17.7004 19.0037 19.0037 19.9130 19.9130 k = 0.3966 0.3966-0.0000 ( 3086 PWs) bands (ev): 2.9106 2.9106 7.3563 7.3563 7.7353 7.7353 8.5572 8.5572 9.0339 9.0339 9.8791 9.8791 10.0168 10.0168 10.2686 10.2686 10.4247 10.4247 10.7176 10.7176 11.1230 11.1230 11.4206 11.4206 11.5315 11.5315 11.7235 11.7235 11.7714 11.7714 11.9139 11.9139 12.2905 12.2905 12.6899 12.6899 13.1203 13.1203 13.2690 13.2690 13.3421 13.3421 13.4958 13.4958 13.8545 13.8545 14.0684 14.0684 14.3494 14.3494 14.7439 14.7439 14.8585 14.8585 15.1784 15.1784 15.4491 15.4491 16.0195 16.0195 16.7993 16.7993 17.1721 17.1721 17.7741 17.7741 19.0399 19.0399 19.9159 19.9159 k = 0.3879 0.3879-0.0000 ( 3086 PWs) bands (ev): 2.8918 2.8918 7.3366 7.3366 7.7682 7.7682 8.5697 8.5697 8.9704 8.9704 9.9305 9.9305 10.0338 10.0338 10.2725 10.2725 10.4258 10.4258 10.7249 10.7249 11.1038 11.1038 11.4035 11.4035 11.5084 11.5084 11.6990 11.6990 11.7519 11.7519 11.9108 11.9108 12.2750 12.2750 12.7027 12.7027 13.1236 13.1236 13.2619 13.2619 13.3245 13.3245 13.4945 13.4945 13.8407 13.8407 14.0738 14.0738 14.3512 14.3512 14.7328 14.7328 14.8301 14.8301 15.1649 15.1649 15.5040 15.5040 16.0421 16.0421 16.8462 16.8462 17.1748 17.1748 17.8482 17.8482 19.0804 19.0804 19.9192 19.9192 k = 0.3793 0.3793-0.0000 ( 3090 PWs) bands (ev): 2.8716 2.8716 7.3171 7.3171 7.8029 7.8029 8.5820 8.5820 8.9053 8.9053 9.9824 9.9824 10.0502 10.0502 10.2696 10.2696 10.4330 10.4330 10.7300 10.7300 11.0850 11.0850 11.3801 11.3801 11.4862 11.4862 11.6755 11.6755 11.7341 11.7341 11.9128 11.9128 12.2599 12.2599 12.7168 12.7168 13.1229 13.1229 13.2622 13.2622 13.3093 13.3093 13.4855 13.4855 13.8259 13.8259 14.0778 14.0778 14.3521 14.3521 14.7198 14.7198 14.8000 14.8000 15.1449 15.1449 15.5729 15.5729 16.0716 16.0716 16.8958 16.8958 17.1780 17.1780 17.9203 17.9203 19.1268 19.1268 19.9227 19.9227 k = 0.3707 0.3707-0.0000 ( 3096 PWs) bands (ev): 2.8499 2.8499 7.2979 7.2979 7.8390 7.8390 8.5935 8.5935 8.8388 8.8388 10.0245 10.0245 10.0746 10.0746 10.2629 10.2629 10.4442 10.4442 10.7318 10.7318 11.0682 11.0682 11.3507 11.3507 11.4660 11.4660 11.6508 11.6508 11.7216 11.7216 11.9176 11.9176 12.2456 12.2456 12.7320 12.7320 13.1202 13.1202 13.2633 13.2633 13.3014 13.3014 13.4694 13.4694 13.8104 13.8104 14.0806 14.0806 14.3516 14.3516 14.7041 14.7041 14.7724 14.7724 15.1257 15.1257 15.6430 15.6430 16.1107 16.1107 16.9480 16.9480 17.1823 17.1823 17.9883 17.9883 19.1808 19.1808 19.9265 19.9265 k = 0.3621 0.3621-0.0000 ( 3096 PWs) bands (ev): 2.8269 2.8269 7.2794 7.2794 7.8762 7.8762 8.6033 8.6033 8.7718 8.7718 10.0400 10.0400 10.1222 10.1222 10.2557 10.2557 10.4568 10.4568 10.7293 10.7293 11.0545 11.0545 11.3166 11.3166 11.4483 11.4483 11.6250 11.6250 11.7144 11.7144 11.9240 11.9240 12.2323 12.2323 12.7478 12.7478 13.1172 13.1172 13.2571 13.2571 13.3067 13.3067 13.4478 13.4478 13.7948 13.7948 14.0824 14.0824 14.3495 14.3495 14.6849 14.6849 14.7503 14.7503 15.1100 15.1100 15.7063 15.7063 16.1621 16.1621 17.0022 17.0022 17.1889 17.1889 18.0501 18.0501 19.2439 19.2439 19.9307 19.9307 k = 0.3534 0.3534-0.0000 ( 3088 PWs) bands (ev): 2.8024 2.8024 7.2617 7.2617 7.9142 7.9142 8.6090 8.6090 8.7068 8.7068 10.0394 10.0394 10.1811 10.1811 10.2505 10.2505 10.4686 10.4686 10.7218 10.7218 11.0448 11.0448 11.2795 11.2795 11.4325 11.4325 11.6002 11.6002 11.7104 11.7104 11.9314 11.9314 12.2201 12.2201 12.7637 12.7637 13.1148 13.1148 13.2466 13.2466 13.3210 13.3210 13.4230 13.4230 13.7795 13.7795 14.0832 14.0832 14.3455 14.3455 14.6631 14.6631 14.7344 14.7344 15.0984 15.0984 15.7587 15.7587 16.2278 16.2278 17.0561 17.0561 17.2005 17.2005 18.1039 18.1039 19.3175 19.3175 19.9354 19.9354 k = 0.3448 0.3448-0.0000 ( 3092 PWs) bands (ev): 2.7767 2.7767 7.2449 7.2449 7.9526 7.9526 8.5962 8.5962 8.6583 8.6583 10.0309 10.0309 10.2362 10.2362 10.2546 10.2546 10.4782 10.4782 10.7097 10.7097 11.0386 11.0386 11.2410 11.2410 11.4181 11.4181 11.5785 11.5785 11.7075 11.7075 11.9396 11.9396 12.2092 12.2092 12.7791 12.7791 13.1128 13.1128 13.2368 13.2368 13.3380 13.3380 13.3985 13.3985 13.7652 13.7652 14.0833 14.0833 14.3394 14.3394 14.6410 14.6410 14.7232 14.7232 15.0903 15.0903 15.7992 15.7992 16.3070 16.3070 17.1034 17.1034 17.2237 17.2237 18.1489 18.1489 19.4023 19.4023 19.9405 19.9405 k = 0.3362 0.3362-0.0000 ( 3096 PWs) bands (ev): 2.7497 2.7497 7.2292 7.2292 7.9908 7.9908 8.5433 8.5433 8.6478 8.6478 10.0172 10.0172 10.2421 10.2421 10.3103 10.3103 10.4844 10.4844 10.6942 10.6942 11.0346 11.0346 11.2029 11.2029 11.4041 11.4041 11.5617 11.5617 11.7039 11.7039 11.9490 11.9490 12.1998 12.1998 12.7935 12.7935 13.1106 13.1106 13.2300 13.2300 13.3495 13.3495 13.3833 13.3833 13.7524 13.7524 14.0828 14.0828 14.3313 14.3313 14.6206 14.6206 14.7155 14.7155 15.0849 15.0849 15.8294 15.8294 16.3972 16.3972 17.1352 17.1352 17.2677 17.2677 18.1848 18.1848 19.4980 19.4980 19.9463 19.9463 k = 0.3276 0.3276-0.0000 ( 3096 PWs) bands (ev): 2.7215 2.7215 7.2147 7.2147 8.0278 8.0278 8.4767 8.4767 8.6494 8.6494 10.0005 10.0005 10.2410 10.2410 10.3721 10.3721 10.4866 10.4866 10.6769 10.6769 11.0304 11.0304 11.1667 11.1667 11.3901 11.3901 11.5514 11.5514 11.6985 11.6985 11.9601 11.9601 12.1923 12.1923 12.8060 12.8060 13.1076 13.1076 13.2272 13.2272 13.3415 13.3415 13.3928 13.3928 13.7419 13.7419 14.0820 14.0820 14.3216 14.3216 14.6029 14.6029 14.7104 14.7104 15.0811 15.0811 15.8517 15.8517 16.4954 16.4954 17.1529 17.1529 17.3314 17.3314 18.2123 18.2123 19.6037 19.6037 19.9529 19.9529 k = 0.3190 0.3190-0.0000 ( 3092 PWs) bands (ev): 2.6922 2.6922 7.2014 7.2014 8.0623 8.0623 8.4091 8.4091 8.6516 8.6516 9.9824 9.9824 10.2390 10.2390 10.4279 10.4279 10.4878 10.4878 10.6599 10.6599 11.0231 11.0231 11.1341 11.1341 11.3757 11.3757 11.5482 11.5482 11.6906 11.6906 11.9735 11.9735 12.1871 12.1871 12.8164 12.8164 13.1041 13.1041 13.2281 13.2281 13.3305 13.3305 13.4123 13.4123 13.7345 13.7345 14.0809 14.0809 14.3107 14.3107 14.5880 14.5880 14.7077 14.7077 15.0781 15.0781 15.8682 15.8682 16.5983 16.5983 17.1645 17.1645 17.4072 17.4072 18.2323 18.2323 19.7175 19.7175 19.9610 19.9610 k = 0.3103 0.3103-0.0000 ( 3092 PWs) bands (ev): 2.6618 2.6618 7.1892 7.1892 8.0909 8.0909 8.3455 8.3455 8.6524 8.6524 9.9642 9.9642 10.2355 10.2355 10.4521 10.4521 10.5100 10.5100 10.6458 10.6458 11.0106 11.0106 11.1061 11.1061 11.3609 11.3609 11.5515 11.5515 11.6804 11.6804 11.9900 11.9900 12.1849 12.1849 12.8245 12.8245 13.1014 13.1014 13.2305 13.2305 13.3272 13.3272 13.4326 13.4326 13.7312 13.7312 14.0797 14.0797 14.2995 14.2995 14.5755 14.5755 14.7072 14.7072 15.0752 15.0752 15.8804 15.8804 16.7031 16.7031 17.1750 17.1750 17.4906 17.4906 18.2464 18.2464 19.8347 19.8347 19.9735 19.9735 k = 0.3017 0.3017-0.0000 ( 3107 PWs) bands (ev): 2.6305 2.6305 7.1783 7.1783 8.1048 8.1048 8.2950 8.2950 8.6511 8.6511 9.9467 9.9467 10.2300 10.2300 10.4421 10.4421 10.5486 10.5486 10.6411 10.6411 10.9926 10.9926 11.0822 11.0822 11.3460 11.3460 11.5584 11.5584 11.6706 11.6706 12.0100 12.0100 12.1867 12.1867 12.8307 12.8307 13.1008 13.1008 13.2324 13.2324 13.3343 13.3343 13.4514 13.4514 13.7330 13.7330 14.0786 14.0786 14.2887 14.2887 14.5651 14.5651 14.7089 14.7089 15.0720 15.0720 15.8895 15.8895 16.8062 16.8062 17.1885 17.1885 17.5794 17.5794 18.2561 18.2561 19.9308 19.9308 20.0134 20.0134 k = 0.2931 0.2931-0.0000 ( 3115 PWs) bands (ev): 2.5983 2.5983 7.1686 7.1686 8.0885 8.0885 8.2732 8.2732 8.6476 8.6476 9.9305 9.9305 10.2223 10.2223 10.4223 10.4223 10.5638 10.5638 10.6605 10.6605 10.9713 10.9713 11.0598 11.0598 11.3309 11.3309 11.5610 11.5610 11.6689 11.6689 12.0339 12.0339 12.1938 12.1938 12.8358 12.8358 13.1035 13.1035 13.2330 13.2330 13.3511 13.3511 13.4677 13.4677 13.7411 13.7411 14.0776 14.0776 14.2790 14.2790 14.5563 14.5563 14.7128 14.7128 15.0679 15.0679 15.8961 15.8961 16.9020 16.9020 17.2102 17.2102 17.6723 17.6723 18.2630 18.2630 19.9625 19.9625 20.1218 20.1218 k = 0.2845 0.2845-0.0000 ( 3121 PWs) bands (ev): 2.5653 2.5653 7.1599 7.1599 8.0405 8.0405 8.2814 8.2814 8.6420 8.6420 9.9160 9.9160 10.2122 10.2122 10.3982 10.3982 10.5544 10.5544 10.6993 10.6993 10.9494 10.9494 11.0358 11.0358 11.3156 11.3156 11.5494 11.5494 11.6850 11.6850 12.0612 12.0612 12.2076 12.2076 12.8411 12.8411 13.1096 13.1096 13.2335 13.2335 13.3754 13.3754 13.4810 13.4810 13.7557 13.7557 14.0768 14.0768 14.2709 14.2709 14.5486 14.5486 14.7188 14.7188 15.0630 15.0630 15.9008 15.9008 16.9808 16.9808 17.2494 17.2494 17.7678 17.7678 18.2691 18.2691 19.9752 19.9752 20.2514 20.2514 k = 0.2759 0.2759-0.0000 ( 3111 PWs) bands (ev): 2.5317 2.5317 7.1523 7.1523 7.9768 7.9768 8.3033 8.3033 8.6346 8.6346 9.9033 9.9033 10.1997 10.1997 10.3715 10.3715 10.5353 10.5353 10.7402 10.7402 10.9290 10.9290 11.0084 11.0084 11.2993 11.2993 11.5250 11.5250 11.7186 11.7186 12.0914 12.0914 12.2296 12.2296 12.8478 12.8478 13.1186 13.1186 13.2348 13.2348 13.4047 13.4047 13.4917 13.4917 13.7770 13.7770 14.0764 14.0764 14.2651 14.2651 14.5420 14.5420 14.7267 14.7267 15.0570 15.0570 15.9040 15.9040 17.0332 17.0332 17.3152 17.3152 17.8639 17.8639 18.2767 18.2767 19.9850 19.9850 20.3835 20.3835 k = 0.2672 0.2672-0.0000 ( 3103 PWs) bands (ev): 2.4975 2.4975 7.1456 7.1456 7.9071 7.9071 8.3291 8.3291 8.6259 8.6259 9.8924 9.8924 10.1851 10.1851 10.3435 10.3435 10.5116 10.5116 10.7766 10.7766 10.9110 10.9110 10.9769 10.9769 11.2805 11.2805 11.4955 11.4955 11.7641 11.7641 12.1233 12.1233 12.2610 12.2610 12.8570 12.8570 13.1297 13.1297 13.2376 13.2376 13.4364 13.4364 13.5014 13.5014 13.8042 13.8042 14.0763 14.0763 14.2618 14.2618 14.5363 14.5363 14.7365 14.7365 15.0501 15.0501 15.9059 15.9059 17.0610 17.0610 17.4054 17.4054 17.9575 17.9575 18.2894 18.2894 19.9943 19.9943 20.5129 20.5129 k = 0.2586 0.2586-0.0000 ( 3103 PWs) bands (ev): 2.4628 2.4628 7.1397 7.1397 7.8351 7.8351 8.3545 8.3545 8.6165 8.6165 9.8829 9.8829 10.1684 10.1684 10.3148 10.3148 10.4850 10.4850 10.8052 10.8052 10.8964 10.8964 10.9417 10.9417 11.2564 11.2564 11.4677 11.4677 11.8180 11.8180 12.1560 12.1560 12.3021 12.3021 12.8694 12.8694 13.1418 13.1418 13.2426 13.2426 13.4664 13.4664 13.5143 13.5143 13.8363 13.8363 14.0767 14.0767 14.2613 14.2613 14.5315 14.5315 14.7480 14.7480 15.0423 15.0423 15.9067 15.9067 17.0735 17.0735 17.5101 17.5101 18.0424 18.0424 18.3136 18.3136 20.0035 20.0035 20.6350 20.6350 k = 0.2500 0.2500-0.0000 ( 3101 PWs) bands (ev): 2.4279 2.4279 7.1344 7.1344 7.7624 7.7624 8.3777 8.3777 8.6073 8.6073 9.8747 9.8747 10.1499 10.1499 10.2858 10.2858 10.4566 10.4566 10.8214 10.8214 10.8871 10.8871 10.9050 10.9050 11.2239 11.2239 11.4474 11.4474 11.8784 11.8784 12.1893 12.1893 12.3519 12.3519 12.8859 12.8859 13.1538 13.1538 13.2504 13.2504 13.4870 13.4870 13.5379 13.5379 13.8720 13.8720 14.0778 14.0778 14.2640 14.2640 14.5275 14.5275 14.7611 14.7611 15.0340 15.0340 15.9066 15.9066 17.0777 17.0777 17.6220 17.6220 18.1093 18.1093 18.3588 18.3588 20.0128 20.0128 20.7427 20.7427 k = 0.2414 0.2414-0.0000 ( 3103 PWs) bands (ev): 2.3927 2.3927 7.1295 7.1295 7.6897 7.6897 8.3970 8.3970 8.5996 8.5996 9.8674 9.8674 10.1299 10.1299 10.2570 10.2570 10.4271 10.4271 10.8167 10.8167 10.8674 10.8674 10.8906 10.8906 11.1821 11.1821 11.4375 11.4375 11.9439 11.9439 12.2231 12.2231 12.4087 12.4087 12.9072 12.9072 13.1644 13.1644 13.2617 13.2617 13.4981 13.4981 13.5725 13.5725 13.9101 13.9101 14.0800 14.0800 14.2698 14.2698 14.5247 14.5247 14.7756 14.7756 15.0254 15.0254 15.9058 15.9058 17.0769 17.0769 17.7371 17.7371 18.1532 18.1532 18.4302 18.4302 20.0220 20.0220 20.8224 20.8224 k = 0.2328 0.2328-0.0000 ( 3095 PWs) bands (ev): 2.3574 2.3574 7.1250 7.1250 7.6175 7.6175 8.4114 8.4114 8.5944 8.5944 9.8607 9.8607 10.1086 10.1086 10.2285 10.2285 10.3972 10.3972 10.7866 10.7866 10.8447 10.8447 10.8958 10.8958 11.1329 11.1329 11.4379 11.4379 12.0136 12.0136 12.2575 12.2575 12.4699 12.4699 12.9341 12.9341 13.1729 13.1729 13.2769 13.2769 13.5062 13.5062 13.6118 13.6118 13.9490 13.9490 14.0842 14.0842 14.2789 14.2789 14.5230 14.5230 14.7913 14.7913 15.0169 15.0169 15.9043 15.9043 17.0726 17.0726 17.8531 17.8531 18.1808 18.1808 18.5215 18.5215 20.0312 20.0312 20.8504 20.8504 k = 0.2241 0.2241-0.0000 ( 3097 PWs) bands (ev): 2.3222 2.3222 7.1206 7.1206 7.5461 7.5461 8.4199 8.4199 8.5930 8.5930 9.8541 9.8541 10.0864 10.0864 10.2004 10.2004 10.3674 10.3674 10.7418 10.7418 10.8287 10.8287 10.9001 10.9001 11.0799 11.0799 11.4470 11.4470 12.0865 12.0865 12.2922 12.2922 12.5329 12.5329 12.9674 12.9674 13.1794 13.1794 13.2957 13.2957 13.5145 13.5145 13.6526 13.6526 13.9858 13.9858 14.0927 14.0927 14.2913 14.2913 14.5227 14.5227 14.8080 14.8080 15.0090 15.0090 15.9024 15.9024 17.0656 17.0656 17.9672 17.9672 18.2025 18.2025 18.6233 18.6233 20.0397 20.0397 20.8173 20.8173 k = 0.2155 0.2155-0.0000 ( 3095 PWs) bands (ev): 2.2871 2.2871 7.1161 7.1161 7.4759 7.4759 8.4228 8.4228 8.5953 8.5953 9.8474 9.8474 10.0634 10.0634 10.1728 10.1728 10.3381 10.3381 10.6918 10.6918 10.8130 10.8130 10.8997 10.8997 11.0273 11.0273 11.4633 11.4633 12.1617 12.1617 12.3268 12.3268 12.5952 12.5952 13.0078 13.0078 13.1844 13.1844 13.3176 13.3176 13.5244 13.5244 13.6936 13.6936 14.0156 14.0156 14.1100 14.1100 14.3069 14.3069 14.5241 14.5241 14.8254 14.8254 15.0022 15.0022 15.9002 15.9002 17.0563 17.0563 18.0735 18.0735 18.2289 18.2289 18.7299 18.7299 20.0471 20.0471 20.7497 20.7497 k = 0.2069 0.2069-0.0000 ( 3097 PWs) bands (ev): 2.2523 2.2523 7.1112 7.1112 7.4071 7.4071 8.4210 8.4210 8.6007 8.6007 9.8402 9.8402 10.0399 10.0399 10.1459 10.1459 10.3098 10.3098 10.6394 10.6394 10.7946 10.7946 10.8917 10.8917 10.9810 10.9810 11.4855 11.4855 12.2381 12.2381 12.3610 12.3610 12.6547 12.6547 13.0550 13.0550 13.1887 13.1887 13.3421 13.3421 13.5372 13.5372 13.7338 13.7338 14.0341 14.0341 14.1398 14.1398 14.3257 14.3257 14.5273 14.5273 14.8432 14.8432 14.9972 14.9972 15.8978 15.8978 17.0448 17.0448 18.1541 18.1541 18.2800 18.2800 18.8376 18.8376 20.0522 20.0522 20.6723 20.6723 k = 0.1983 0.1983-0.0000 ( 3091 PWs) bands (ev): 2.2179 2.2179 7.1059 7.1059 7.3401 7.3401 8.4161 8.4161 8.6080 8.6080 9.8324 9.8324 10.0161 10.0161 10.1196 10.1196 10.2825 10.2825 10.5861 10.5861 10.7699 10.7699 10.8735 10.8735 10.9481 10.9481 11.5129 11.5129 12.3143 12.3143 12.3945 12.3945 12.7105 12.7105 13.1068 13.1068 13.1940 13.1940 13.3687 13.3687 13.5540 13.5540 13.7725 13.7725 14.0437 14.0437 14.1795 14.1795 14.3476 14.3476 14.5327 14.5327 14.8610 14.8610 14.9949 14.9949 15.8955 15.8955 17.0312 17.0312 18.1961 18.1961 18.3696 18.3696 18.9440 18.9440 20.0535 20.0535 20.5980 20.5980 k = 0.1897 0.1897-0.0000 ( 3099 PWs) bands (ev): 2.1840 2.1840 7.0997 7.0997 7.2751 7.2751 8.4098 8.4098 8.6159 8.6159 9.8237 9.8237 9.9921 9.9921 10.0941 10.0941 10.2566 10.2566 10.5326 10.5326 10.7356 10.7356 10.8499 10.8499 10.9285 10.9285 11.5448 11.5448 12.3863 12.3863 12.4294 12.4294 12.7623 12.7623 13.1548 13.1548 13.2066 13.2066 13.3976 13.3976 13.5766 13.5766 13.8090 13.8090 14.0487 14.0487 14.2242 14.2242 14.3723 14.3723 14.5403 14.5403 14.8783 14.8783 14.9961 14.9961 15.8935 15.8935 17.0153 17.0153 18.2208 18.2208 18.4765 18.4765 19.0465 19.0465 20.0488 20.0488 20.5347 20.5347 k = 0.1810 0.1810-0.0000 ( 3099 PWs) bands (ev): 2.1507 2.1507 7.0920 7.0920 7.2128 7.2128 8.4030 8.4030 8.6236 8.6236 9.8141 9.8141 9.9679 9.9679 10.0692 10.0692 10.2320 10.2320 10.4794 10.4794 10.6918 10.6918 10.8292 10.8292 10.9147 10.9147 11.5807 11.5807 12.4378 12.4378 12.4803 12.4803 12.8110 12.8110 13.1787 13.1787 13.2428 13.2428 13.4295 13.4295 13.6066 13.6066 13.8427 13.8427 14.0517 14.0517 14.2710 14.2710 14.3997 14.3997 14.5504 14.5504 14.8949 14.8949 15.0018 15.0018 15.8919 15.8919 16.9973 16.9973 18.2418 18.2418 18.5871 18.5871 19.1424 19.1424 20.0365 20.0365 20.4888 20.4888 k = 0.1724 0.1724-0.0000 ( 3101 PWs) bands (ev): 2.1182 2.1182 7.0808 7.0808 7.1555 7.1555 8.3968 8.3968 8.6305 8.6305 9.8035 9.8035 9.9437 9.9437 10.0451 10.0451 10.2090 10.2090 10.4272 10.4272 10.6425 10.6425 10.8130 10.8130 10.9024 10.9024 11.6201 11.6201 12.4671 12.4671 12.5475 12.5475 12.8574 12.8574 13.1861 13.1861 13.2906 13.2906 13.4657 13.4657 13.6455 13.6455 13.8732 13.8732 14.0538 14.0538 14.3182 14.3182 14.4293 14.4293 14.5634 14.5634 14.9106 14.9106 15.0123 15.0123 15.8913 15.8913 16.9770 16.9770 18.2627 18.2627 18.6970 18.6970 19.2278 19.2278 20.0178 20.0178 20.4639 20.4639 k = 0.1638 0.1638-0.0000 ( 3103 PWs) bands (ev): 2.0865 2.0865 7.0580 7.0580 7.1113 7.1113 8.3916 8.3916 8.6365 8.6365 9.7920 9.7920 9.9195 9.9195 10.0216 10.0216 10.1876 10.1876 10.3764 10.3764 10.5915 10.5915 10.7997 10.7997 10.8902 10.8902 11.6626 11.6626 12.4891 12.4891 12.6144 12.6144 12.9020 12.9020 13.1899 13.1899 13.3336 13.3336 13.5079 13.5079 13.6939 13.6939 13.9004 13.9004 14.0557 14.0557 14.3648 14.3648 14.4600 14.4600 14.5801 14.5801 14.9263 14.9263 15.0276 15.0276 15.8918 15.8918 16.9544 16.9544 18.2847 18.2847 18.8042 18.8042 19.2975 19.2975 19.9988 19.9988 20.4603 20.4603 k = 0.1552 0.1552-0.0000 ( 3103 PWs) bands (ev): 2.0558 2.0558 7.0150 7.0150 7.0889 7.0889 8.3877 8.3877 8.6413 8.6413 9.7795 9.7795 9.8953 9.8953 9.9986 9.9986 10.1679 10.1679 10.3273 10.3273 10.5410 10.5410 10.7882 10.7882 10.8777 10.8777 11.7078 11.7078 12.5071 12.5071 12.6767 12.6767 12.9453 12.9453 13.1923 13.1923 13.3685 13.3685 13.5565 13.5565 13.7503 13.7503 13.9244 13.9244 14.0577 14.0577 14.4102 14.4102 14.4895 14.4895 14.6019 14.6019 14.9428 14.9428 15.0467 15.0467 15.8941 15.8941 16.9294 16.9294 18.3082 18.3082 18.9064 18.9064 19.3463 19.3463 19.9889 19.9889 20.4755 20.4755 k = 0.1466 0.1466-0.0000 ( 3105 PWs) bands (ev): 2.0261 2.0261 6.9641 6.9641 7.0762 7.0762 8.3852 8.3852 8.6450 8.6450 9.7662 9.7662 9.8711 9.8711 9.9760 9.9760 10.1499 10.1499 10.2802 10.2802 10.4924 10.4924 10.7778 10.7778 10.8649 10.8649 11.7551 11.7551 12.5216 12.5216 12.7331 12.7331 12.9873 12.9873 13.1937 13.1937 13.3965 13.3965 13.6111 13.6111 13.8110 13.8110 13.9468 13.9468 14.0601 14.0601 14.4540 14.4540 14.5152 14.5152 14.6309 14.6309 14.9612 14.9612 15.0688 15.0688 15.8985 15.8985 16.9019 16.9019 18.3334 18.3334 18.9999 18.9999 19.3721 19.3721 19.9961 19.9961 20.5062 20.5062 k = 0.1379 0.1379-0.0000 ( 3105 PWs) bands (ev): 1.9976 1.9976 6.9130 6.9130 7.0657 7.0657 8.3843 8.3843 8.6478 8.6478 9.7521 9.7521 9.8470 9.8470 9.9538 9.9538 10.1337 10.1337 10.2355 10.2355 10.4465 10.4465 10.7682 10.7682 10.8520 10.8520 11.8042 11.8042 12.5333 12.5333 12.7824 12.7824 13.0282 13.0282 13.1941 13.1941 13.4197 13.4197 13.6710 13.6710 13.8690 13.8690 13.9720 13.9720 14.0629 14.0629 14.4963 14.4963 14.5355 14.5355 14.6677 14.6677 14.9816 14.9816 15.0929 15.0929 15.9057 15.9057 16.8719 16.8719 18.3601 18.3601 19.0773 19.0773 19.3828 19.3828 20.0225 20.0225 20.5498 20.5498 k = 0.1293 0.1293-0.0000 ( 3107 PWs) bands (ev): 1.9703 1.9703 6.8636 6.8636 7.0555 7.0555 8.3847 8.3847 8.6497 8.6497 9.7375 9.7375 9.8230 9.8230 9.9318 9.9318 10.1191 10.1191 10.1934 10.1934 10.4036 10.4036 10.7591 10.7591 10.8392 10.8392 11.8545 11.8545 12.5427 12.5427 12.8243 12.8243 13.0681 13.0681 13.1930 13.1930 13.4397 13.4397 13.7358 13.7358 13.9124 13.9124 14.0090 14.0090 14.0667 14.0667 14.5348 14.5348 14.5531 14.5531 14.7109 14.7109 15.0037 15.0037 15.1183 15.1183 15.9163 15.9163 16.8394 16.8394 18.3883 18.3883 19.1234 19.1234 19.3993 19.3993 20.0635 20.0635 20.6036 20.6036 k = 0.1207 0.1207-0.0000 ( 3107 PWs) bands (ev): 1.9444 1.9444 6.8166 6.8166 7.0455 7.0455 8.3864 8.3864 8.6511 8.6511 9.7225 9.7225 9.7992 9.7992 9.9099 9.9099 10.1063 10.1063 10.1542 10.1542 10.3641 10.3641 10.7506 10.7506 10.8266 10.8266 11.9055 11.9055 12.5504 12.5504 12.8586 12.8586 13.1070 13.1070 13.1906 13.1906 13.4573 13.4573 13.8047 13.8047 13.9360 13.9360 14.0538 14.0538 14.0793 14.0793 14.5546 14.5546 14.5849 14.5849 14.7582 14.7582 15.0266 15.0266 15.1445 15.1445 15.9308 15.9308 16.8042 16.8042 18.4176 18.4176 19.1254 19.1254 19.4417 19.4417 20.1129 20.1129 20.6642 20.6642 k = 0.1121 0.1121-0.0000 ( 3099 PWs) bands (ev): 1.9199 1.9199 6.7723 6.7723 7.0355 7.0355 8.3891 8.3891 8.6520 8.6520 9.7074 9.7074 9.7757 9.7757 9.8882 9.8882 10.0949 10.0949 10.1181 10.1181 10.3282 10.3282 10.7425 10.7425 10.8144 10.8144 11.9567 11.9567 12.5569 12.5569 12.8856 12.8856 13.1440 13.1440 13.1876 13.1876 13.4730 13.4730 13.8767 13.8767 13.9480 13.9480 14.0665 14.0665 14.1315 14.1315 14.5628 14.5628 14.6253 14.6253 14.8079 14.8079 15.0491 15.0491 15.1707 15.1707 15.9498 15.9498 16.7666 16.7666 18.4478 18.4478 19.0935 19.0935 19.5059 19.5059 20.1661 20.1661 20.7251 20.7251 k = 0.1034 0.1034-0.0000 ( 3099 PWs) bands (ev): 1.8969 1.8969 6.7307 6.7307 7.0255 7.0255 8.3925 8.3925 8.6529 8.6529 9.6922 9.6922 9.7527 9.7527 9.8667 9.8667 10.0814 10.0814 10.0887 10.0887 10.2958 10.2958 10.7347 10.7347 10.8027 10.8027 12.0074 12.0074 12.5629 12.5629 12.9059 12.9059 13.1686 13.1686 13.1945 13.1945 13.4867 13.4867 13.9497 13.9497 13.9551 13.9551 14.0706 14.0706 14.1930 14.1930 14.5680 14.5680 14.6669 14.6669 14.8586 14.8586 15.0699 15.0699 15.1965 15.1965 15.9734 15.9734 16.7265 16.7265 18.4786 18.4786 19.0448 19.0448 19.5786 19.5786 20.2204 20.2204 20.7730 20.7730 k = 0.0948 0.0948-0.0000 ( 3093 PWs) bands (ev): 1.8754 1.8754 6.6921 6.6921 7.0157 7.0157 8.3965 8.3965 8.6537 8.6537 9.6772 9.6772 9.7303 9.7303 9.8457 9.8457 10.0532 10.0532 10.0784 10.0784 10.2669 10.2669 10.7274 10.7274 10.7918 10.7918 12.0570 12.0570 12.5689 12.5689 12.9205 12.9205 13.1661 13.1661 13.2257 13.2257 13.4986 13.4986 13.9586 13.9586 14.0223 14.0223 14.0752 14.0752 14.2530 14.2530 14.5718 14.5718 14.7092 14.7092 14.9093 14.9093 15.0882 15.0882 15.2211 15.2211 16.0014 16.0014 16.6842 16.6842 18.5095 18.5095 18.9895 18.9895 19.6524 19.6524 20.2743 20.2743 20.7912 20.7912 k = 0.0862 0.0862-0.0000 ( 3095 PWs) bands (ev): 1.8556 1.8556 6.6565 6.6565 7.0063 7.0063 8.4007 8.4007 8.6548 8.6548 9.6626 9.6626 9.7087 9.7087 9.8252 9.8252 10.0261 10.0261 10.0715 10.0715 10.2413 10.2413 10.7204 10.7204 10.7817 10.7817 12.1048 12.1048 12.5758 12.5758 12.9300 12.9300 13.1572 13.1572 13.2603 13.2603 13.5086 13.5086 13.9611 13.9611 14.0676 14.0676 14.1050 14.1050 14.3096 14.3096 14.5747 14.5747 14.7521 14.7521 14.9596 14.9596 15.1031 15.1031 15.2441 15.2441 16.0334 16.0334 16.6398 16.6398 18.5402 18.5402 18.9325 18.9325 19.7240 19.7240 20.3270 20.3270 20.7811 20.7811 k = 0.0776 0.0776-0.0000 ( 3089 PWs) bands (ev): 1.8375 1.8375 6.6241 6.6241 6.9973 6.9973 8.4050 8.4050 8.6562 8.6562 9.6487 9.6487 9.6882 9.6882 9.8056 9.8056 10.0018 10.0018 10.0658 10.0658 10.2190 10.2190 10.7139 10.7139 10.7724 10.7724 12.1499 12.1499 12.5841 12.5841 12.9352 12.9352 13.1464 13.1464 13.2937 13.2937 13.5167 13.5167 13.9627 13.9627 14.0733 14.0733 14.1714 14.1714 14.3616 14.3616 14.5771 14.5771 14.7955 14.7955 15.0087 15.0087 15.1145 15.1145 15.2654 15.2654 16.0683 16.0683 16.5938 16.5938 18.5703 18.5703 18.8768 18.8768 19.7917 19.7917 20.3777 20.3777 20.7578 20.7578 k = 0.0690 0.0690-0.0000 ( 3089 PWs) bands (ev): 1.8211 1.8211 6.5948 6.5948 6.9888 6.9888 8.4090 8.4090 8.6579 8.6579 9.6355 9.6355 9.6689 9.6689 9.7872 9.7872 9.9804 9.9804 10.0612 10.0612 10.1996 10.1996 10.7078 10.7078 10.7642 10.7642 12.1913 12.1913 12.5947 12.5947 12.9364 12.9364 13.1346 13.1346 13.3250 13.3250 13.5229 13.5229 13.9638 13.9638 14.0757 14.0757 14.2368 14.2368 14.4085 14.4085 14.5793 14.5793 14.8392 14.8392 15.0556 15.0556 15.1229 15.1229 15.2846 15.2846 16.1048 16.1048 16.5466 16.5466 18.5991 18.5991 18.8242 18.8242 19.8547 19.8547 20.4255 20.4255 20.7310 20.7310 k = 0.0603 0.0603-0.0000 ( 3093 PWs) bands (ev): 1.8066 1.8066 6.5689 6.5689 6.9810 6.9810 8.4126 8.4126 8.6601 8.6601 9.6234 9.6234 9.6512 9.6512 9.7701 9.7701 9.9618 9.9618 10.0576 10.0576 10.1831 10.1831 10.7022 10.7022 10.7569 10.7569 12.2283 12.2283 12.6082 12.6082 12.9339 12.9339 13.1222 13.1222 13.3541 13.3541 13.5272 13.5272 13.9646 13.9646 14.0775 14.0775 14.2974 14.2974 14.4500 14.4500 14.5816 14.5816 14.8823 14.8823 15.0957 15.0957 15.1327 15.1327 15.3018 15.3018 16.1414 16.1414 16.4991 16.4991 18.6262 18.6262 18.7758 18.7758 19.9127 19.9127 20.4694 20.4694 20.7049 20.7049 k = 0.0517 0.0517-0.0000 ( 3103 PWs) bands (ev): 1.7939 1.7939 6.5463 6.5463 6.9740 6.9740 8.4157 8.4157 8.6624 8.6624 9.6125 9.6125 9.6353 9.6353 9.7547 9.7547 9.9459 9.9459 10.0546 10.0546 10.1691 10.1691 10.6972 10.6972 10.7507 10.7507 12.2600 12.2600 12.6251 12.6251 12.9278 12.9278 13.1100 13.1100 13.3805 13.3805 13.5298 13.5298 13.9651 13.9651 14.0792 14.0792 14.3518 14.3518 14.4855 14.4855 14.5843 14.5843 14.9239 14.9239 15.1125 15.1125 15.1604 15.1604 15.3170 15.3170 16.1767 16.1767 16.4521 16.4521 18.6511 18.6511 18.7324 18.7324 19.9653 19.9653 20.5078 20.5078 20.6816 20.6816 k = 0.0431 0.0431-0.0000 ( 3099 PWs) bands (ev): 1.7831 1.7831 6.5271 6.5271 6.9680 6.9680 8.4183 8.4183 8.6650 8.6650 9.6030 9.6030 9.6214 9.6214 9.7413 9.7413 9.9326 9.9326 10.0524 10.0524 10.1576 10.1576 10.6928 10.6928 10.7455 10.7455 12.2860 12.2860 12.6454 12.6454 12.9180 12.9180 13.0987 13.0987 13.4041 13.4041 13.5306 13.5306 13.9655 13.9655 14.0806 14.0806 14.3993 14.3993 14.5145 14.5145 14.5879 14.5879 14.9626 14.9626 15.1127 15.1127 15.1992 15.1992 15.3303 15.3303 16.2091 16.2091 16.4069 16.4069 18.6733 18.6733 18.6949 18.6949 20.0120 20.0120 20.5393 20.5393 20.6623 20.6623 k = 0.0345 0.0345-0.0000 ( 3099 PWs) bands (ev): 1.7742 1.7742 6.5113 6.5113 6.9629 6.9629 8.4203 8.4203 8.6674 8.6674 9.5949 9.5949 9.6097 9.6097 9.7300 9.7300 9.9219 9.9219 10.0507 10.0507 10.1484 10.1484 10.6891 10.6891 10.7413 10.7413 12.3063 12.3063 12.6687 12.6687 12.9048 12.9048 13.0888 13.0888 13.4248 13.4248 13.5299 13.5299 13.9658 13.9658 14.0820 14.0820 14.4393 14.4393 14.5357 14.5357 14.5935 14.5935 14.9971 14.9971 15.1085 15.1085 15.2362 15.2362 15.3420 15.3420 16.2373 16.2373 16.3653 16.3653 18.6634 18.6634 18.6924 18.6924 20.0522 20.0522 20.5624 20.5624 20.6482 20.6482 k = 0.0259 0.0259-0.0000 ( 3099 PWs) bands (ev): 1.7672 1.7672 6.4990 6.4990 6.9588 6.9588 8.4219 8.4219 8.6696 8.6696 9.5885 9.5885 9.6004 9.6004 9.7210 9.7210 9.9136 9.9136 10.0494 10.0494 10.1413 10.1413 10.6861 10.6861 10.7381 10.7381 12.3212 12.3212 12.6937 12.6937 12.8886 12.8886 13.0808 13.0808 13.4424 13.4424 13.5278 13.5278 13.9660 13.9660 14.0831 14.0831 14.4714 14.4714 14.5481 14.5481 14.6018 14.6018 15.0261 15.0261 15.1025 15.1025 15.2677 15.2677 15.3523 15.3523 16.2602 16.2602 16.3293 16.3293 18.6387 18.6387 18.7077 18.7077 20.0852 20.0852 20.5761 20.5761 20.6402 20.6402 k = 0.0172 0.0172-0.0000 ( 3099 PWs) bands (ev): 1.7622 1.7622 6.4902 6.4902 6.9559 6.9559 8.4229 8.4229 8.6713 8.6713 9.5839 9.5839 9.5937 9.5937 9.7145 9.7145 9.9077 9.9077 10.0486 10.0486 10.1363 10.1363 10.6839 10.6839 10.7358 10.7358 12.3312 12.3312 12.7182 12.7182 12.8709 12.8709 13.0751 13.0751 13.4564 13.4564 13.5248 13.5248 13.9662 13.9662 14.0839 14.0839 14.4955 14.4955 14.5532 14.5532 14.6111 14.6111 15.0491 15.0491 15.0958 15.0958 15.2910 15.2910 15.3615 15.3615 16.2763 16.2763 16.3019 16.3019 18.6209 18.6209 18.7189 18.7189 20.1098 20.1098 20.5814 20.5814 20.6379 20.6379 k = 0.0086 0.0086-0.0000 ( 3099 PWs) bands (ev): 1.7592 1.7592 6.4850 6.4850 6.9542 6.9542 8.4236 8.4236 8.6724 8.6724 9.5811 9.5811 9.5896 9.5896 9.7106 9.7106 9.9042 9.9042 10.0481 10.0481 10.1334 10.1334 10.6826 10.6826 10.7344 10.7344 12.3370 12.3370 12.7383 12.7383 12.8552 12.8552 13.0716 13.0716 13.4658 13.4658 13.5220 13.5220 13.9663 13.9663 14.0845 14.0845 14.5112 14.5112 14.5537 14.5537 14.6182 14.6182 15.0659 15.0659 15.0885 15.0885 15.3047 15.3047 15.3684 15.3684 16.2784 16.2784 16.2921 16.2921 18.6101 18.6101 18.7257 18.7257 20.1252 20.1252 20.5823 20.5823 20.6381 20.6381 k = 0.0000 0.0000 0.0000 ( 3099 PWs) bands (ev): 1.7582 1.7582 6.4832 6.4832 6.9536 6.9536 8.4238 8.4238 8.6728 8.6728 9.5801 9.5801 9.5882 9.5882 9.7092 9.7092 9.9030 9.9030 10.0480 10.0480 10.1324 10.1324 10.6822 10.6822 10.7339 10.7339 12.3389 12.3389 12.7467 12.7467 12.8482 12.8482 13.0705 13.0705 13.4692 13.4692 13.5207 13.5207 13.9663 13.9663 14.0847 14.0847 14.5169 14.5169 14.5533 14.5533 14.6207 14.6207 15.0750 15.0750 15.0825 15.0825 15.3092 15.3092 15.3711 15.3711 16.2738 16.2738 16.2940 16.2940 18.6065 18.6065 18.7280 18.7280 20.1304 20.1304 20.5822 20.5822 20.6384 20.6384 k = 0.0000 0.0000 0.0000 ( 3099 PWs) bands (ev): 1.7582 1.7582 6.4832 6.4832 6.9536 6.9536 8.4238 8.4238 8.6728 8.6728 9.5801 9.5801 9.5882 9.5882 9.7092 9.7092 9.9030 9.9030 10.0480 10.0480 10.1324 10.1324 10.6822 10.6822 10.7339 10.7339 12.3389 12.3389 12.7467 12.7467 12.8482 12.8482 13.0705 13.0705 13.4692 13.4692 13.5207 13.5207 13.9663 13.9663 14.0847 14.0847 14.5169 14.5169 14.5533 14.5533 14.6207 14.6207 15.0750 15.0750 15.0825 15.0825 15.3092 15.3092 15.3711 15.3711 16.2738 16.2738 16.2940 16.2940 18.6065 18.6065 18.7280 18.7280 20.1304 20.1304 20.5822 20.5822 20.6384 20.6384 k = 0.0000 0.0000 0.0119 ( 3095 PWs) bands (ev): 1.7587 1.7587 6.4756 6.4756 6.9602 6.9602 8.4233 8.4233 8.6722 8.6722 9.5818 9.5818 9.5886 9.5886 9.7033 9.7033 9.9086 9.9086 10.0498 10.0498 10.1319 10.1319 10.6842 10.6842 10.7365 10.7365 12.3392 12.3392 12.7460 12.7460 12.8470 12.8470 13.0679 13.0679 13.4621 13.4621 13.5219 13.5219 13.9657 13.9657 14.0812 14.0812 14.4867 14.4867 14.5795 14.5795 14.6067 14.6067 15.0668 15.0668 15.0902 15.0902 15.3260 15.3260 15.3886 15.3886 16.2731 16.2731 16.2953 16.2953 18.5826 18.5826 18.7473 18.7473 20.1215 20.1215 20.5751 20.5751 20.6377 20.6377 k = 0.0000 0.0000 0.0238 ( 3099 PWs) bands (ev): 1.7599 1.7599 6.4540 6.4540 6.9790 6.9790 8.4220 8.4220 8.6706 8.6706 9.5867 9.5867 9.5897 9.5897 9.6872 9.6872 9.9236 9.9236 10.0553 10.0553 10.1304 10.1304 10.6902 10.6902 10.7442 10.7442 12.3400 12.3400 12.7437 12.7437 12.8432 12.8432 13.0604 13.0604 13.4413 13.4413 13.5247 13.5247 13.9638 13.9638 14.0704 14.0704 14.4401 14.4401 14.5685 14.5685 14.6151 14.6151 15.0522 15.0522 15.1064 15.1064 15.3717 15.3717 15.4374 15.4374 16.2714 16.2714 16.2992 16.2992 18.5314 18.5314 18.7849 18.7849 20.0953 20.0953 20.5544 20.5544 20.6357 20.6357 k = 0.0000 0.0000 0.0357 ( 3099 PWs) bands (ev): 1.7620 1.7620 6.4213 6.4213 7.0070 7.0070 8.4198 8.4198 8.6679 8.6679 9.5916 9.5916 9.5943 9.5943 9.6646 9.6646 9.9448 9.9448 10.0644 10.0644 10.1281 10.1281 10.7001 10.7001 10.7569 10.7569 12.3414 12.3414 12.7390 12.7390 12.8370 12.8370 13.0490 13.0490 13.4091 13.4091 13.5273 13.5273 13.9612 13.9612 14.0512 14.0512 14.3911 14.3911 14.5148 14.5148 14.6494 14.6494 15.0363 15.0363 15.1310 15.1310 15.4378 15.4378 15.5089 15.5089 16.2693 16.2693 16.3054 16.3054 18.4694 18.4694 18.8248 18.8248 20.0537 20.0537 20.5207 20.5207 20.6333 20.6333 k = 0.0000 0.0000 0.0476 ( 3091 PWs) bands (ev): 1.7649 1.7649 6.3809 6.3809 7.0412 7.0412 8.4169 8.4169 8.6643 8.6643 9.5941 9.5941 9.6025 9.6025 9.6400 9.6400 9.9696 9.9696 10.0770 10.0770 10.1250 10.1250 10.7138 10.7138 10.7746 10.7746 12.3435 12.3435 12.7307 12.7307 12.8289 12.8289 13.0348 13.0348 13.3687 13.3687 13.5270 13.5270 13.9582 13.9582 14.0219 14.0219 14.3441 14.3441 14.4541 14.4541 14.6814 14.6814 15.0210 15.0210 15.1643 15.1643 15.5181 15.5181 15.5950 15.5950 16.2670 16.2670 16.3139 16.3139 18.4012 18.4012 18.8632 18.8632 19.9990 19.9990 20.4752 20.4752 20.6310 20.6310 k = 0.0000 0.0000 0.0595 ( 3099 PWs) bands (ev): 1.7685 1.7685 6.3353 6.3353 7.0791 7.0791 8.4131 8.4131 8.6598 8.6598 9.5953 9.5953 9.5974 9.5974 9.6305 9.6305 9.9964 9.9964 10.0922 10.0922 10.1219 10.1219 10.7313 10.7313 10.7971 10.7971 12.3466 12.3466 12.7169 12.7169 12.8196 12.8196 13.0191 13.0191 13.3235 13.3235 13.5206 13.5206 13.9555 13.9555 13.9815 13.9815 14.3027 14.3027 14.3927 14.3927 14.7102 14.7102 15.0071 15.0071 15.2057 15.2057 15.6082 15.6082 15.6894 15.6894 16.2647 16.2647 16.3255 16.3255 18.3287 18.3287 18.8993 18.8993 19.9335 19.9335 20.4191 20.4191 20.6291 20.6291 k = 0.0000 0.0000 0.0714 ( 3111 PWs) bands (ev): 1.7728 1.7728 6.2865 6.2865 7.1191 7.1191 8.4088 8.4088 8.6545 8.6545 9.5668 9.5668 9.6014 9.6014 9.6427 9.6427 10.0242 10.0242 10.1048 10.1048 10.1243 10.1243 10.7522 10.7522 10.8244 10.8244 12.3508 12.3508 12.6951 12.6951 12.8101 12.8101 13.0028 13.0028 13.2768 13.2768 13.5053 13.5053 13.9307 13.9307 13.9535 13.9535 14.2686 14.2686 14.3353 14.3353 14.7354 14.7354 14.9945 14.9945 15.2545 15.2545 15.7055 15.7055 15.7871 15.7871 16.2625 16.2625 16.3418 16.3418 18.2532 18.2532 18.9332 18.9332 19.8592 19.8592 20.3536 20.3536 20.6278 20.6278 k = 0.0000 0.0000 0.0833 ( 3102 PWs) bands (ev): 1.7777 1.7777 6.2358 6.2358 7.1599 7.1599 8.4039 8.4039 8.6485 8.6485 9.5336 9.5336 9.6060 9.6060 9.6601 9.6601 10.0525 10.0525 10.1041 10.1041 10.1428 10.1428 10.7764 10.7764 10.8562 10.8562 12.3563 12.3563 12.6634 12.6634 12.8009 12.8009 12.9867 12.9867 13.2317 13.2317 13.4792 13.4792 13.8721 13.8721 13.9521 13.9521 14.2410 14.2410 14.2848 14.2848 14.7566 14.7566 14.9828 14.9828 15.3093 15.3093 15.8082 15.8082 15.8832 15.8832 16.2604 16.2604 16.3654 16.3654 18.1759 18.1759 18.9652 18.9652 19.7778 19.7778 20.2798 20.2798 20.6270 20.6270 k = 0.0000 0.0000 0.0952 ( 3106 PWs) bands (ev): 1.7832 1.7832 6.1844 6.1844 7.2008 7.2008 8.3985 8.3985 8.6421 8.6421 9.4989 9.4989 9.6112 9.6112 9.6794 9.6794 10.0809 10.0809 10.0982 10.0982 10.1691 10.1691 10.8037 10.8037 10.8924 10.8924 12.3634 12.3634 12.6211 12.6211 12.7918 12.7918 12.9711 12.9711 13.1903 13.1903 13.4421 13.4421 13.8092 13.8092 13.9504 13.9504 14.2185 14.2185 14.2429 14.2429 14.7741 14.7741 14.9720 14.9720 15.3688 15.3688 15.9151 15.9151 15.9722 15.9722 16.2583 16.2583 16.4004 16.4004 18.0978 18.0978 18.9956 18.9956 19.6904 19.6904 20.1987 20.1987 20.6267 20.6267 k = 0.0000 0.0000 0.1071 ( 3102 PWs) bands (ev): 1.7892 1.7892 6.1330 6.1330 7.2414 7.2414 8.3927 8.3927 8.6353 8.6353 9.4634 9.4634 9.6170 9.6170 9.6999 9.6999 10.0909 10.0909 10.1090 10.1090 10.1998 10.1998 10.8337 10.8337 10.9328 10.9328 12.3723 12.3723 12.5689 12.5689 12.7815 12.7815 12.9559 12.9559 13.1539 13.1539 13.3952 13.3952 13.7452 13.7452 13.9473 13.9473 14.1992 14.1992 14.2104 14.2104 14.7882 14.7882 14.9618 14.9618 15.4312 15.4312 16.0252 16.0252 16.0478 16.0478 16.2563 16.2563 16.4520 16.4520 18.0202 18.0202 19.0248 19.0248 19.5980 19.5980 20.1109 20.1109 20.6268 20.6268 k = 0.0000 0.0000 0.1190 ( 3102 PWs) bands (ev): 1.7955 1.7955 6.0823 6.0823 7.2811 7.2811 8.3867 8.3867 8.6282 8.6282 9.4275 9.4275 9.6233 9.6233 9.7209 9.7209 10.0828 10.0828 10.1364 10.1364 10.2341 10.2341 10.8661 10.8661 10.9772 10.9772 12.3830 12.3830 12.5082 12.5082 12.7687 12.7687 12.9406 12.9406 13.1229 13.1229 13.3411 13.3411 13.6830 13.6830 13.9414 13.9414 14.1821 14.1821 14.1864 14.1864 14.7996 14.7996 14.9523 14.9523 15.4950 15.4950 16.1056 16.1056 16.1379 16.1379 16.2544 16.2544 16.5238 16.5238 17.9441 17.9441 19.0531 19.0531 19.5013 19.5013 20.0173 20.0173 20.6271 20.6271 k = 0.0000 0.0000 0.1310 ( 3114 PWs) bands (ev): 1.8021 1.8021 6.0329 6.0329 7.3198 7.3198 8.3806 8.3806 8.6211 8.6211 9.3914 9.3914 9.6300 9.6300 9.7421 9.7421 10.0741 10.0741 10.1630 10.1630 10.2718 10.2718 10.9003 10.9003 11.0253 11.0253 12.3955 12.3955 12.4410 12.4410 12.7517 12.7517 12.9242 12.9242 13.0972 13.0972 13.2835 13.2835 13.6246 13.6246 13.9325 13.9325 14.1663 14.1663 14.1692 14.1692 14.8088 14.8088 14.9433 14.9433 15.5587 15.5587 16.1461 16.1461 16.2526 16.2526 16.2528 16.2528 16.6146 16.6146 17.8708 17.8708 19.0806 19.0806 19.4009 19.4009 19.9185 19.9185 20.6276 20.6276 k = 0.0000 0.0000 0.1429 ( 3114 PWs) bands (ev): 1.8089 1.8089 5.9853 5.9853 7.3571 7.3571 8.3744 8.3744 8.6141 8.6141 9.3556 9.3556 9.6372 9.6372 9.7629 9.7629 10.0649 10.0649 10.1883 10.1883 10.3128 10.3128 10.9359 10.9359 11.0770 11.0770 12.3694 12.3694 12.4094 12.4094 12.7292 12.7292 12.9046 12.9046 13.0765 13.0765 13.2267 13.2267 13.5718 13.5718 13.9210 13.9210 14.1514 14.1514 14.1562 14.1562 14.8162 14.8162 14.9348 14.9348 15.6212 15.6212 16.1737 16.1737 16.2510 16.2510 16.3694 16.3694 16.7198 16.7198 17.8013 17.8013 19.1075 19.1075 19.2972 19.2972 19.8151 19.8151 20.6284 20.6284 k = 0.0000 0.0000 0.1548 ( 3106 PWs) bands (ev): 1.8158 1.8158 5.9400 5.9400 7.3930 7.3930 8.3683 8.3683 8.6072 8.6072 9.3204 9.3204 9.6446 9.6446 9.7830 9.7830 10.0554 10.0554 10.2121 10.2121 10.3570 10.3570 10.9720 10.9720 11.1320 11.1320 12.2957 12.2957 12.4240 12.4240 12.7001 12.7001 12.8795 12.8795 13.0605 13.0605 13.1758 13.1758 13.5254 13.5254 13.9077 13.9077 14.1371 14.1371 14.1447 14.1447 14.8222 14.8222 14.9269 14.9269 15.6816 15.6816 16.1926 16.1926 16.2495 16.2495 16.4876 16.4876 16.8344 16.8344 17.7367 17.7367 19.1337 19.1337 19.1906 19.1906 19.7078 19.7078 20.6292 20.6292 k = 0.0000 0.0000 0.1667 ( 3110 PWs) bands (ev): 1.8225 1.8225 5.8972 5.8972 7.4270 7.4270 8.3624 8.3624 8.6007 8.6007 9.2861 9.2861 9.6522 9.6522 9.8022 9.8022 10.0457 10.0457 10.2341 10.2341 10.4042 10.4042 11.0078 11.0078 11.1900 11.1900 12.2217 12.2217 12.4375 12.4375 12.6641 12.6641 12.8468 12.8468 13.0488 13.0488 13.1355 13.1355 13.4860 13.4860 13.8938 13.8938 14.1234 14.1234 14.1325 14.1325 14.8271 14.8271 14.9195 14.9195 15.7388 15.7388 16.2059 16.2059 16.2482 16.2482 16.6069 16.6069 16.9546 16.9546 17.6782 17.6782 19.0815 19.0815 19.1587 19.1587 19.5974 19.5974 20.6301 20.6301 k = 0.0000 0.0000 0.1786 ( 3110 PWs) bands (ev): 1.8291 1.8291 5.8574 5.8574 7.4591 7.4591 8.3567 8.3567 8.5945 8.5945 9.2530 9.2530 9.6599 9.6599 9.8203 9.8203 10.0360 10.0360 10.2542 10.2542 10.4541 10.4541 11.0420 11.0420 11.2508 11.2508 12.1496 12.1496 12.4471 12.4471 12.6215 12.6215 12.8077 12.8077 13.0408 13.0408 13.1082 13.1082 13.4534 13.4534 13.8801 13.8801 14.1102 14.1102 14.1179 14.1179 14.8311 14.8311 14.9126 14.9126 15.7923 15.7923 16.2155 16.2155 16.2472 16.2472 16.7272 16.7272 17.0773 17.0773 17.6270 17.6270 18.9703 18.9703 19.1815 19.1815 19.4855 19.4855 20.6310 20.6310 k = 0.0000 0.0000 0.1905 ( 3118 PWs) bands (ev): 1.8354 1.8354 5.8209 5.8209 7.4890 7.4890 8.3514 8.3514 8.5889 8.5889 9.2217 9.2217 9.6676 9.6676 9.8370 9.8370 10.0264 10.0264 10.2721 10.2721 10.5067 10.5067 11.0730 11.0730 11.3141 11.3141 12.0815 12.0815 12.4480 12.4480 12.5736 12.5736 12.7681 12.7681 13.0358 13.0358 13.0927 13.0927 13.4272 13.4272 13.8674 13.8674 14.0977 14.0977 14.1001 14.1001 14.8343 14.8343 14.9064 14.9064 15.8414 15.8414 16.2223 16.2223 16.2467 16.2467 16.8482 16.8482 17.1991 17.1991 17.5859 17.5859 18.8572 18.8572 19.1969 19.1969 19.3773 19.3773 20.6319 20.6319 k = 0.0000 0.0000 0.2024 ( 3122 PWs) bands (ev): 1.8413 1.8413 5.7879 5.7879 7.5164 7.5164 8.3466 8.3466 8.5839 8.5839 9.1925 9.1925 9.6751 9.6751 9.8521 9.8521 10.0172 10.0172 10.2877 10.2877 10.5615 10.5615 11.0988 11.0988 11.3794 11.3794 12.0198 12.0198 12.4338 12.4338 12.5219 12.5219 12.7370 12.7370 13.0332 13.0332 13.0865 13.0865 13.4066 13.4066 13.8565 13.8565 14.0788 14.0788 14.0860 14.0860 14.8370 14.8370 14.9008 14.9008 15.8857 15.8857 16.2269 16.2269 16.2468 16.2468 16.9696 16.9696 17.3115 17.3115 17.5623 17.5623 18.7427 18.7427 19.1776 19.1776 19.3002 19.3002 20.6328 20.6328 k = 0.0000 0.0000 0.2143 ( 3142 PWs) bands (ev): 1.8466 1.8466 5.7588 5.7588 7.5410 7.5410 8.3422 8.3422 8.5795 8.5795 9.1658 9.1658 9.6822 9.6822 9.8655 9.8655 10.0085 10.0085 10.3011 10.3011 10.6183 10.6183 11.1170 11.1170 11.4464 11.4464 11.9669 11.9669 12.4003 12.4003 12.4683 12.4683 12.7206 12.7206 13.0322 13.0322 13.0867 13.0867 13.3906 13.3906 13.8480 13.8480 14.0541 14.0541 14.0753 14.0753 14.8392 14.8392 14.8958 14.8958 15.9248 15.9248 16.2298 16.2298 16.2476 16.2476 17.0910 17.0910 17.3884 17.3884 17.5818 17.5818 18.6271 18.6271 19.0873 19.0873 19.2904 19.2904 20.6336 20.6336 k = 0.0000 0.0000 0.2262 ( 3130 PWs) bands (ev): 1.8513 1.8513 5.7338 5.7338 7.5625 7.5625 8.3384 8.3384 8.5758 8.5758 9.1422 9.1422 9.6888 9.6888 9.8771 9.8771 10.0006 10.0006 10.3123 10.3123 10.6766 10.6766 11.1250 11.1250 11.5144 11.5144 11.9253 11.9253 12.3500 12.3500 12.4149 12.4149 12.7180 12.7180 13.0322 13.0322 13.0912 13.0912 13.3786 13.3786 13.8425 13.8425 14.0267 14.0267 14.0658 14.0658 14.8411 14.8411 14.8916 14.8916 15.9584 15.9584 16.2313 16.2313 16.2488 16.2488 17.2117 17.2117 17.4065 17.4065 17.6671 17.6671 18.5113 18.5113 18.9700 18.9700 19.3040 19.3040 20.6343 20.6343 k = 0.0000 0.0000 0.2381 ( 3130 PWs) bands (ev): 1.8553 1.8553 5.7131 5.7131 7.5806 7.5806 8.3352 8.3352 8.5727 8.5727 9.1221 9.1221 9.6946 9.6946 9.8868 9.8868 9.9937 9.9937 10.3212 10.3212 10.7357 10.7357 11.1206 11.1206 11.5822 11.5822 11.8964 11.8964 12.2895 12.2895 12.3639 12.3639 12.7235 12.7235 13.0328 13.0328 13.0980 13.0980 13.3698 13.3698 13.8407 13.8407 13.9978 13.9978 14.0577 14.0577 14.8426 14.8426 14.8880 14.8880 15.9862 15.9862 16.2319 16.2319 16.2502 16.2502 17.3307 17.3307 17.3988 17.3988 17.7845 17.7845 18.3961 18.3961 18.8459 18.8459 19.3203 19.3203 20.6349 20.6349 k = 0.0000 0.0000 0.2500 ( 3130 PWs) bands (ev): 1.8585 1.8585 5.6968 5.6968 7.5950 7.5950 8.3327 8.3327 8.5704 8.5704 9.1060 9.1060 9.6994 9.6994 9.8944 9.8944 9.9880 9.9880 10.3280 10.3280 10.7948 10.7948 11.1034 11.1034 11.6481 11.6481 11.8799 11.8799 12.2258 12.2258 12.3183 12.3183 12.7320 12.7320 13.0337 13.0337 13.1056 13.1056 13.3635 13.3635 13.8430 13.8430 13.9687 13.9687 14.0512 14.0512 14.8437 14.8437 14.8851 14.8851 16.0080 16.0080 16.2321 16.2321 16.2515 16.2515 17.3872 17.3872 17.4464 17.4464 17.9107 17.9107 18.2836 18.2836 18.7193 18.7193 19.3350 19.3350 20.6354 20.6354 k = 0.0000 0.0000 0.2619 ( 3138 PWs) bands (ev): 1.8609 1.8609 5.6851 5.6851 7.6056 7.6056 8.3309 8.3309 8.5688 8.5688 9.0941 9.0941 9.7030 9.7030 9.8999 9.8999 9.9837 9.9837 10.3328 10.3328 10.8520 10.8520 11.0749 11.0749 11.7083 11.7083 11.8733 11.8733 12.1656 12.1656 12.2812 12.2812 12.7399 12.7399 13.0344 13.0344 13.1124 13.1124 13.3593 13.3593 13.8494 13.8494 13.9413 13.9413 14.0464 14.0464 14.8446 14.8446 14.8830 14.8830 16.0237 16.0237 16.2322 16.2322 16.2525 16.2525 17.3776 17.3776 17.5541 17.5541 18.0385 18.0385 18.1779 18.1779 18.5926 18.5926 19.3465 19.3465 20.6358 20.6358 k = 0.0000 0.0000 0.2738 ( 3146 PWs) bands (ev): 1.8623 1.8623 5.6780 5.6780 7.6119 7.6119 8.3298 8.3298 8.5678 8.5678 9.0869 9.0869 9.7052 9.7052 9.9033 9.9033 9.9811 9.9811 10.3357 10.3357 10.9032 10.9032 11.0402 11.0402 11.7547 11.7547 11.8722 11.8722 12.1186 12.1186 12.2566 12.2566 12.7454 12.7454 13.0350 13.0350 13.1172 13.1172 13.3570 13.3570 13.8588 13.8588 13.9186 13.9186 14.0435 14.0435 14.8451 14.8451 14.8818 14.8818 16.0331 16.0331 16.2322 16.2322 16.2531 16.2531 17.3716 17.3716 17.6423 17.6423 18.0910 18.0910 18.1609 18.1609 18.4712 18.4712 19.3537 19.3537 20.6360 20.6360 k = 0.0000 0.0000 0.2857 ( 3154 PWs) bands (ev): 1.8628 1.8628 5.6756 5.6756 7.6141 7.6141 8.3294 8.3294 8.5674 8.5674 9.0845 9.0845 9.7060 9.7060 9.9044 9.9044 9.9802 9.9802 10.3366 10.3366 10.9302 10.9302 11.0186 11.0186 11.7733 11.7733 11.8724 11.8724 12.0997 12.0997 12.2479 12.2479 12.7473 12.7473 13.0352 13.0352 13.1189 13.1189 13.3562 13.3562 13.8647 13.8647 13.9081 13.9081 14.0425 14.0425 14.8453 14.8453 14.8813 14.8813 16.0362 16.0362 16.2321 16.2321 16.2533 16.2533 17.3695 17.3695 17.6807 17.6807 18.0530 18.0530 18.2362 18.2362 18.3962 18.3962 19.3562 19.3562 20.6360 20.6360 k = 0.0000 0.0000 0.2857 ( 3154 PWs) bands (ev): 1.8628 1.8628 5.6756 5.6756 7.6141 7.6141 8.3294 8.3294 8.5674 8.5674 9.0845 9.0845 9.7060 9.7060 9.9044 9.9044 9.9802 9.9802 10.3366 10.3366 10.9302 10.9302 11.0186 11.0186 11.7733 11.7733 11.8724 11.8724 12.0997 12.0997 12.2479 12.2479 12.7473 12.7473 13.0352 13.0352 13.1189 13.1189 13.3562 13.3562 13.8647 13.8647 13.9081 13.9081 14.0425 14.0425 14.8453 14.8453 14.8813 14.8813 16.0362 16.0362 16.2321 16.2321 16.2533 16.2533 17.3695 17.3695 17.6807 17.6807 18.0530 18.0530 18.2362 18.2362 18.3962 18.3962 19.3562 19.3562 20.6360 20.6360 k = 0.0000 0.0122 0.2857 ( 3154 PWs) bands (ev): 1.8636 1.8636 5.6774 5.6774 7.6154 7.6154 8.3292 8.3292 8.5672 8.5672 9.0864 9.0864 9.7070 9.7070 9.9052 9.9052 9.9811 9.9811 10.3377 10.3377 10.9290 10.9290 11.0189 11.0189 11.7724 11.7724 11.8650 11.8650 12.1033 12.1033 12.2476 12.2476 12.7419 12.7419 13.0181 13.0181 13.1437 13.1437 13.3541 13.3541 13.8530 13.8530 13.9199 13.9199 14.0449 14.0449 14.8430 14.8430 14.8809 14.8809 16.0348 16.0348 16.2231 16.2231 16.2489 16.2489 17.3694 17.3694 17.6820 17.6820 18.0506 18.0506 18.2335 18.2335 18.3911 18.3911 19.3607 19.3607 20.6368 20.6368 k = 0.0000 0.0244 0.2857 ( 3154 PWs) bands (ev): 1.8663 1.8663 5.6830 5.6830 7.6192 7.6192 8.3284 8.3284 8.5663 8.5663 9.0923 9.0923 9.7101 9.7101 9.9077 9.9077 9.9841 9.9841 10.3410 10.3410 10.9254 10.9254 11.0195 11.0195 11.7694 11.7694 11.8445 11.8445 12.1124 12.1124 12.2464 12.2464 12.7267 12.7267 12.9902 12.9902 13.1933 13.1933 13.3479 13.3479 13.8318 13.8318 13.9413 13.9413 14.0520 14.0520 14.8362 14.8362 14.8794 14.8794 16.0306 16.0306 16.1968 16.1968 16.2358 16.2358 17.3694 17.3694 17.6830 17.6830 18.0417 18.0417 18.2274 18.2274 18.3783 18.3783 19.3734 19.3734 20.6410 20.6410 k = 0.0000 0.0366 0.2857 ( 3142 PWs) bands (ev): 1.8707 1.8707 5.6922 5.6922 7.6257 7.6257 8.3272 8.3272 8.5650 8.5650 9.1020 9.1020 9.7151 9.7151 9.9118 9.9118 9.9889 9.9889 10.3465 10.3465 10.9195 10.9195 11.0205 11.0205 11.7630 11.7630 11.8162 11.8162 12.1239 12.1239 12.2442 12.2442 12.7044 12.7044 12.9652 12.9652 13.2507 13.2507 13.3379 13.3379 13.8103 13.8103 13.9636 13.9636 14.0637 14.0637 14.8251 14.8251 14.8767 14.8767 16.0235 16.0235 16.1551 16.1551 16.2141 16.2141 17.3700 17.3700 17.6768 17.6768 18.0219 18.0219 18.2241 18.2241 18.3649 18.3649 19.3928 19.3928 20.6515 20.6515 k = 0.0000 0.0488 0.2857 ( 3140 PWs) bands (ev): 1.8768 1.8768 5.7051 5.7051 7.6346 7.6346 8.3253 8.3253 8.5633 8.5633 9.1154 9.1154 9.7222 9.7222 9.9175 9.9175 9.9957 9.9957 10.3540 10.3540 10.9114 10.9114 11.0216 11.0216 11.7475 11.7475 11.7891 11.7891 12.1350 12.1350 12.2402 12.2402 12.6785 12.6785 12.9439 12.9439 13.3083 13.3083 13.3260 13.3260 13.7912 13.7912 13.9849 13.9849 14.0801 14.0801 14.8099 14.8099 14.8729 14.8729 16.0133 16.0133 16.1000 16.1000 16.1845 16.1845 17.3717 17.3717 17.6544 17.6544 17.9859 17.9859 18.2317 18.2317 18.3596 18.3596 19.4168 19.4168 20.6685 20.6685 k = 0.0000 0.0610 0.2857 ( 3144 PWs) bands (ev): 1.8847 1.8847 5.7216 5.7216 7.6461 7.6461 8.3227 8.3227 8.5615 8.5615 9.1322 9.1322 9.7312 9.7312 9.9249 9.9249 10.0044 10.0044 10.3634 10.3634 10.9014 10.9014 11.0227 11.0227 11.7151 11.7151 11.7735 11.7735 12.1445 12.1445 12.2338 12.2338 12.6523 12.6523 12.9251 12.9251 13.3061 13.3061 13.3687 13.3687 13.7769 13.7769 14.0045 14.0045 14.1008 14.1008 14.7906 14.7906 14.8680 14.8680 15.9987 15.9987 16.0348 16.0348 16.1480 16.1480 17.3737 17.3737 17.6106 17.6106 17.9308 17.9308 18.2566 18.2566 18.3680 18.3680 19.4436 19.4436 20.6895 20.6895 k = 0.0000 0.0732 0.2857 ( 3136 PWs) bands (ev): 1.8942 1.8942 5.7418 5.7418 7.6601 7.6601 8.3194 8.3194 8.5597 8.5597 9.1525 9.1525 9.7422 9.7422 9.9338 9.9338 10.0150 10.0150 10.3745 10.3745 10.8895 10.8895 11.0234 11.0234 11.6731 11.6731 11.7644 11.7644 12.1514 12.1514 12.2242 12.2242 12.6280 12.6280 12.9073 12.9073 13.2866 13.2866 13.4187 13.4187 13.7704 13.7704 14.0223 14.0223 14.1256 14.1256 14.7674 14.7674 14.8622 14.8622 15.9534 15.9534 15.9880 15.9880 16.1057 16.1057 17.3732 17.3732 17.5473 17.5473 17.8590 17.8590 18.3002 18.3002 18.3902 18.3902 19.4719 19.4719 20.7105 20.7105 k = 0.0000 0.0854 0.2857 ( 3128 PWs) bands (ev): 1.9054 1.9054 5.7656 5.7656 7.6765 7.6765 8.3152 8.3152 8.5582 8.5582 9.1759 9.1759 9.7552 9.7552 9.9442 9.9442 10.0275 10.0275 10.3871 10.3871 10.8760 10.8760 11.0237 11.0237 11.6279 11.6279 11.7568 11.7568 12.1558 12.1558 12.2107 12.2107 12.6073 12.6073 12.8897 12.8897 13.2645 13.2645 13.4568 13.4568 13.7750 13.7750 14.0383 14.0383 14.1541 14.1541 14.7403 14.7403 14.8558 14.8558 15.8723 15.8723 15.9661 15.9661 16.0591 16.0591 17.3594 17.3594 17.4769 17.4769 17.7770 17.7770 18.3588 18.3588 18.4244 18.4244 19.5009 19.5009 20.7264 20.7264 k = 0.0000 0.0976 0.2857 ( 3120 PWs) bands (ev): 1.9182 1.9182 5.7929 5.7929 7.6954 7.6954 8.3100 8.3100 8.5571 8.5571 9.2022 9.2022 9.7702 9.7702 9.9562 9.9562 10.0418 10.0418 10.4008 10.4008 10.8609 10.8609 11.0235 11.0235 11.5824 11.5824 11.7494 11.7494 12.1573 12.1573 12.1935 12.1935 12.5905 12.5905 12.8716 12.8716 13.2404 13.2404 13.4792 13.4792 13.7921 13.7921 14.0525 14.0525 14.1862 14.1862 14.7095 14.7095 14.8490 14.8490 15.7844 15.7844 15.9402 15.9402 16.0108 16.0108 17.3040 17.3040 17.4272 17.4272 17.6950 17.6950 18.4252 18.4252 18.4710 18.4710 19.5300 19.5300 20.7328 20.7328 k = 0.0000 0.1098 0.2857 ( 3120 PWs) bands (ev): 1.9326 1.9326 5.8238 5.8238 7.7166 7.7166 8.3037 8.3037 8.5566 8.5566 9.2313 9.2313 9.7870 9.7870 9.9696 9.9696 10.0579 10.0579 10.4152 10.4152 10.8445 10.8445 11.0226 11.0226 11.5380 11.5380 11.7420 11.7420 12.1543 12.1543 12.1746 12.1746 12.5777 12.5777 12.8528 12.8528 13.2147 13.2147 13.4866 13.4866 13.8190 13.8190 14.0649 14.0649 14.2220 14.2220 14.6754 14.6754 14.8422 14.8422 15.6927 15.6927 15.9053 15.9053 15.9651 15.9651 17.2065 17.2065 17.3897 17.3897 17.6291 17.6291 18.4875 18.4875 18.5364 18.5364 19.5588 19.5588 20.7264 20.7264 k = 0.0000 0.1220 0.2857 ( 3116 PWs) bands (ev): 1.9484 1.9484 5.8582 5.8582 7.7402 7.7402 8.2963 8.2963 8.5568 8.5568 9.2629 9.2629 9.8058 9.8058 9.9845 9.9845 10.0759 10.0759 10.4296 10.4296 10.8271 10.8271 11.0210 11.0210 11.4957 11.4957 11.7346 11.7346 12.1383 12.1383 12.1632 12.1632 12.5680 12.5680 12.8330 12.8330 13.1875 13.1875 13.4830 13.4830 13.8494 13.8494 14.0755 14.0755 14.2605 14.2605 14.6390 14.6390 14.8355 14.8355 15.5989 15.5989 15.8579 15.8579 15.9263 15.9263 17.0917 17.0917 17.3285 17.3285 17.5969 17.5969 18.5429 18.5429 18.6195 18.6195 19.5871 19.5871 20.7060 20.7060 k = 0.0000 0.1341 0.2857 ( 3120 PWs) bands (ev): 1.9657 1.9657 5.8961 5.8961 7.7659 7.7659 8.2875 8.2875 8.5579 8.5579 9.2969 9.2969 9.8264 9.8264 10.0008 10.0008 10.0955 10.0955 10.4434 10.4434 10.8091 10.8091 11.0190 11.0190 11.4564 11.4564 11.7271 11.7271 12.1112 12.1112 12.1582 12.1582 12.5607 12.5607 12.8125 12.8125 13.1591 13.1591 13.4727 13.4727 13.8775 13.8775 14.0845 14.0845 14.2990 14.2990 14.6022 14.6022 14.8292 14.8292 15.5043 15.5043 15.8010 15.8010 15.8918 15.8918 16.9691 16.9691 17.2412 17.2412 17.5957 17.5957 18.5974 18.5974 18.7115 18.7115 19.6144 19.6144 20.6722 20.6722 k = 0.0000 0.1463 0.2857 ( 3120 PWs) bands (ev): 1.9843 1.9843 5.9373 5.9373 7.7938 7.7938 8.2775 8.2775 8.5599 8.5599 9.3331 9.3331 9.8488 9.8488 10.0184 10.0184 10.1168 10.1168 10.4557 10.4557 10.7909 10.7909 11.0168 11.0168 11.4207 11.4207 11.7199 11.7199 12.0803 12.0803 12.1533 12.1533 12.5549 12.5549 12.7911 12.7911 13.1297 13.1297 13.4587 13.4587 13.8991 13.8991 14.0924 14.0924 14.3310 14.3310 14.5700 14.5700 14.8235 14.8235 15.4109 15.4109 15.7391 15.7391 15.8578 15.8578 16.8425 16.8425 17.1417 17.1417 17.6121 17.6121 18.6526 18.6526 18.8087 18.8087 19.6405 19.6405 20.6270 20.6270 k = 0.0000 0.1585 0.2857 ( 3114 PWs) bands (ev): 2.0042 2.0042 5.9819 5.9819 7.8237 7.8237 8.2661 8.2661 8.5627 8.5627 9.3713 9.3713 9.8730 9.8730 10.0374 10.0374 10.1397 10.1397 10.4655 10.4655 10.7731 10.7731 11.0150 11.0150 11.3889 11.3889 11.7130 11.7130 12.0472 12.0472 12.1475 12.1475 12.5499 12.5499 12.7690 12.7690 13.0995 13.0995 13.4428 13.4428 13.9121 13.9121 14.0998 14.0998 14.3439 14.3439 14.5522 14.5522 14.8181 14.8181 15.3204 15.3204 15.6745 15.6745 15.8223 15.8223 16.7143 16.7143 17.0393 17.0393 17.6380 17.6380 18.7086 18.7086 18.9095 18.9095 19.6649 19.6649 20.5727 20.5727 k = 0.0000 0.1707 0.2857 ( 3110 PWs) bands (ev): 2.0253 2.0253 6.0298 6.0298 7.8555 7.8555 8.2533 8.2533 8.5665 8.5665 9.4113 9.4113 9.8989 9.8989 10.0576 10.0576 10.1641 10.1641 10.4718 10.4718 10.7557 10.7557 11.0145 11.0145 11.3612 11.3612 11.7066 11.7066 12.0127 12.0127 12.1406 12.1406 12.5451 12.5451 12.7464 12.7464 13.0685 13.0685 13.4261 13.4261 13.9156 13.9156 14.1069 14.1069 14.3268 14.3268 14.5557 14.5557 14.8128 14.8128 15.2356 15.2356 15.6085 15.6085 15.7844 15.7844 16.5863 16.5863 16.9391 16.9391 17.6701 17.6701 18.7652 18.7652 19.0129 19.0129 19.6873 19.6873 20.5117 20.5117 k = 0.0000 0.1829 0.2857 ( 3116 PWs) bands (ev): 2.0475 2.0475 6.0809 6.0809 7.8890 7.8890 8.2393 8.2393 8.5712 8.5712 9.4528 9.4528 9.9265 9.9265 10.0790 10.0790 10.1898 10.1898 10.4740 10.4740 10.7389 10.7389 11.0165 11.0165 11.3374 11.3374 11.7008 11.7008 11.9772 11.9772 12.1324 12.1324 12.5401 12.5401 12.7236 12.7236 13.0367 13.0367 13.4090 13.4090 13.9100 13.9100 14.1128 14.1128 14.2856 14.2856 14.5704 14.5704 14.8068 14.8068 15.1602 15.1602 15.5419 15.5419 15.7435 15.7435 16.4603 16.4603 16.8444 16.8444 17.7065 17.7065 18.8219 18.8219 19.1184 19.1184 19.7073 19.7073 20.4465 20.4465 k = 0.0000 0.1951 0.2857 ( 3114 PWs) bands (ev): 2.0706 2.0706 6.1350 6.1350 7.9239 7.9239 8.2242 8.2242 8.5768 8.5768 9.4956 9.4956 9.9558 9.9558 10.1017 10.1017 10.2165 10.2165 10.4721 10.4721 10.7221 10.7221 11.0220 11.0220 11.3172 11.3172 11.6958 11.6958 11.9412 11.9412 12.1231 12.1231 12.5345 12.5345 12.7007 12.7007 13.0044 13.0044 13.3918 13.3918 13.8964 13.8964 14.1144 14.1144 14.2337 14.2337 14.5792 14.5792 14.7991 14.7991 15.0990 15.0990 15.4752 15.4752 15.6988 15.6988 16.3384 16.3384 16.7583 16.7583 17.7464 17.7464 18.8784 18.8784 19.2253 19.2253 19.7245 19.7245 20.3788 20.3788 k = 0.0000 0.2073 0.2857 ( 3114 PWs) bands (ev): 2.0947 2.0947 6.1922 6.1922 7.9598 7.9598 8.2083 8.2083 8.5832 8.5832 9.5395 9.5395 9.9866 9.9866 10.1256 10.1256 10.2437 10.2437 10.4664 10.4664 10.7049 10.7049 11.0321 11.0321 11.3002 11.3002 11.6917 11.6917 11.9049 11.9049 12.1125 12.1125 12.5281 12.5281 12.6782 12.6782 12.9714 12.9714 13.3745 13.3745 13.8760 13.8760 14.0996 14.0996 14.1891 14.1891 14.5702 14.5702 14.7891 14.7891 15.0557 15.0557 15.4088 15.4088 15.6494 15.6494 16.2226 16.2226 16.6834 16.6834 17.7892 17.7892 18.9343 18.9343 19.3331 19.3331 19.7388 19.7388 20.3106 20.3106 k = 0.0000 0.2195 0.2857 ( 3118 PWs) bands (ev): 2.1195 2.1195 6.2523 6.2523 7.9957 7.9957 8.1924 8.1924 8.5904 8.5904 9.5841 9.5841 10.0189 10.0189 10.1507 10.1507 10.2707 10.2707 10.4584 10.4584 10.6869 10.6869 11.0471 11.0471 11.2858 11.2858 11.6886 11.6886 11.8687 11.8687 12.1006 12.1006 12.5208 12.5208 12.6564 12.6564 12.9378 12.9378 13.3571 13.3571 13.8498 13.8498 14.0506 14.0506 14.1720 14.1720 14.5382 14.5382 14.7778 14.7778 15.0287 15.0287 15.3431 15.3431 15.5940 15.5940 16.1154 16.1154 16.6225 16.6225 17.8344 17.8344 18.9894 18.9894 19.4405 19.4405 19.7502 19.7502 20.2436 20.2436 k = 0.0000 0.2317 0.2857 ( 3108 PWs) bands (ev): 2.1450 2.1450 6.3153 6.3153 8.0298 8.0298 8.1784 8.1784 8.5983 8.5983 9.6292 9.6292 10.0527 10.0527 10.1770 10.1770 10.2955 10.2955 10.4503 10.4503 10.6681 10.6681 11.0667 11.0667 11.2735 11.2735 11.6867 11.6867 11.8326 11.8326 12.0872 12.0872 12.5123 12.5123 12.6356 12.6356 12.9037 12.9037 13.3391 13.3391 13.8184 13.8184 13.9812 13.9812 14.1711 14.1711 14.4856 14.4856 14.7659 14.7659 15.0107 15.0107 15.2784 15.2784 15.5313 15.5313 16.0194 16.0194 16.5780 16.5780 17.8818 17.8818 19.0434 19.0434 19.5452 19.5452 19.7598 19.7598 20.1798 20.1798 k = 0.0000 0.2439 0.2857 ( 3112 PWs) bands (ev): 2.1709 2.1709 6.3808 6.3808 8.0571 8.0571 8.1710 8.1710 8.6069 8.6069 9.6742 9.6742 10.0878 10.0878 10.2044 10.2044 10.3144 10.3144 10.4462 10.4462 10.6493 10.6493 11.0900 11.0900 11.2631 11.2631 11.6861 11.6861 11.7973 11.7973 12.0724 12.0724 12.5026 12.5026 12.6163 12.6163 12.8691 12.8691 13.3201 13.3201 13.7813 13.7813 13.9063 13.9063 14.1739 14.1739 14.4190 14.4190 14.7527 14.7527 14.9930 14.9930 15.2148 15.2148 15.4603 15.4603 15.9361 15.9361 16.5518 16.5518 17.9309 17.9309 19.0959 19.0959 19.6393 19.6393 19.7725 19.7725 20.1225 20.1225 k = 0.0000 0.2561 0.2857 ( 3112 PWs) bands (ev): 2.1973 2.1973 6.4489 6.4489 8.0682 8.0682 8.1797 8.1797 8.6160 8.6160 9.7190 9.7190 10.1241 10.1241 10.2328 10.2328 10.3213 10.3213 10.4520 10.4520 10.6318 10.6318 11.1156 11.1156 11.2544 11.2544 11.6865 11.6865 11.7631 11.7631 12.0560 12.0560 12.4918 12.4918 12.5985 12.5985 12.8342 12.8342 13.2994 13.2994 13.7357 13.7357 13.8347 13.8347 14.1770 14.1770 14.3442 14.3442 14.7372 14.7372 14.9699 14.9699 15.1524 15.1524 15.3813 15.3813 15.8659 15.8659 16.5448 16.5448 17.9815 17.9815 19.1466 19.1466 19.6982 19.6982 19.8061 19.8061 20.0794 20.0794 k = 0.0000 0.2683 0.2857 ( 3116 PWs) bands (ev): 2.2238 2.2238 6.5193 6.5193 8.0608 8.0608 8.2066 8.2066 8.6258 8.6258 9.7628 9.7628 10.1615 10.1615 10.2621 10.2621 10.3136 10.3136 10.4703 10.4703 10.6171 10.6171 11.1413 11.1413 11.2478 11.2478 11.6865 11.6865 11.7324 11.7324 12.0379 12.0379 12.4799 12.4799 12.5825 12.5825 12.7991 12.7991 13.2760 13.2760 13.6763 13.6763 13.7747 13.7747 14.1793 14.1793 14.2651 14.2651 14.7183 14.7183 14.9386 14.9386 15.0911 15.0911 15.2962 15.2962 15.8075 15.8075 16.5566 16.5566 18.0332 18.0332 19.1954 19.1954 19.7099 19.7099 19.8517 19.8517 20.0716 20.0716 k = 0.0000 0.2805 0.2857 ( 3116 PWs) bands (ev): 2.2505 2.2505 6.5919 6.5919 8.0431 8.0431 8.2434 8.2434 8.6362 8.6362 9.8053 9.8053 10.1997 10.1997 10.2877 10.2877 10.2987 10.2987 10.4974 10.4974 10.6072 10.6072 11.1640 11.1640 11.2449 11.2449 11.6773 11.6773 11.7142 11.7142 12.0181 12.0181 12.4672 12.4672 12.5682 12.5682 12.7643 12.7643 13.2487 13.2487 13.6043 13.6043 13.7283 13.7283 14.1758 14.1758 14.1886 14.1886 14.6953 14.6953 14.8992 14.8992 15.0306 15.0306 15.2081 15.2081 15.7589 15.7589 16.5855 16.5855 18.0857 18.0857 19.2415 19.2416 19.7004 19.7004 19.8588 19.8588 20.1245 20.1245 k = 0.0000 0.2927 0.2857 ( 3106 PWs) bands (ev): 2.2770 2.2770 6.6664 6.6664 8.0209 8.0209 8.2842 8.2842 8.6470 8.6470 9.8455 9.8455 10.2361 10.2361 10.2679 10.2679 10.3246 10.3246 10.5282 10.5282 10.6044 10.6044 11.1789 11.1789 11.2487 11.2487 11.6529 11.6529 11.7157 11.7157 11.9967 11.9967 12.4540 12.4540 12.5549 12.5549 12.7304 12.7304 13.2158 13.2158 13.5278 13.5278 13.6900 13.6900 14.1015 14.1015 14.1810 14.1810 14.6678 14.6678 14.8531 14.8531 14.9701 14.9701 15.1205 15.1205 15.7179 15.7179 16.6290 16.6290 18.1387 18.1387 19.2846 19.2846 19.6807 19.6807 19.8375 19.8375 20.2175 20.2175 k = 0.0000 0.3049 0.2857 ( 3104 PWs) bands (ev): 2.3033 2.3033 6.7426 6.7426 7.9966 7.9966 8.3267 8.3267 8.6585 8.6585 9.8825 9.8825 10.2283 10.2283 10.2837 10.2837 10.3554 10.3554 10.5565 10.5565 10.6131 10.6131 11.1832 11.1832 11.2602 11.2602 11.6249 11.6249 11.7257 11.7257 11.9736 11.9736 12.4408 12.4408 12.5418 12.5418 12.6983 12.6983 13.1755 13.1755 13.4535 13.4535 13.6561 13.6561 14.0211 14.0211 14.1785 14.1785 14.6355 14.6355 14.8024 14.8024 14.9087 14.9087 15.0369 15.0369 15.6830 15.6830 16.6841 16.6841 18.1919 18.1919 19.3234 19.3234 19.6547 19.6547 19.8107 19.8107 20.3251 20.3251 k = 0.0000 0.3171 0.2857 ( 3108 PWs) bands (ev): 2.3292 2.3292 6.8202 6.8202 7.9711 7.9711 8.3694 8.3694 8.6705 8.6705 9.9139 9.9139 10.1959 10.1959 10.3234 10.3234 10.3860 10.3860 10.5768 10.5768 10.6381 10.6381 11.1800 11.1800 11.2744 11.2744 11.5984 11.5984 11.7404 11.7404 11.9491 11.9491 12.4277 12.4277 12.5281 12.5281 12.6693 12.6693 13.1263 13.1263 13.3851 13.3851 13.6249 13.6249 13.9425 13.9425 14.1741 14.1741 14.5984 14.5984 14.7488 14.7488 14.8451 14.8451 14.9607 14.9607 15.6534 15.6534 16.7480 16.7480 18.2450 18.2450 19.3559 19.3559 19.6269 19.6269 19.7853 19.7853 20.4372 20.4372 k = 0.0000 0.3293 0.2857 ( 3112 PWs) bands (ev): 2.3545 2.3545 6.8989 6.8989 7.9452 7.9452 8.4116 8.4116 8.6831 8.6831 9.9355 9.9355 10.1665 10.1665 10.3644 10.3644 10.4158 10.4158 10.5930 10.5930 10.6749 10.6749 11.1733 11.1733 11.2859 11.2859 11.5746 11.5746 11.7590 11.7590 11.9233 11.9233 12.4145 12.4145 12.5127 12.5127 12.6451 12.6451 13.0681 13.0681 13.3244 13.3244 13.5952 13.5952 13.8672 13.8672 14.1673 14.1673 14.5567 14.5567 14.6937 14.6937 14.7800 14.7800 14.8937 14.8937 15.6281 15.6281 16.8182 16.8182 18.2977 18.2977 19.3787 19.3787 19.6030 19.6030 19.7625 19.7625 20.5491 20.5491 k = 0.0000 0.3415 0.2857 ( 3108 PWs) bands (ev): 2.3790 2.3790 6.9782 6.9782 7.9194 7.9194 8.4525 8.4525 8.6965 8.6965 9.9402 9.9402 10.1491 10.1491 10.4052 10.4052 10.4447 10.4447 10.6107 10.6107 10.7171 10.7171 11.1649 11.1649 11.2917 11.2917 11.5544 11.5544 11.7809 11.7809 11.8967 11.8967 12.4004 12.4004 12.4958 12.4958 12.6267 12.6267 13.0029 13.0029 13.2703 13.2703 13.5659 13.5659 13.7964 13.7964 14.1579 14.1579 14.5112 14.5112 14.6368 14.6368 14.7170 14.7170 14.8350 14.8350 15.6068 15.6068 16.8924 16.8924 18.3496 18.3496 19.3870 19.3870 19.5897 19.5897 19.7424 19.7424 20.6559 20.6559 k = 0.0000 0.3537 0.2857 ( 3104 PWs) bands (ev): 2.4026 2.4026 7.0577 7.0577 7.8940 7.8940 8.4915 8.4915 8.7106 8.7106 9.9226 9.9226 10.1503 10.1503 10.4435 10.4435 10.4742 10.4742 10.6316 10.6316 10.7618 10.7618 11.1557 11.1557 11.2905 11.2905 11.5378 11.5378 11.8056 11.8056 11.8696 11.8696 12.3838 12.3838 12.4797 12.4797 12.6143 12.6143 12.9342 12.9342 13.2206 13.2206 13.5356 13.5356 13.7319 13.7319 14.1457 14.1457 14.4626 14.4626 14.5782 14.5782 14.6607 14.6607 14.7825 14.7825 15.5890 15.5890 16.9687 16.9687 18.4004 18.4004 19.3782 19.3782 19.5903 19.5903 19.7250 19.7250 20.7483 20.7483 k = 0.0000 0.3659 0.2857 ( 3094 PWs) bands (ev): 2.4251 2.4251 7.1369 7.1369 7.8696 7.8696 8.5279 8.5279 8.7256 8.7256 9.8866 9.8866 10.1672 10.1672 10.4752 10.4752 10.5079 10.5079 10.6555 10.6555 10.8075 10.8075 11.1464 11.1464 11.2827 11.2827 11.5239 11.5239 11.8318 11.8318 11.8432 11.8432 12.3627 12.3627 12.4676 12.4676 12.6067 12.6067 12.8655 12.8655 13.1729 13.1729 13.5030 13.5030 13.6749 13.6749 14.1312 14.1312 14.4114 14.4114 14.5198 14.5198 14.6126 14.6126 14.7346 14.7346 15.5741 15.5741 17.0454 17.0454 18.4498 18.4498 19.3562 19.3562 19.6005 19.6005 19.7116 19.7116 20.8081 20.8081 k = 0.0000 0.3780 0.2857 ( 3102 PWs) bands (ev): 2.4464 2.4464 7.2150 7.2150 7.8464 7.8464 8.5611 8.5611 8.7414 8.7414 9.8401 9.8401 10.1927 10.1927 10.4993 10.4993 10.5466 10.5466 10.6814 10.6814 10.8529 10.8529 11.1377 11.1377 11.2696 11.2696 11.5112 11.5112 11.8166 11.8166 11.8597 11.8597 12.3366 12.3366 12.4614 12.4614 12.6026 12.6026 12.8001 12.8001 13.1253 13.1253 13.4681 13.4681 13.6259 13.6259 14.1149 14.1149 14.3573 14.3573 14.4659 14.4659 14.5716 14.5716 14.6905 14.6905 15.5619 15.5619 17.1210 17.1210 18.4974 18.4974 19.3272 19.3272 19.6123 19.6123 19.7046 19.7046 20.8183 20.8183 k = 0.0000 0.3902 0.2857 ( 3088 PWs) bands (ev): 2.4662 2.4662 7.2912 7.2912 7.8249 7.8249 8.5907 8.5907 8.7577 8.7577 9.7887 9.7887 10.2223 10.2223 10.5188 10.5188 10.5872 10.5872 10.7086 10.7086 10.8963 10.8963 11.1308 11.1308 11.2533 11.2533 11.4978 11.4978 11.7922 11.7922 11.8866 11.8866 12.3069 12.3069 12.4605 12.4605 12.6010 12.6010 12.7410 12.7410 13.0767 13.0767 13.4318 13.4318 13.5840 13.5840 14.0982 14.0982 14.3004 14.3004 14.4191 14.4191 14.5363 14.5363 14.6499 14.6499 15.5520 15.5520 17.1943 17.1943 18.5429 18.5429 19.2956 19.2956 19.6183 19.6183 19.7075 19.7075 20.7892 20.7892 k = 0.0000 0.4024 0.2857 ( 3084 PWs) bands (ev): 2.4844 2.4844 7.3645 7.3645 7.8056 7.8056 8.6167 8.6167 8.7739 8.7739 9.7360 9.7360 10.2537 10.2537 10.5353 10.5353 10.6276 10.6276 10.7360 10.7360 10.9347 10.9347 11.1273 11.1273 11.2360 11.2360 11.4822 11.4822 11.7701 11.7701 11.9121 11.9121 12.2751 12.2751 12.4631 12.4631 12.6010 12.6010 12.6910 12.6910 13.0267 13.0267 13.3965 13.3965 13.5470 13.5470 14.0828 14.0828 14.2422 14.2422 14.3792 14.3792 14.5058 14.5058 14.6131 14.6131 15.5440 15.5440 17.2640 17.2640 18.5861 18.5861 19.2635 19.2635 19.6167 19.6167 19.7204 19.7204 20.7420 20.7420 k = 0.0000 0.4146 0.2857 ( 3088 PWs) bands (ev): 2.5008 2.5008 7.4335 7.4335 7.7891 7.7891 8.6392 8.6392 8.7891 8.7891 9.6840 9.6840 10.2855 10.2855 10.5492 10.5492 10.6667 10.6667 10.7631 10.7631 10.9642 10.9642 11.1295 11.1295 11.2203 11.2203 11.4635 11.4635 11.7504 11.7504 11.9355 11.9355 12.2425 12.2425 12.4668 12.4668 12.6020 12.6020 12.6529 12.6529 12.9757 12.9757 13.3639 13.3639 13.5134 13.5134 14.0702 14.0702 14.1852 14.1852 14.3440 14.3440 14.4799 14.4799 14.5804 14.5804 15.5376 15.5376 17.3290 17.3290 18.6263 18.6263 19.2324 19.2324 19.6108 19.6108 19.7388 19.7388 20.6888 20.6888 k = 0.0000 0.4268 0.2857 ( 3088 PWs) bands (ev): 2.5154 2.5154 7.4963 7.4963 7.7763 7.7763 8.6587 8.6587 8.8021 8.8021 9.6349 9.6349 10.3169 10.3169 10.5607 10.5607 10.7034 10.7034 10.7891 10.7891 10.9815 10.9815 11.1371 11.1371 11.2106 11.2106 11.4417 11.4417 11.7330 11.7330 11.9565 11.9565 12.2101 12.2101 12.4695 12.4695 12.6035 12.6035 12.6290 12.6290 12.9246 12.9246 13.3353 13.3353 13.4824 13.4824 14.0613 14.0613 14.1318 14.1318 14.3114 14.3114 14.4586 14.4586 14.5520 14.5520 15.5326 15.5326 17.3880 17.3880 18.6634 18.6634 19.2031 19.2031 19.6036 19.6036 19.7591 19.7591 20.6355 20.6355 k = 0.0000 0.4390 0.2857 ( 3088 PWs) bands (ev): 2.5280 2.5280 7.5506 7.5506 7.7683 7.7683 8.6758 8.6758 8.8121 8.8121 9.5904 9.5904 10.3469 10.3469 10.5695 10.5695 10.7370 10.7370 10.8134 10.8134 10.9875 10.9875 11.1421 11.1421 11.2145 11.2145 11.4176 11.4176 11.7177 11.7177 11.9749 11.9749 12.1784 12.1784 12.4710 12.4710 12.6035 12.6035 12.6203 12.6203 12.8749 12.8749 13.3110 13.3110 13.4540 13.4540 14.0542 14.0542 14.0861 14.0861 14.2804 14.2804 14.4415 14.4415 14.5281 14.5281 15.5287 15.5287 17.4402 17.4402 18.6968 18.6968 19.1762 19.1762 19.5969 19.5969 19.7791 19.7791 20.5853 20.5853 k = 0.0000 0.4512 0.2857 ( 3088 PWs) bands (ev): 2.5384 2.5384 7.5935 7.5935 7.7666 7.7666 8.6908 8.6908 8.8183 8.8183 9.5519 9.5519 10.3747 10.3747 10.5755 10.5755 10.7667 10.7667 10.8345 10.8345 10.9869 10.9869 11.1390 11.1390 11.2333 11.2333 11.3926 11.3926 11.7039 11.7039 11.9912 11.9912 12.1483 12.1483 12.4731 12.4731 12.6007 12.6007 12.6237 12.6237 12.8283 12.8283 13.2912 13.2912 13.4290 13.4290 14.0313 14.0313 14.0675 14.0675 14.2507 14.2507 14.4283 14.4283 14.5088 14.5088 15.5258 15.5258 17.4844 17.4844 18.7259 18.7259 19.1523 19.1523 19.5912 19.5912 19.7975 19.7975 20.5405 20.5405 k = 0.0000 0.4634 0.2857 ( 3086 PWs) bands (ev): 2.5466 2.5466 7.6225 7.6225 7.7720 7.7720 8.7039 8.7039 8.8206 8.8206 9.5208 9.5208 10.3991 10.3991 10.5790 10.5790 10.7921 10.7921 10.8504 10.8504 10.9848 10.9848 11.1325 11.1325 11.2579 11.2579 11.3684 11.3684 11.6918 11.6918 12.0062 12.0062 12.1202 12.1202 12.4783 12.4783 12.5967 12.5967 12.6319 12.6319 12.7875 12.7875 13.2757 13.2757 13.4084 13.4084 13.9986 13.9986 14.0707 14.0707 14.2226 14.2226 14.4187 14.4187 14.4940 14.4940 15.5237 15.5237 17.5199 17.5199 18.7501 18.7501 19.1322 19.1322 19.5868 19.5868 19.8134 19.8134 20.5030 20.5030 k = 0.0000 0.4756 0.2857 ( 3090 PWs) bands (ev): 2.5525 2.5525 7.6387 7.6387 7.7819 7.7819 8.7147 8.7147 8.8201 8.8201 9.4981 9.4981 10.4186 10.4186 10.5803 10.5803 10.8130 10.8130 10.8590 10.8590 10.9841 10.9841 11.1267 11.1267 11.2807 11.2807 11.3473 11.3473 11.6819 11.6819 12.0208 12.0208 12.0949 12.0949 12.4870 12.4870 12.5910 12.5910 12.6403 12.6403 12.7554 12.7554 13.2646 13.2646 13.3930 13.3930 13.9729 13.9729 14.0791 14.0791 14.1976 14.1976 14.4122 14.4122 14.4835 14.4835 15.5222 15.5222 17.5458 17.5458 18.7684 18.7684 19.1168 19.1168 19.5838 19.5838 19.8257 19.8257 20.4745 20.4745 k = 0.0000 0.4878 0.2857 ( 3096 PWs) bands (ev): 2.5561 2.5561 7.6460 7.6460 7.7910 7.7910 8.7221 8.7221 8.8183 8.8183 9.4843 9.4843 10.4314 10.4314 10.5803 10.5803 10.8287 10.8287 10.8604 10.8604 10.9850 10.9850 11.1231 11.1231 11.2980 11.2980 11.3312 11.3312 11.6752 11.6752 12.0361 12.0361 12.0727 12.0727 12.4963 12.4963 12.5845 12.5845 12.6463 12.6463 12.7349 12.7349 13.2578 13.2578 13.3835 13.3835 13.9568 13.9568 14.0884 14.0884 14.1785 14.1785 14.4084 14.4084 14.4772 14.4772 15.5214 15.5214 17.5616 17.5616 18.7800 18.7800 19.1070 19.1070 19.5819 19.5819 19.8336 19.8336 20.4567 20.4567 k = 0.0000 0.5000 0.2857 ( 3092 PWs) bands (ev): 2.5573 2.5573 7.6480 7.6480 7.7946 7.7946 8.7249 8.7249 8.8174 8.8174 9.4797 9.4797 10.4359 10.4359 10.5802 10.5802 10.8355 10.8355 10.8590 10.8590 10.9857 10.9857 11.1219 11.1219 11.3061 11.3061 11.3235 11.3235 11.6728 11.6728 12.0515 12.0515 12.0548 12.0548 12.5006 12.5006 12.5812 12.5812 12.6484 12.6484 12.7279 12.7279 13.2555 13.2555 13.3803 13.3803 13.9513 13.9513 14.0929 14.0929 14.1708 14.1708 14.4072 14.4072 14.4752 14.4752 15.5211 15.5211 17.5669 17.5669 18.7839 18.7839 19.1036 19.1036 19.5814 19.5814 19.8363 19.8363 20.4506 20.4506 k = 0.0000 0.5000 0.2857 ( 3092 PWs) bands (ev): 2.5573 2.5573 7.6480 7.6480 7.7946 7.7946 8.7249 8.7249 8.8174 8.8174 9.4797 9.4797 10.4359 10.4359 10.5802 10.5802 10.8355 10.8355 10.8590 10.8590 10.9857 10.9857 11.1219 11.1219 11.3061 11.3061 11.3235 11.3235 11.6728 11.6728 12.0515 12.0515 12.0548 12.0548 12.5006 12.5006 12.5812 12.5812 12.6484 12.6484 12.7279 12.7279 13.2555 13.2555 13.3803 13.3803 13.9513 13.9513 14.0929 14.0929 14.1708 14.1708 14.4072 14.4072 14.4752 14.4752 15.5211 15.5211 17.5669 17.5669 18.7839 18.7839 19.1036 19.1036 19.5814 19.5814 19.8363 19.8363 20.4506 20.4506 k = 0.0122 0.5000 0.2857 ( 3096 PWs) bands (ev): 2.5579 2.5579 7.6485 7.6485 7.7955 7.7955 8.7233 8.7233 8.8173 8.8173 9.4806 9.4806 10.4345 10.4345 10.5806 10.5806 10.8168 10.8168 10.8779 10.8779 10.9836 10.9836 11.1206 11.1206 11.3064 11.3064 11.3241 11.3241 11.6705 11.6705 12.0511 12.0511 12.0560 12.0560 12.4865 12.4865 12.5853 12.5853 12.6611 12.6611 12.7313 12.7313 13.2578 13.2578 13.3806 13.3806 13.9523 13.9523 14.0928 14.0928 14.1712 14.1712 14.4074 14.4074 14.4770 14.4770 15.5205 15.5205 17.5692 17.5692 18.7796 18.7796 19.1044 19.1044 19.5713 19.5713 19.8104 19.8104 20.4899 20.4899 k = 0.0244 0.5000 0.2857 ( 3084 PWs) bands (ev): 2.5597 2.5597 7.6502 7.6502 7.7981 7.7981 8.7186 8.7186 8.8170 8.8170 9.4831 9.4831 10.4304 10.4304 10.5819 10.5819 10.7907 10.7907 10.9047 10.9047 10.9773 10.9773 11.1170 11.1170 11.3072 11.3072 11.3261 11.3261 11.6637 11.6637 12.0466 12.0466 12.0624 12.0624 12.4578 12.4578 12.5918 12.5918 12.6862 12.6862 12.7466 12.7466 13.2642 13.2642 13.3819 13.3819 13.9551 13.9551 14.0925 14.0925 14.1724 14.1724 14.4080 14.4080 14.4826 14.4826 15.5186 15.5186 17.5758 17.5758 18.7661 18.7661 19.1066 19.1066 19.5386 19.5386 19.7544 19.7544 20.5892 20.5892 k = 0.0366 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.5627 2.5627 7.6528 7.6528 7.8028 7.8028 8.7108 8.7108 8.8166 8.8166 9.4874 9.4874 10.4236 10.4236 10.5838 10.5838 10.7652 10.7652 10.9313 10.9313 10.9670 10.9670 11.1112 11.1112 11.3086 11.3086 11.3291 11.3291 11.6533 11.6533 12.0388 12.0388 12.0721 12.0721 12.4289 12.4289 12.5987 12.5987 12.7019 12.7019 12.7837 12.7837 13.2743 13.2743 13.3846 13.3846 13.9599 13.9599 14.0920 14.0920 14.1745 14.1745 14.4090 14.4090 14.4916 14.4916 15.5155 15.5155 17.5866 17.5866 18.7420 18.7420 19.1098 19.1098 19.4810 19.4810 19.6998 19.6998 20.7196 20.7196 k = 0.0488 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.5669 2.5669 7.6558 7.6558 7.8099 7.8099 8.6999 8.6999 8.8160 8.8160 9.4933 9.4933 10.4144 10.4144 10.5858 10.5858 10.7416 10.7416 10.9506 10.9506 10.9591 10.9591 11.1036 11.1036 11.3104 11.3104 11.3330 11.3330 11.6401 11.6401 12.0286 12.0286 12.0825 12.0825 12.4059 12.4059 12.6066 12.6066 12.7088 12.7088 12.8360 12.8360 13.2868 13.2868 13.3897 13.3897 13.9663 13.9663 14.0915 14.0915 14.1773 14.1773 14.4106 14.4106 14.5038 14.5038 15.5111 15.5111 17.6008 17.6008 18.7054 18.7054 19.1134 19.1134 19.4083 19.4083 19.6562 19.6562 20.8611 20.8611 k = 0.0610 0.5000 0.2857 ( 3084 PWs) bands (ev): 2.5722 2.5722 7.6588 7.6588 7.8199 7.8199 8.6859 8.6859 8.8152 8.8152 9.5007 9.5007 10.4029 10.4029 10.5873 10.5873 10.7208 10.7208 10.9341 10.9341 10.9818 10.9818 11.0947 11.0947 11.3119 11.3119 11.3382 11.3382 11.6253 11.6253 12.0166 12.0166 12.0910 12.0910 12.3921 12.3921 12.6160 12.6160 12.7130 12.7130 12.8944 12.8944 13.2999 13.2999 13.3990 13.3990 13.9744 13.9744 14.0909 14.0909 14.1808 14.1808 14.4127 14.4127 14.5187 14.5187 15.5056 15.5056 17.6174 17.6174 18.6549 18.6549 19.1157 19.1157 19.3378 19.3378 19.6181 19.6181 20.9947 20.9947 k = 0.0732 0.5000 0.2857 ( 3084 PWs) bands (ev): 2.5787 2.5787 7.6614 7.6614 7.8331 7.8331 8.6689 8.6689 8.8143 8.8143 9.5097 9.5097 10.3893 10.3893 10.5874 10.5874 10.7040 10.7040 10.9129 10.9129 11.0036 11.0036 11.0849 11.0849 11.3125 11.3125 11.3452 11.3452 11.6096 11.6096 12.0036 12.0036 12.0955 12.0955 12.3895 12.3895 12.6268 12.6268 12.7166 12.7166 12.9552 12.9552 13.3116 13.3116 13.4143 13.4143 13.9839 13.9839 14.0905 14.0905 14.1851 14.1851 14.4156 14.4156 14.5357 14.5357 15.4991 15.4991 17.6349 17.6349 18.5908 18.5908 19.1136 19.1136 19.2825 19.2825 19.5799 19.5799 21.0778 21.0778 k = 0.0854 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.5863 2.5863 7.6632 7.6632 7.8499 7.8499 8.6489 8.6489 8.8131 8.8131 9.5200 9.5200 10.3738 10.3738 10.5853 10.5853 10.6921 10.6921 10.8886 10.8886 11.0223 11.0223 11.0753 11.0753 11.3115 11.3115 11.3545 11.3545 11.5939 11.5939 11.9904 11.9904 12.0952 12.0952 12.3983 12.3983 12.6389 12.6389 12.7202 12.7202 13.0163 13.0163 13.3206 13.3206 13.4368 13.4368 13.9947 13.9947 14.0900 14.0900 14.1902 14.1902 14.4193 14.4193 14.5544 14.5544 15.4916 15.4916 17.6506 17.6506 18.5173 18.5173 19.1031 19.1031 19.2496 19.2496 19.5390 19.5390 21.0416 21.0416 k = 0.0976 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.5950 2.5950 7.6639 7.6639 7.8705 7.8705 8.6259 8.6259 8.8118 8.8118 9.5316 9.5316 10.3566 10.3566 10.5805 10.5805 10.6856 10.6856 10.8618 10.8618 11.0353 11.0353 11.0684 11.0684 11.3091 11.3091 11.3659 11.3659 11.5787 11.5787 11.9775 11.9775 12.0911 12.0911 12.4171 12.4171 12.6521 12.6521 12.7241 12.7241 13.0762 13.0762 13.3275 13.3275 13.4661 13.4661 14.0069 14.0069 14.0895 14.0895 14.1959 14.1959 14.4241 14.4241 14.5742 14.5742 15.4834 15.4834 17.6604 17.6604 18.4420 18.4420 19.0836 19.0836 19.2376 19.2376 19.4948 19.4948 20.9155 20.9155 k = 0.1098 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.6048 2.6048 7.6634 7.6634 7.8949 7.8949 8.6002 8.6002 8.8103 8.8103 9.5443 9.5443 10.3379 10.3379 10.5731 10.5731 10.6840 10.6840 10.8330 10.8330 11.0365 11.0365 11.0701 11.0701 11.3055 11.3055 11.3790 11.3790 11.5647 11.5647 11.9656 11.9656 12.0849 12.0849 12.4435 12.4435 12.6663 12.6663 12.7285 12.7285 13.1335 13.1335 13.3336 13.3336 13.5007 13.5007 14.0203 14.0203 14.0888 14.0888 14.2024 14.2024 14.4300 14.4300 14.5944 14.5944 15.4744 15.4744 17.6585 17.6585 18.3748 18.3748 19.0589 19.0589 19.2379 19.2379 19.4477 19.4477 20.7603 20.7603 k = 0.1220 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.6155 2.6155 7.6618 7.6618 7.9229 7.9229 8.5719 8.5719 8.8086 8.8086 9.5579 9.5579 10.3181 10.3181 10.5640 10.5640 10.6862 10.6862 10.8032 10.8032 11.0287 11.0287 11.0778 11.0778 11.3016 11.3016 11.3927 11.3927 11.5529 11.5529 11.9550 11.9550 12.0784 12.0784 12.4751 12.4751 12.6811 12.6811 12.7334 12.7334 13.1864 13.1864 13.3408 13.3408 13.5392 13.5392 14.0350 14.0350 14.0880 14.0880 14.2095 14.2095 14.4371 14.4371 14.6144 14.6144 15.4649 15.4649 17.6382 17.6382 18.3262 18.3262 19.0317 19.0317 19.2399 19.2399 19.4017 19.4017 20.5992 20.5992 k = 0.1341 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.6273 2.6273 7.6591 7.6591 7.9544 7.9544 8.5412 8.5412 8.8068 8.8068 9.5722 9.5722 10.2974 10.2974 10.5538 10.5538 10.6909 10.6909 10.7736 10.7736 11.0182 11.0182 11.0845 11.0845 11.2981 11.2981 11.4055 11.4055 11.5449 11.5449 11.9461 11.9461 12.0729 12.0729 12.5098 12.5098 12.6965 12.6965 12.7391 12.7391 13.2327 13.2327 13.3514 13.3514 13.5800 13.5800 14.0510 14.0510 14.0872 14.0872 14.2172 14.2172 14.4457 14.4457 14.6335 14.6335 15.4551 15.4551 17.5951 17.5951 18.3033 18.3033 19.0019 19.0019 19.2293 19.2293 19.3678 19.3678 20.4412 20.4412 k = 0.1463 0.5000 0.2857 ( 3068 PWs) bands (ev): 2.6399 2.6399 7.6554 7.6554 7.9890 7.9890 8.5087 8.5087 8.8048 8.8048 9.5870 9.5870 10.2759 10.2759 10.5420 10.5420 10.6966 10.6966 10.7460 10.7460 11.0073 11.0073 11.0880 11.0880 11.2957 11.2957 11.4152 11.4152 11.5431 11.5431 11.9391 11.9391 12.0691 12.0691 12.5459 12.5459 12.7122 12.7122 12.7456 12.7456 13.2690 13.2690 13.3689 13.3689 13.6213 13.6213 14.0658 14.0658 14.0891 14.0891 14.2254 14.2254 14.4557 14.4557 14.6513 14.6513 15.4451 15.4451 17.5307 17.5307 18.3065 18.3065 18.9681 18.9681 19.1906 19.1906 19.3599 19.3599 20.2916 20.2916 k = 0.1585 0.5000 0.2857 ( 3068 PWs) bands (ev): 2.6534 2.6534 7.6509 7.6509 8.0261 8.0261 8.4749 8.4749 8.8026 8.8026 9.6021 9.6021 10.2540 10.2540 10.5278 10.5278 10.7003 10.7003 10.7253 10.7253 10.9968 10.9968 11.0875 11.0875 11.2945 11.2945 11.4200 11.4200 11.5498 11.5498 11.9342 11.9342 12.0675 12.0675 12.5822 12.5822 12.7278 12.7278 12.7534 12.7534 13.2940 13.2940 13.3949 13.3949 13.6613 13.6613 14.0708 14.0708 14.1031 14.1031 14.2339 14.2339 14.4669 14.4669 14.6671 14.6671 15.4351 15.4351 17.4510 17.4510 18.3301 18.3301 18.9290 18.9290 19.1284 19.1284 19.3726 19.3726 20.1544 20.1544 k = 0.1707 0.5000 0.2857 ( 3072 PWs) bands (ev): 2.6676 2.6676 7.6456 7.6456 8.0649 8.0649 8.4407 8.4407 8.8004 8.8004 9.6171 9.6171 10.2318 10.2318 10.5093 10.5093 10.6936 10.6936 10.7216 10.7216 10.9868 10.9868 11.0828 11.0828 11.2944 11.2944 11.4203 11.4203 11.5653 11.5653 11.9314 11.9314 12.0682 12.0682 12.6173 12.6173 12.7425 12.7425 12.7632 12.7632 13.3108 13.3108 13.4267 13.4267 13.6977 13.6977 14.0675 14.0675 14.1281 14.1281 14.2427 14.2427 14.4792 14.4792 14.6807 14.6807 15.4253 15.4253 17.3632 17.3632 18.3661 18.3661 18.8844 18.8844 19.0536 19.0536 19.3949 19.3949 20.0330 20.0330 k = 0.1829 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.6826 2.6826 7.6396 7.6396 8.1035 8.1035 8.4081 8.4081 8.7980 8.7980 9.6319 9.6319 10.2095 10.2095 10.4854 10.4854 10.6849 10.6849 10.7283 10.7283 10.9775 10.9775 11.0743 11.0743 11.2941 11.2941 11.4191 11.4191 11.5879 11.5879 11.9308 11.9308 12.0711 12.0711 12.6503 12.6503 12.7553 12.7553 12.7763 12.7763 13.3241 13.3241 13.4598 13.4598 13.7289 13.7289 14.0612 14.0612 14.1593 14.1593 14.2514 14.2514 14.4919 14.4919 14.6922 14.6922 15.4159 15.4159 17.2729 17.2729 18.4043 18.4043 18.8373 18.8373 18.9718 18.9718 19.4213 19.4213 19.9299 19.9299 k = 0.1951 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.6983 2.6983 7.6330 7.6330 8.1383 8.1383 8.3809 8.3809 8.7955 8.7955 9.6461 9.6461 10.1872 10.1872 10.4561 10.4561 10.6828 10.6828 10.7369 10.7369 10.9692 10.9692 11.0626 11.0626 11.2922 11.2922 11.4199 11.4199 11.6156 11.6156 11.9324 11.9324 12.0762 12.0762 12.6801 12.6801 12.7664 12.7664 12.7923 12.7923 13.3370 13.3370 13.4916 13.4916 13.7536 13.7536 14.0530 14.0530 14.1953 14.1953 14.2597 14.2597 14.5037 14.5037 14.7026 14.7026 15.4070 15.4070 17.1844 17.1844 18.4291 18.4291 18.7961 18.7961 18.8884 18.8884 19.4485 19.4485 19.8460 19.8460 k = 0.2073 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.7145 2.7145 7.6260 7.6260 8.1616 8.1616 8.3670 8.3670 8.7929 8.7929 9.6595 9.6595 10.1652 10.1652 10.4223 10.4223 10.6879 10.6879 10.7460 10.7460 10.9617 10.9617 11.0482 11.0482 11.2880 11.2880 11.4250 11.4250 11.6470 11.6470 11.9361 11.9361 12.0832 12.0832 12.7063 12.7063 12.7768 12.7768 12.8097 12.8097 13.3509 13.3509 13.5207 13.5207 13.7712 13.7712 14.0434 14.0434 14.2346 14.2346 14.2675 14.2675 14.5125 14.5125 14.7138 14.7138 15.3987 15.3987 17.1007 17.1007 18.4195 18.4195 18.7538 18.7538 18.8316 18.8316 19.4722 19.4722 19.7804 19.7804 k = 0.2195 0.5000 0.2857 ( 3068 PWs) bands (ev): 2.7312 2.7312 7.6185 7.6185 8.1635 8.1635 8.3763 8.3763 8.7903 8.7903 9.6718 9.6718 10.1436 10.1436 10.3855 10.3855 10.6993 10.6993 10.7552 10.7552 10.9552 10.9552 11.0317 11.0317 11.2818 11.2818 11.4349 11.4349 11.6812 11.6812 11.9418 11.9418 12.0921 12.0921 12.7286 12.7286 12.7875 12.7875 12.8272 12.8272 13.3667 13.3667 13.5462 13.5462 13.7821 13.7821 14.0327 14.0327 14.2703 14.2703 14.2795 14.2795 14.5154 14.5154 14.7289 14.7289 15.3914 15.3914 17.0237 17.0237 18.3667 18.3667 18.6712 18.6712 18.8510 18.8510 19.4842 19.4842 19.7309 19.7309 k = 0.2317 0.5000 0.2857 ( 3072 PWs) bands (ev): 2.7484 2.7484 7.6107 7.6107 8.1439 8.1439 8.4092 8.4092 8.7876 8.7876 9.6829 9.6829 10.1224 10.1224 10.3471 10.3471 10.7156 10.7156 10.7643 10.7643 10.9495 10.9495 11.0135 11.0135 11.2752 11.2752 11.4493 11.4493 11.7173 11.7173 11.9495 11.9495 12.1025 12.1025 12.7473 12.7473 12.7988 12.7988 12.8437 12.8437 13.3848 13.3848 13.5674 13.5674 13.7872 13.7872 14.0215 14.0215 14.2767 14.2767 14.3182 14.3182 14.5098 14.5098 14.7511 14.7511 15.3851 15.3851 16.9549 16.9549 18.2837 18.2837 18.5727 18.5727 18.9116 18.9116 19.4677 19.4677 19.6974 19.6974 k = 0.2439 0.5000 0.2857 ( 3068 PWs) bands (ev): 2.7658 2.7658 7.6026 7.6026 8.1115 8.1115 8.4572 8.4572 8.7849 8.7849 9.6925 9.6925 10.1017 10.1017 10.3079 10.3079 10.7352 10.7352 10.7736 10.7736 10.9443 10.9443 10.9941 10.9941 11.2700 11.2700 11.4670 11.4670 11.7549 11.7549 11.9591 11.9591 12.1145 12.1145 12.7628 12.7628 12.8106 12.8106 12.8581 12.8581 13.4052 13.4052 13.5832 13.5832 13.7878 13.7878 14.0101 14.0101 14.2772 14.2772 14.3568 14.3568 14.4954 14.4954 14.7820 14.7820 15.3801 15.3801 16.8951 16.8951 18.1852 18.1852 18.4695 18.4695 18.9895 18.9895 19.4070 19.4070 19.6822 19.6822 k = 0.2561 0.5000 0.2857 ( 3068 PWs) bands (ev): 2.7835 2.7835 7.5942 7.5942 8.0731 8.0731 8.5136 8.5136 8.7822 8.7822 9.7005 9.7005 10.0816 10.0816 10.2686 10.2686 10.7549 10.7549 10.7855 10.7855 10.9392 10.9392 10.9741 10.9741 11.2681 11.2681 11.4874 11.4874 11.7932 11.7932 11.9706 11.9706 12.1281 12.1281 12.7757 12.7757 12.8228 12.8228 12.8697 12.8697 13.4278 13.4278 13.5922 13.5922 13.7858 13.7858 13.9990 13.9990 14.2718 14.2718 14.3900 14.3900 14.4761 14.4761 14.8213 14.8213 15.3769 15.3769 16.8445 16.8445 18.0803 18.0803 18.3640 18.3640 19.0715 19.0715 19.3143 19.3143 19.6812 19.6812 k = 0.2683 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.8013 2.8013 7.5856 7.5856 8.0318 8.0318 8.5752 8.5752 8.7795 8.7795 9.7070 9.7070 10.0622 10.0622 10.2299 10.2299 10.7683 10.7683 10.8049 10.8049 10.9315 10.9315 10.9565 10.9565 11.2708 11.2708 11.5098 11.5098 11.8315 11.8315 11.9840 11.9840 12.1431 12.1431 12.7866 12.7866 12.8352 12.8352 12.8781 12.8781 13.4521 13.4521 13.5930 13.5930 13.7835 13.7835 13.9884 13.9884 14.2571 14.2571 14.4081 14.4081 14.4651 14.4651 14.8670 14.8670 15.3761 15.3761 16.8031 16.8031 17.9743 17.9743 18.2573 18.2573 19.1134 19.1134 19.2473 19.2473 19.6892 19.6892 k = 0.2805 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.8191 2.8191 7.5769 7.5769 7.9895 7.9895 8.6406 8.6406 8.7769 8.7769 9.7118 9.7118 10.0434 10.0434 10.1920 10.1920 10.7746 10.7746 10.8305 10.8305 10.9152 10.9152 10.9488 10.9488 11.2792 11.2792 11.5336 11.5336 11.8689 11.8689 11.9995 11.9995 12.1599 12.1599 12.7957 12.7957 12.8475 12.8475 12.8834 12.8834 13.4774 13.4774 13.5845 13.5845 13.7828 13.7828 13.9785 13.9785 14.2290 14.2290 14.3996 14.3996 14.4792 14.4792 14.9164 14.9164 15.3788 15.3788 16.7703 16.7703 17.8704 17.8704 18.1506 18.1506 19.0261 19.0261 19.3023 19.3023 19.7058 19.7058 k = 0.2927 0.5000 0.2857 ( 3084 PWs) bands (ev): 2.8369 2.8369 7.5681 7.5681 7.9470 7.9470 8.7087 8.7087 8.7745 8.7745 9.7151 9.7151 10.0252 10.0252 10.1555 10.1555 10.7772 10.7772 10.8551 10.8551 10.8917 10.8917 10.9529 10.9529 11.2939 11.2939 11.5585 11.5585 11.9043 11.9043 12.0173 12.0173 12.1787 12.1787 12.8032 12.8032 12.8594 12.8594 12.8855 12.8855 13.5028 13.5028 13.5671 13.5671 13.7846 13.7846 13.9691 13.9691 14.1859 14.1859 14.3829 14.3829 14.5031 14.5031 14.9663 14.9663 15.3867 15.3867 16.7453 16.7453 17.7709 17.7709 18.0447 18.0447 18.9006 18.9006 19.3890 19.3890 19.7337 19.7337 k = 0.3049 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.8545 2.8545 7.5593 7.5593 7.9050 7.9050 8.7693 8.7693 8.7819 8.7819 9.7169 9.7169 10.0075 10.0075 10.1208 10.1208 10.7776 10.7776 10.8646 10.8646 10.8715 10.8715 10.9708 10.9708 11.3149 11.3149 11.5841 11.5841 11.9366 11.9366 12.0374 12.0374 12.1997 12.1997 12.8091 12.8091 12.8707 12.8707 12.8849 12.8849 13.5242 13.5242 13.5450 13.5450 13.7884 13.7884 13.9602 13.9602 14.1302 14.1302 14.3670 14.3670 14.5275 14.5275 15.0135 15.0135 15.4021 15.4021 16.7272 16.7272 17.6772 17.6772 17.9405 17.9405 18.7690 18.7690 19.4713 19.4713 19.7772 19.7772 k = 0.3171 0.5000 0.2857 ( 3084 PWs) bands (ev): 2.8717 2.8717 7.5504 7.5504 7.8640 7.8640 8.7689 8.7689 8.8522 8.8522 9.7175 9.7175 9.9901 9.9901 10.0881 10.0881 10.7764 10.7764 10.8365 10.8365 10.8764 10.8764 11.0030 11.0030 11.3418 11.3418 11.6103 11.6103 11.9650 11.9650 12.0596 12.0596 12.2232 12.2232 12.8132 12.8132 12.8808 12.8808 12.8825 12.8825 13.5068 13.5068 13.5538 13.5538 13.7936 13.7936 13.9512 13.9512 14.0666 14.0666 14.3515 14.3515 14.5506 14.5506 15.0543 15.0543 15.4274 15.4274 16.7147 16.7147 17.5904 17.5904 17.8390 17.8390 18.6362 18.6362 19.5397 19.5397 19.8415 19.8415 k = 0.3293 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.8886 2.8886 7.5415 7.5415 7.8245 7.8245 8.7667 8.7667 8.9257 8.9257 9.7168 9.7168 9.9729 9.9729 10.0579 10.0579 10.7740 10.7740 10.8066 10.8066 10.8746 10.8746 11.0449 11.0449 11.3740 11.3740 11.6367 11.6367 11.9895 11.9895 12.0831 12.0831 12.2494 12.2494 12.8153 12.8153 12.8769 12.8769 12.8913 12.8913 13.4723 13.4723 13.5718 13.5718 13.7992 13.7992 13.9403 13.9403 14.0020 14.0020 14.3347 14.3347 14.5722 14.5722 15.0864 15.0864 15.4645 15.4645 16.7066 16.7066 17.5109 17.5109 17.7410 17.7410 18.5038 18.5038 19.5915 19.5915 19.9267 19.9267 k = 0.3415 0.5000 0.2857 ( 3080 PWs) bands (ev): 2.9049 2.9049 7.5327 7.5327 7.7867 7.7867 8.7646 8.7646 9.0003 9.0003 9.7152 9.7152 9.9555 9.9555 10.0308 10.0308 10.7698 10.7698 10.7764 10.7764 10.8696 10.8696 11.0926 11.0926 11.4107 11.4107 11.6631 11.6631 12.0106 12.0106 12.1066 12.1066 12.2779 12.2779 12.8150 12.8150 12.8707 12.8707 12.8998 12.8998 13.4351 13.4351 13.5828 13.5828 13.8042 13.8042 13.9141 13.9141 13.9555 13.9555 14.3156 14.3156 14.5923 14.5923 15.1093 15.1093 15.5134 15.5134 16.7018 16.7018 17.4392 17.4392 17.6474 17.6474 18.3726 18.3726 19.6305 19.6305 20.0276 20.0276 k = 0.3537 0.5000 0.2857 ( 3072 PWs) bands (ev): 2.9206 2.9206 7.5239 7.5239 7.7511 7.7511 8.7626 8.7626 9.0754 9.0754 9.7128 9.7128 9.9378 9.9378 10.0071 10.0071 10.7426 10.7426 10.7677 10.7677 10.8632 10.8632 11.1440 11.1440 11.4511 11.4511 11.6895 11.6895 12.0290 12.0290 12.1293 12.1293 12.3079 12.3079 12.8122 12.8122 12.8637 12.8637 12.9069 12.9069 13.3974 13.3974 13.5806 13.5806 13.8068 13.8068 13.8683 13.8683 13.9402 13.9402 14.2935 14.2935 14.6109 14.6109 15.1246 15.1246 15.5723 15.5723 16.6990 16.6990 17.3753 17.3753 17.5594 17.5594 18.2430 18.2430 19.6616 19.6616 20.1379 20.1379 k = 0.3659 0.5000 0.2857 ( 3076 PWs) bands (ev): 2.9355 2.9355 7.5151 7.5151 7.7179 7.7179 8.7607 8.7607 9.1506 9.1506 9.7099 9.7099 9.9196 9.9196 9.9870 9.9870 10.7093 10.7093 10.7635 10.7635 10.8561 10.8561 11.1979 11.1979 11.4945 11.4945 11.7157 11.7157 12.0452 12.0452 12.1509 12.1509 12.3379 12.3379 12.8069 12.8069 12.8563 12.8563 12.9122 12.9122 13.3607 13.3607 13.5576 13.5576 13.8024 13.8024 13.8401 13.8401 13.9325 13.9325 14.2686 14.2686 14.6282 14.6282 15.1343 15.1343 15.6387 15.6387 16.6971 16.6971 17.3189 17.3189 17.4777 17.4777 18.1156 18.1156 19.6881 19.6881 20.2526 20.2526 k = 0.3780 0.5000 0.2857 ( 3084 PWs) bands (ev): 2.9496 2.9496 7.5063 7.5063 7.6873 7.6873 8.7590 8.7590 9.2251 9.2251 9.7066 9.7066 9.9013 9.9013 9.9703 9.9703 10.6750 10.6750 10.7594 10.7594 10.8490 10.8490 11.2534 11.2534 11.5399 11.5399 11.7417 11.7417 12.0594 12.0594 12.1710 12.1710 12.3663 12.3663 12.7995 12.7995 12.8490 12.8490 12.9156 12.9156 13.3259 13.3259 13.5121 13.5121 13.7942 13.7942 13.8349 13.8349 13.9266 13.9266 14.2412 14.2412 14.6440 14.6440 15.1404 15.1404 15.7103 15.7103 16.6952 16.6952 17.2697 17.2697 17.4035 17.4035 17.9905 17.9905 19.7116 19.7116 20.3682 20.3682 k = 0.3902 0.5000 0.2857 ( 3088 PWs) bands (ev): 2.9627 2.9627 7.4976 7.4976 7.6598 7.6598 8.7575 8.7575 9.2985 9.2985 9.7031 9.7031 9.8838 9.8838 9.9566 9.9566 10.6399 10.6399 10.7553 10.7553 10.8421 10.8421 11.3096 11.3096 11.5867 11.5867 11.7675 11.7675 12.0716 12.0716 12.1899 12.1899 12.3912 12.3912 12.7907 12.7907 12.8418 12.8418 12.9166 12.9166 13.2936 13.2936 13.4522 13.4522 13.7927 13.7927 13.8368 13.8368 13.9218 13.9218 14.2120 14.2120 14.6584 14.6584 15.1445 15.1445 15.7852 15.7852 16.6925 16.6925 17.2273 17.2273 17.3377 17.3377 17.8681 17.8681 19.7329 19.7329 20.4820 20.4820 k = 0.4024 0.5000 0.2857 ( 3088 PWs) bands (ev): 2.9747 2.9747 7.4888 7.4888 7.6354 7.6354 8.7561 8.7561 9.3697 9.3697 9.6996 9.6996 9.8677 9.8677 9.9452 9.9452 10.6041 10.6041 10.7513 10.7513 10.8356 10.8356 11.3652 11.3652 11.6343 11.6343 11.7932 11.7932 12.0819 12.0819 12.2073 12.2073 12.4108 12.4108 12.7813 12.7813 12.8353 12.8353 12.9155 12.9155 13.2627 13.2627 13.3884 13.3884 13.7962 13.7962 13.8400 13.8400 13.9179 13.9179 14.1819 14.1819 14.6715 14.6715 15.1473 15.1473 15.8618 15.8618 16.6886 16.6886 17.1912 17.1912 17.2810 17.2810 17.7489 17.7489 19.7523 19.7523 20.5917 20.5917 k = 0.4146 0.5000 0.2857 ( 3092 PWs) bands (ev): 2.9856 2.9856 7.4801 7.4801 7.6144 7.6144 8.7549 8.7549 9.4377 9.4377 9.6963 9.6963 9.8539 9.8539 9.9358 9.9358 10.5677 10.5677 10.7477 10.7477 10.8296 10.8296 11.4190 11.4190 11.6823 11.6823 11.8187 11.8187 12.0899 12.0899 12.2230 12.2230 12.4236 12.4236 12.7717 12.7717 12.8303 12.8303 12.9122 12.9122 13.2294 13.2294 13.3308 13.3308 13.8015 13.8015 13.8434 13.8434 13.9148 13.9148 14.1521 14.1521 14.6830 14.6830 15.1495 15.1495 15.9387 15.9387 16.6836 16.6836 17.1608 17.1608 17.2337 17.2337 17.6332 17.6332 19.7698 19.7698 20.6962 20.6962 k = 0.4268 0.5000 0.2857 ( 3092 PWs) bands (ev): 2.9952 2.9952 7.4716 7.4716 7.5967 7.5967 8.7538 8.7538 9.5011 9.5011 9.6933 9.6933 9.8432 9.8432 9.9281 9.9281 10.5314 10.5314 10.7443 10.7443 10.8242 10.8242 11.4692 11.4692 11.7307 11.7307 11.8439 11.8439 12.0955 12.0955 12.2365 12.2365 12.4289 12.4289 12.7619 12.7619 12.8279 12.8279 12.9072 12.9072 13.1879 13.1879 13.2890 13.2890 13.8065 13.8065 13.8468 13.8468 13.9121 13.9121 14.1238 14.1238 14.6932 14.6932 15.1513 15.1513 16.0142 16.0142 16.6785 16.6785 17.1356 17.1356 17.1958 17.1958 17.5218 17.5218 19.7854 19.7854 20.7950 20.7950 k = 0.4390 0.5000 0.2857 ( 3096 PWs) bands (ev): 3.0035 3.0035 7.4635 7.4635 7.5823 7.5823 8.7529 8.7529 9.5577 9.5577 9.6908 9.6908 9.8366 9.8366 9.9218 9.9218 10.4957 10.4957 10.7414 10.7414 10.8196 10.8196 11.5140 11.5140 11.7795 11.7795 11.8684 11.8684 12.0979 12.0979 12.2468 12.2468 12.4276 12.4276 12.7518 12.7518 12.8287 12.8287 12.9009 12.9009 13.1393 13.1393 13.2644 13.2644 13.8103 13.8103 13.8504 13.8504 13.9094 13.9094 14.0982 14.0982 14.7018 14.7018 15.1528 15.1528 16.0863 16.0863 16.6748 16.6748 17.1150 17.1150 17.1665 17.1665 17.4156 17.4156 19.7990 19.7990 20.8872 20.8872 k = 0.4512 0.5000 0.2857 ( 3096 PWs) bands (ev): 3.0104 3.0104 7.4563 7.4563 7.5711 7.5711 8.7522 8.7522 9.6048 9.6048 9.6891 9.6891 9.8351 9.8351 9.9170 9.9170 10.4618 10.4618 10.7389 10.7389 10.8157 10.8157 11.5518 11.5518 11.8287 11.8287 11.8915 11.8915 12.0964 12.0964 12.2532 12.2532 12.4218 12.4218 12.7417 12.7417 12.8324 12.8324 12.8939 12.8939 13.0916 13.0916 13.2504 13.2504 13.8127 13.8127 13.8546 13.8546 13.9061 13.9061 14.0763 14.0763 14.7089 14.7089 15.1541 15.1541 16.1522 16.1522 16.6749 16.6749 17.0988 17.0988 17.1449 17.1449 17.3163 17.3163 19.8104 19.8104 20.9710 20.9710 k = 0.4634 0.5000 0.2857 ( 3096 PWs) bands (ev): 3.0158 3.0158 7.4501 7.4501 7.5627 7.5627 8.7517 8.7517 9.6396 9.6396 9.6887 9.6887 9.8392 9.8392 9.9135 9.9135 10.4312 10.4312 10.7370 10.7370 10.8127 10.8127 11.5814 11.5814 11.8771 11.8771 11.9129 11.9129 12.0896 12.0896 12.2551 12.2551 12.4142 12.4142 12.7325 12.7325 12.8378 12.8378 12.8865 12.8865 13.0511 13.0511 13.2422 13.2422 13.8139 13.8139 13.8597 13.8597 13.9016 13.9016 14.0590 14.0590 14.7144 14.7144 15.1551 15.1551 16.2086 16.2086 16.6809 16.6809 17.0865 17.0865 17.1295 17.1295 17.2264 17.2264 19.8195 19.8195 21.0432 21.0432 k = 0.4756 0.5000 0.2857 ( 3100 PWs) bands (ev): 3.0197 3.0197 7.4455 7.4455 7.5569 7.5569 8.7513 8.7513 9.6602 9.6602 9.6904 9.6904 9.8474 9.8474 9.9113 9.9113 10.4063 10.4063 10.7356 10.7356 10.8105 10.8105 11.6024 11.6024 11.9161 11.9161 11.9383 11.9383 12.0755 12.0755 12.2534 12.2534 12.4076 12.4076 12.7250 12.7250 12.8442 12.8442 12.8788 12.8788 13.0210 13.0210 13.2375 13.2375 13.8142 13.8142 13.8655 13.8655 13.8960 13.8960 14.0468 14.0468 14.7184 14.7184 15.1559 15.1559 16.2515 16.2515 16.6933 16.6933 17.0775 17.0775 17.1184 17.1184 17.1518 17.1518 19.8260 19.8260 21.0993 21.0993 k = 0.4878 0.5000 0.2857 ( 3096 PWs) bands (ev): 3.0220 3.0220 7.4426 7.4426 7.5535 7.5535 8.7510 8.7510 9.6687 9.6687 9.6937 9.6937 9.8554 9.8554 9.9103 9.9103 10.3897 10.3897 10.7347 10.7347 10.8092 10.8092 11.6148 11.6148 11.9316 11.9316 11.9783 11.9783 12.0530 12.0530 12.2505 12.2505 12.4034 12.4034 12.7201 12.7201 12.8510 12.8510 12.8711 12.8711 13.0027 13.0027 13.2350 13.2350 13.8142 13.8142 13.8717 13.8717 13.8898 13.8898 14.0396 14.0396 14.7208 14.7208 15.1563 15.1563 16.2781 16.2781 16.7077 16.7077 17.0706 17.0706 17.0953 17.0953 17.1173 17.1173 19.8301 19.8301 21.1349 21.1349 k = 0.5000 0.5000 0.2857 ( 3080 PWs) bands (ev): 3.0228 3.0228 7.4416 7.4416 7.5524 7.5524 8.7510 8.7510 9.6706 9.6706 9.6953 9.6953 9.8587 9.8587 9.9101 9.9101 10.3838 10.3838 10.7344 10.7344 10.8087 10.8087 11.6190 11.6190 11.9358 11.9358 12.0097 12.0097 12.0290 12.0290 12.2492 12.2492 12.4021 12.4021 12.7184 12.7184 12.8553 12.8553 12.8663 12.8663 12.9967 12.9967 13.2343 13.2343 13.8141 13.8141 13.8756 13.8756 13.8859 13.8859 14.0372 14.0372 14.7216 14.7216 15.1565 15.1565 16.2870 16.2870 16.7146 16.7146 17.0646 17.0646 17.0807 17.0807 17.1143 17.1143 19.8314 19.8314 21.1470 21.1470 k = 0.5000 0.5000 0.2857 ( 3080 PWs) bands (ev): 3.0228 3.0228 7.4416 7.4416 7.5524 7.5524 8.7510 8.7510 9.6706 9.6706 9.6953 9.6953 9.8587 9.8587 9.9101 9.9101 10.3838 10.3838 10.7344 10.7344 10.8087 10.8087 11.6190 11.6190 11.9358 11.9358 12.0097 12.0097 12.0290 12.0290 12.2492 12.2492 12.4021 12.4021 12.7184 12.7184 12.8553 12.8553 12.8663 12.8663 12.9967 12.9967 13.2343 13.2343 13.8141 13.8141 13.8756 13.8756 13.8859 13.8859 14.0372 14.0372 14.7216 14.7216 15.1565 15.1565 16.2870 16.2870 16.7146 16.7146 17.0646 17.0646 17.0807 17.0807 17.1143 17.1143 19.8314 19.8314 21.1470 21.1470 k = 0.4914 0.4914 0.2857 ( 3096 PWs) bands (ev): 3.0220 3.0220 7.4426 7.4426 7.5535 7.5535 8.7510 8.7510 9.6686 9.6686 9.6936 9.6936 9.8555 9.8555 9.9104 9.9104 10.3896 10.3896 10.7347 10.7347 10.8092 10.8092 11.6149 11.6149 11.9317 11.9317 11.9787 11.9787 12.0522 12.0522 12.2509 12.2509 12.4034 12.4034 12.7201 12.7201 12.8508 12.8508 12.8712 12.8712 13.0027 13.0027 13.2350 13.2350 13.8142 13.8142 13.8716 13.8716 13.8899 13.8899 14.0396 14.0396 14.7208 14.7208 15.1563 15.1563 16.2781 16.2781 16.7078 16.7078 17.0697 17.0697 17.0967 17.0967 17.1168 17.1168 19.8301 19.8301 21.1349 21.1349 k = 0.4828 0.4828 0.2857 ( 3092 PWs) bands (ev): 3.0197 3.0197 7.4455 7.4455 7.5569 7.5569 8.7512 8.7512 9.6595 9.6595 9.6901 9.6901 9.8485 9.8485 9.9116 9.9116 10.4059 10.4059 10.7355 10.7355 10.8106 10.8106 11.6027 11.6027 11.9179 11.9179 11.9385 11.9385 12.0684 12.0684 12.2589 12.2589 12.4078 12.4078 12.7251 12.7251 12.8429 12.8429 12.8799 12.8799 13.0204 13.0204 13.2373 13.2373 13.8142 13.8142 13.8645 13.8645 13.8973 13.8973 14.0467 14.0467 14.7184 14.7184 15.1559 15.1559 16.2518 16.2518 16.6936 16.6936 17.0726 17.0726 17.1237 17.1237 17.1507 17.1507 19.8260 19.8260 21.0994 21.0994 k = 0.4741 0.4741 0.2857 ( 3096 PWs) bands (ev): 3.0157 3.0157 7.4502 7.4502 7.5627 7.5627 8.7513 8.7513 9.6361 9.6361 9.6882 9.6882 9.8440 9.8440 9.9145 9.9145 10.4294 10.4294 10.7365 10.7365 10.8131 10.8131 11.5829 11.5829 11.8852 11.8852 11.9081 11.9081 12.0655 12.0655 12.2762 12.2762 12.4161 12.4161 12.7331 12.7331 12.8333 12.8333 12.8899 12.8899 13.0485 13.0485 13.2411 13.2411 13.8140 13.8140 13.8564 13.8564 13.9059 13.9059 14.0587 14.0587 14.7145 14.7145 15.1551 15.1551 16.2102 16.2102 16.6821 16.6821 17.0753 17.0753 17.1353 17.1353 17.2287 17.2287 19.8193 19.8193 21.0439 21.0439 k = 0.4655 0.4655 0.2857 ( 3100 PWs) bands (ev): 3.0102 3.0102 7.4564 7.4564 7.5711 7.5711 8.7510 8.7510 9.5961 9.5961 9.6886 9.6886 9.8468 9.8468 9.9195 9.9195 10.4570 10.4570 10.7376 10.7376 10.8169 10.8169 11.5561 11.5561 11.8418 11.8418 11.8809 11.8809 12.0465 12.0465 12.2986 12.2986 12.4301 12.4301 12.7437 12.7437 12.8220 12.8220 12.9013 12.9013 13.0845 13.0845 13.2469 13.2469 13.8134 13.8134 13.8479 13.8479 13.9152 13.9152 14.0758 14.0758 14.7091 14.7091 15.1540 15.1540 16.1566 16.1566 16.6779 16.6779 17.0793 17.0793 17.1512 17.1512 17.3213 17.3213 19.8097 19.8097 20.9730 20.9730 k = 0.4569 0.4569 0.2857 ( 3108 PWs) bands (ev): 3.0032 3.0032 7.4638 7.4638 7.5824 7.5824 8.7500 8.7500 9.5427 9.5427 9.6904 9.6904 9.8572 9.8572 9.9273 9.9273 10.4858 10.4858 10.7382 10.7382 10.8224 10.8224 11.5232 11.5232 11.7967 11.7967 11.8481 11.8481 12.0182 12.0182 12.3183 12.3183 12.4518 12.4518 12.7561 12.7561 12.8093 12.8093 12.9143 12.9143 13.1251 13.1251 13.2552 13.2552 13.8122 13.8122 13.8397 13.8397 13.9250 13.9250 14.0978 14.0978 14.7023 14.7023 15.1528 15.1528 16.0956 16.0956 16.6813 16.6813 17.0848 17.0848 17.1712 17.1712 17.4234 17.4234 19.7973 19.7973 20.8910 20.8910 k = 0.4483 0.4483 0.2857 ( 3108 PWs) bands (ev): 2.9946 2.9946 7.4721 7.4721 7.5969 7.5969 8.7474 8.7474 9.4804 9.4804 9.6932 9.6932 9.8727 9.8727 9.9391 9.9391 10.5138 10.5138 10.7381 10.7381 10.8296 10.8296 11.4855 11.4855 11.7506 11.7506 11.8096 11.8096 11.9863 11.9863 12.3303 12.3303 12.4812 12.4812 12.7695 12.7695 12.7963 12.7963 12.9294 12.9294 13.1656 13.1656 13.2680 13.2680 13.8100 13.8100 13.8331 13.8331 13.9350 13.9350 14.1244 14.1244 14.6942 14.6942 15.1513 15.1513 16.0310 16.0310 16.6908 16.6908 17.0921 17.0921 17.1956 17.1956 17.5321 17.5321 19.7820 19.7820 20.8006 20.8006 k = 0.4397 0.4397 0.2857 ( 3106 PWs) bands (ev): 2.9845 2.9845 7.4811 7.4811 7.6147 7.6147 8.7425 8.7425 9.4130 9.4130 9.6965 9.6965 9.8896 9.8896 9.9573 9.9573 10.5398 10.5398 10.7370 10.7370 10.8387 10.8387 11.4441 11.4441 11.7026 11.7026 11.7668 11.7668 11.9538 11.9538 12.3342 12.3342 12.5145 12.5145 12.7792 12.7792 12.7885 12.7885 12.9467 12.9467 13.1997 13.1997 13.2893 13.2893 13.8060 13.8060 13.8302 13.8302 13.9451 13.9451 14.1549 14.1549 14.6849 14.6849 15.1498 15.1498 15.9662 15.9662 16.7047 16.7047 17.1012 17.1012 17.2244 17.2244 17.6455 17.6455 19.7639 19.7639 20.7030 20.7030 k = 0.4310 0.4310 0.2857 ( 3106 PWs) bands (ev): 2.9729 2.9729 7.4905 7.4905 7.6361 7.6361 8.7337 8.7337 9.3438 9.3438 9.7005 9.7005 9.9047 9.9047 9.9841 9.9841 10.5631 10.5631 10.7347 10.7347 10.8497 10.8497 11.4003 11.4003 11.6518 11.6518 11.7222 11.7222 11.9222 11.9222 12.3308 12.3308 12.5466 12.5466 12.7729 12.7729 12.7999 12.7999 12.9658 12.9658 13.2223 13.2223 13.3221 13.3221 13.7999 13.7999 13.8326 13.8326 13.9552 13.9552 14.1884 14.1884 14.6747 14.6747 15.1483 15.1483 15.9037 15.9037 16.7216 16.7216 17.1119 17.1119 17.2576 17.2576 17.7624 17.7624 19.7429 19.7429 20.5993 20.5993 k = 0.4224 0.4224 0.2857 ( 3102 PWs) bands (ev): 2.9598 2.9598 7.5003 7.5003 7.6609 7.6609 8.7193 8.7193 9.2760 9.2760 9.7049 9.7049 9.9173 9.9173 10.0195 10.0195 10.5830 10.5830 10.7312 10.7312 10.8625 10.8625 11.3552 11.3552 11.5971 11.5971 11.6782 11.6782 11.8918 11.8918 12.3209 12.3209 12.5720 12.5720 12.7706 12.7706 12.8138 12.8138 12.9865 12.9865 13.2350 13.2350 13.3628 13.3628 13.7929 13.7929 13.8408 13.8408 13.9657 13.9657 14.2237 14.2237 14.6637 14.6637 15.1470 15.1470 15.8455 15.8455 16.7403 16.7403 17.1243 17.1243 17.2952 17.2952 17.8814 17.8814 19.7193 19.7193 20.4914 20.4914 k = 0.4138 0.4138 0.2857 ( 3094 PWs) bands (ev): 2.9453 2.9453 7.5104 7.5104 7.6890 7.6890 8.6969 8.6969 9.2125 9.2125 9.7099 9.7099 9.9280 9.9280 10.0623 10.0623 10.5994 10.5994 10.7262 10.7262 10.8769 10.8769 11.3096 11.3096 11.5389 11.5389 11.6367 11.6367 11.8627 11.8627 12.3044 12.3044 12.5863 12.5863 12.7773 12.7773 12.8281 12.8281 13.0082 13.0082 13.2419 13.2419 13.4058 13.4058 13.7858 13.7858 13.8553 13.8553 13.9771 13.9771 14.2599 14.2599 14.6522 14.6522 15.1461 15.1461 15.7935 15.7935 16.7599 16.7599 17.1382 17.1382 17.3368 17.3368 18.0013 18.0013 19.6936 19.6936 20.3815 20.3815 k = 0.4052 0.4052 0.2857 ( 3082 PWs) bands (ev): 2.9293 2.9293 7.5209 7.5209 7.7203 7.7203 8.6642 8.6642 9.1563 9.1563 9.7154 9.7154 9.9378 9.9378 10.1110 10.1110 10.6123 10.6123 10.7197 10.7197 10.8926 10.8926 11.2647 11.2647 11.4779 11.4779 11.5983 11.5983 11.8347 11.8347 12.2813 12.2813 12.5887 12.5887 12.7912 12.7912 12.8442 12.8442 13.0300 13.0300 13.2452 13.2452 13.4478 13.4478 13.7790 13.7790 13.8762 13.8762 13.9900 13.9900 14.2958 14.2958 14.6404 14.6404 15.1462 15.1462 15.7489 15.7489 16.7799 16.7799 17.1535 17.1535 17.3820 17.3820 18.1206 18.1206 19.6665 19.6665 20.2723 20.2723 k = 0.3966 0.3966 0.2857 ( 3078 PWs) bands (ev): 2.9119 2.9119 7.5319 7.5319 7.7546 7.7546 8.6192 8.6192 9.1094 9.1094 9.7215 9.7215 9.9469 9.9469 10.1648 10.1648 10.6218 10.6218 10.7117 10.7117 10.9088 10.9088 11.2215 11.2215 11.4155 11.4155 11.5634 11.5634 11.8079 11.8079 12.2516 12.2516 12.5821 12.5821 12.8060 12.8060 12.8649 12.8649 13.0513 13.0513 13.2456 13.2456 13.4874 13.4874 13.7729 13.7729 13.9027 13.9027 14.0058 14.0058 14.3304 14.3304 14.6286 14.6286 15.1476 15.1476 15.7129 15.7129 16.7998 16.7998 17.1702 17.1702 17.4299 17.4299 18.2373 18.2373 19.6390 19.6390 20.1659 20.1659 k = 0.3879 0.3879 0.2857 ( 3080 PWs) bands (ev): 2.8932 2.8932 7.5434 7.5434 7.7914 7.7914 8.5619 8.5619 9.0721 9.0721 9.7284 9.7284 9.9556 9.9556 10.2229 10.2229 10.6281 10.6281 10.7019 10.7019 10.9245 10.9245 11.1814 11.1814 11.3531 11.3531 11.5322 11.5322 11.7822 11.7822 12.2154 12.2154 12.5698 12.5698 12.8161 12.8161 12.8913 12.8913 13.0713 13.0713 13.2437 13.2437 13.5237 13.5237 13.7679 13.7679 13.9328 13.9328 14.0266 14.0266 14.3628 14.3628 14.6172 14.6172 15.1511 15.1511 15.6864 15.6864 16.8196 16.8196 17.1881 17.1881 17.4794 17.4794 18.3491 18.3491 19.6129 19.6129 20.0645 20.0645 k = 0.3793 0.3793 0.2857 ( 3080 PWs) bands (ev): 2.8732 2.8732 7.5555 7.5555 7.8305 7.8305 8.4937 8.4937 9.0430 9.0430 9.7362 9.7362 9.9638 9.9638 10.2845 10.2845 10.6316 10.6316 10.6904 10.6904 10.9373 10.9373 11.1468 11.1468 11.2920 11.2920 11.5049 11.5049 11.7578 11.7578 12.1734 12.1734 12.5538 12.5538 12.8210 12.8210 12.9208 12.9208 13.0891 13.0891 13.2405 13.2405 13.5565 13.5565 13.7645 13.7645 13.9629 13.9629 14.0554 14.0554 14.3926 14.3926 14.6066 14.6066 15.1574 15.1574 15.6696 15.6696 16.8390 16.8390 17.2072 17.2072 17.5291 17.5291 18.4529 18.4529 19.5901 19.5901 19.9700 19.9700 k = 0.3707 0.3707 0.2857 ( 3086 PWs) bands (ev): 2.8519 2.8519 7.5682 7.5682 7.8713 7.8713 8.4172 8.4172 9.0196 9.0196 9.7452 9.7452 9.9714 9.9714 10.3487 10.3487 10.6323 10.6323 10.6771 10.6771 10.9436 10.9436 11.1209 11.1209 11.2339 11.2339 11.4820 11.4820 11.7348 11.7348 12.1261 12.1261 12.5351 12.5351 12.8215 12.8215 12.9502 12.9502 13.1033 13.1033 13.2380 13.2380 13.5854 13.5854 13.7633 13.7633 13.9904 13.9904 14.0940 14.0940 14.4194 14.4194 14.5974 14.5974 15.1669 15.1669 15.6628 15.6628 16.8582 16.8582 17.2273 17.2273 17.5776 17.5776 18.5450 18.5450 19.5729 19.5729 19.8848 19.8848 k = 0.3621 0.3621 0.2857 ( 3086 PWs) bands (ev): 2.8294 2.8294 7.5815 7.5815 7.9130 7.9130 8.3352 8.3352 8.9994 8.9994 9.7556 9.7556 9.9784 9.9784 10.4140 10.4140 10.6305 10.6305 10.6622 10.6622 10.9391 10.9391 11.1063 11.1063 11.1819 11.1819 11.4637 11.4637 11.7136 11.7136 12.0743 12.0743 12.5142 12.5142 12.8185 12.8185 12.9757 12.9757 13.1131 13.1131 13.2386 13.2386 13.6100 13.6100 13.7647 13.7647 14.0156 14.0156 14.1412 14.1412 14.4432 14.4432 14.5899 14.5899 15.1801 15.1801 15.6655 15.6655 16.8772 16.8772 17.2483 17.2483 17.6227 17.6227 18.6216 18.6216 19.5634 19.5634 19.8114 19.8114 k = 0.3534 0.3534 0.2857 ( 3088 PWs) bands (ev): 2.8058 2.8058 7.5955 7.5955 7.9539 7.9539 8.2513 8.2513 8.9801 8.9801 9.7678 9.7678 9.9846 9.9846 10.4779 10.4779 10.6264 10.6264 10.6468 10.6468 10.9233 10.9233 11.0945 11.0945 11.1466 11.1466 11.4505 11.4505 11.6943 11.6943 12.0189 12.0189 12.4912 12.4912 12.8123 12.8123 12.9918 12.9918 13.1212 13.1212 13.2443 13.2443 13.6304 13.6304 13.7690 13.7690 14.0402 14.0402 14.1943 14.1943 14.4644 14.4644 14.5850 14.5850 15.1969 15.1969 15.6775 15.6775 16.8959 16.8959 17.2703 17.2703 17.6626 17.6626 18.6793 18.6793 19.5614 19.5614 19.7537 19.7537 k = 0.3448 0.3448 0.2857 ( 3088 PWs) bands (ev): 2.7810 2.7810 7.6101 7.6101 7.9881 7.9881 8.1724 8.1724 8.9603 8.9603 9.7820 9.7820 9.9898 9.9898 10.5331 10.5331 10.6211 10.6211 10.6337 10.6337 10.9009 10.9009 11.0668 11.0668 11.1442 11.1442 11.4429 11.4429 11.6775 11.6775 11.9608 11.9608 12.4663 12.4663 12.8034 12.8034 12.9917 12.9917 13.1351 13.1351 13.2543 13.2543 13.6473 13.6473 13.7757 13.7757 14.0654 14.0654 14.2507 14.2507 14.4830 14.4830 14.5835 14.5835 15.2171 15.2171 15.6981 15.6981 16.9145 16.9145 17.2929 17.2929 17.6949 17.6949 18.7168 18.7168 19.5625 19.5625 19.7182 19.7182 k = 0.3362 0.3362 0.2857 ( 3086 PWs) bands (ev): 2.7553 2.7553 7.6251 7.6251 7.9898 7.9898 8.1255 8.1255 8.9386 8.9386 9.7983 9.7983 9.9939 9.9939 10.5575 10.5575 10.6178 10.6178 10.6370 10.6370 10.8789 10.8789 11.0364 11.0364 11.1584 11.1584 11.4414 11.4414 11.6637 11.6637 11.9015 11.9015 12.4398 12.4398 12.7919 12.7919 12.9738 12.9738 13.1586 13.1586 13.2662 13.2662 13.6621 13.6621 13.7843 13.7843 14.0913 14.0913 14.3087 14.3087 14.4993 14.4993 14.5868 14.5868 15.2402 15.2402 15.7267 15.7267 16.9330 16.9330 17.3162 17.3162 17.7177 17.7177 18.7356 18.7356 19.5598 19.5598 19.7108 19.7108 k = 0.3276 0.3276 0.2857 ( 3090 PWs) bands (ev): 2.7285 2.7285 7.6399 7.6399 7.9311 7.9311 8.1393 8.1393 8.9144 8.9144 9.8168 9.8168 9.9969 9.9969 10.5445 10.5445 10.6090 10.6090 10.6614 10.6614 10.8667 10.8667 11.0143 11.0143 11.1766 11.1766 11.4466 11.4466 11.6534 11.6534 11.8427 11.8427 12.4116 12.4116 12.7776 12.7776 12.9434 12.9434 13.1894 13.1894 13.2778 13.2778 13.6762 13.6762 13.7941 13.7941 14.1174 14.1174 14.3667 14.3667 14.5130 14.5130 14.5962 14.5962 15.2657 15.2657 15.7626 15.7626 16.9514 16.9514 17.3400 17.3400 17.7297 17.7297 18.7390 18.7390 19.5546 19.5546 19.7279 19.7279 k = 0.3190 0.3190 0.2857 ( 3086 PWs) bands (ev): 2.7009 2.7009 7.6529 7.6529 7.8497 7.8497 8.1780 8.1780 8.8873 8.8873 9.8375 9.8375 9.9987 9.9987 10.5182 10.5182 10.5985 10.5985 10.6685 10.6685 10.8726 10.8726 11.0042 11.0042 11.1943 11.1943 11.4587 11.4587 11.6465 11.6465 11.7876 11.7876 12.3820 12.3820 12.7607 12.7607 12.9061 12.9061 13.2243 13.2243 13.2880 13.2880 13.6904 13.6904 13.8050 13.8050 14.1429 14.1429 14.4224 14.4224 14.5252 14.5252 14.6127 14.6127 15.2932 15.2932 15.8049 15.8049 16.9694 16.9694 17.3639 17.3639 17.7303 17.7303 18.7306 18.7306 19.5552 19.5552 19.7584 19.7584 k = 0.3103 0.3103 0.2857 ( 3078 PWs) bands (ev): 2.6725 2.6725 7.6565 7.6565 7.7724 7.7724 8.2223 8.2223 8.8572 8.8572 9.8600 9.8600 9.9994 9.9994 10.4868 10.4868 10.5868 10.5868 10.6527 10.6527 10.8904 10.8904 11.0085 11.0085 11.2086 11.2086 11.4772 11.4772 11.6403 11.6403 11.7436 11.7436 12.3507 12.3507 12.7406 12.7406 12.8664 12.8664 13.2594 13.2594 13.2982 13.2982 13.7049 13.7049 13.8175 13.8175 14.1671 14.1671 14.4715 14.4715 14.5403 14.5403 14.6360 14.6360 15.3221 15.3221 15.8529 15.8529 16.9870 16.9870 17.3878 17.3878 17.7202 17.7202 18.7136 18.7136 19.5674 19.5674 19.7941 19.7941 k = 0.3017 0.3017 0.2857 ( 3086 PWs) bands (ev): 2.6434 2.6434 7.6197 7.6197 7.7344 7.7344 8.2676 8.2676 8.8243 8.8243 9.8834 9.8834 9.9994 9.9994 10.4528 10.4528 10.5737 10.5737 10.6250 10.6250 10.9061 10.9061 11.0266 11.0266 11.2169 11.2169 11.5003 11.5003 11.6254 11.6254 11.7266 11.7266 12.3178 12.3178 12.7169 12.7169 12.8280 12.8280 13.2824 13.2824 13.3197 13.3197 13.7188 13.7188 13.8328 13.8328 14.1891 14.1891 14.5047 14.5047 14.5677 14.5677 14.6654 14.6654 15.3523 15.3523 15.9058 15.9058 17.0039 17.0039 17.4109 17.4109 17.7016 17.7016 18.6900 18.6900 19.5932 19.5932 19.8314 19.8314 k = 0.2931 0.2931 0.2857 ( 3084 PWs) bands (ev): 2.6136 2.6136 7.5410 7.5410 7.7389 7.7389 8.3122 8.3122 8.7889 8.7889 9.9062 9.9062 9.9999 9.9999 10.4174 10.4174 10.5589 10.5589 10.5939 10.5939 10.9162 10.9162 11.0512 11.0512 11.2159 11.2159 11.5235 11.5235 11.6030 11.6030 11.7438 11.7438 12.2833 12.2833 12.6895 12.6895 12.7939 12.7939 13.2872 13.2872 13.3581 13.3581 13.7310 13.7310 13.8522 13.8522 14.2085 14.2085 14.5216 14.5216 14.6079 14.6079 14.6998 14.6998 15.3835 15.3835 15.9628 15.9628 17.0198 17.0198 17.4323 17.4323 17.6780 17.6780 18.6611 18.6611 19.6325 19.6325 19.8689 19.8689 k = 0.2845 0.2845 0.2857 ( 3084 PWs) bands (ev): 2.5832 2.5832 7.4520 7.4520 7.7550 7.7550 8.3546 8.3546 8.7519 8.7519 9.9249 9.9249 10.0035 10.0035 10.3817 10.3817 10.5412 10.5412 10.5652 10.5652 10.9230 10.9230 11.0741 11.0741 11.2032 11.2032 11.5365 11.5365 11.5956 11.5956 11.7855 11.7855 12.2476 12.2476 12.6597 12.6597 12.7656 12.7656 13.2852 13.2852 13.4021 13.4021 13.7405 13.7405 13.8765 13.8765 14.2248 14.2248 14.5329 14.5329 14.6508 14.6508 14.7380 14.7380 15.4153 15.4153 16.0232 16.0232 17.0340 17.0340 17.4502 17.4502 17.6541 17.6541 18.6280 18.6280 19.6839 19.6839 19.9065 19.9065 k = 0.2759 0.2759 0.2857 ( 3084 PWs) bands (ev): 2.5524 2.5524 7.3609 7.3609 7.7744 7.7744 8.3934 8.3934 8.7143 8.7143 9.9344 9.9344 10.0145 10.0145 10.3468 10.3468 10.5191 10.5191 10.5424 10.5424 10.9270 10.9270 11.0914 11.0914 11.1795 11.1795 11.5346 11.5346 11.6145 11.6145 11.8425 11.8425 12.2123 12.2123 12.6298 12.6298 12.7435 12.7435 13.2799 13.2799 13.4484 13.4484 13.7472 13.7472 13.9057 13.9057 14.2380 14.2380 14.5437 14.5437 14.6922 14.6922 14.7778 14.7778 15.4476 15.4476 16.0863 16.0863 17.0461 17.0461 17.4617 17.4617 17.6361 17.6361 18.5915 18.5915 19.7449 19.7449 19.9446 19.9446 k = 0.2672 0.2672 0.2857 ( 3086 PWs) bands (ev): 2.5213 2.5213 7.2700 7.2700 7.7955 7.7955 8.4264 8.4264 8.6780 8.6780 9.9330 9.9330 10.0330 10.0330 10.3138 10.3138 10.4959 10.4959 10.5242 10.5242 10.9263 10.9263 11.1006 11.1006 11.1514 11.1514 11.5327 11.5327 11.6453 11.6453 11.9049 11.9049 12.1821 12.1821 12.6023 12.6023 12.7277 12.7277 13.2722 13.2722 13.4960 13.4960 13.7513 13.7513 13.9391 13.9391 14.2482 14.2482 14.5555 14.5555 14.7318 14.7318 14.8168 14.8168 15.4800 15.4800 16.1517 16.1517 17.0552 17.0552 17.4642 17.4642 17.6298 17.6298 18.5523 18.5523 19.8133 19.8133 19.9836 19.9836 k = 0.2586 0.2586 0.2857 ( 3086 PWs) bands (ev): 2.4898 2.4898 7.1799 7.1799 7.8177 7.8177 8.4496 8.4496 8.6470 8.6470 9.9238 9.9238 10.0543 10.0543 10.2843 10.2843 10.4756 10.4756 10.5078 10.5078 10.9158 10.9158 11.0964 11.0964 11.1334 11.1334 11.5355 11.5355 11.6803 11.6803 11.9558 11.9558 12.1694 12.1694 12.5790 12.5790 12.7192 12.7192 13.2630 13.2630 13.5443 13.5443 13.7537 13.7537 13.9759 13.9759 14.2553 14.2553 14.5689 14.5689 14.7699 14.7699 14.8528 14.8528 15.5123 15.5123 16.2188 16.2188 17.0610 17.0610 17.4593 17.4593 17.6366 17.6366 18.5110 18.5110 19.8861 19.8861 20.0242 20.0242 k = 0.2500 0.2500 0.2857 ( 3094 PWs) bands (ev): 2.4582 2.4582 7.0911 7.0911 7.8406 7.8406 8.4566 8.4566 8.6276 8.6276 9.9091 9.9091 10.0730 10.0730 10.2606 10.2606 10.4600 10.4600 10.4928 10.4928 10.8897 10.8897 11.0847 11.0847 11.1298 11.1298 11.5417 11.5417 11.7177 11.7177 11.9719 11.9719 12.1929 12.1929 12.5606 12.5606 12.7211 12.7211 13.2525 13.2525 13.5925 13.5925 13.7551 13.7551 14.0154 14.0154 14.2599 14.2599 14.5843 14.5843 14.8070 14.8070 14.8839 14.8839 15.5442 15.5442 16.2872 16.2872 17.0633 17.0633 17.4525 17.4525 17.6530 17.6530 18.4684 18.4684 19.9607 19.9607 20.0666 20.0666 k = 0.2414 0.2414 0.2857 ( 3098 PWs) bands (ev): 2.4265 2.4265 7.0039 7.0039 7.8641 7.8641 8.4428 8.4428 8.6241 8.6241 9.8901 9.8901 10.0842 10.0842 10.2454 10.2454 10.4490 10.4490 10.4807 10.4807 10.8476 10.8476 11.0803 11.0803 11.1292 11.1292 11.5494 11.5494 11.7562 11.7562 11.9559 11.9559 12.2449 12.2449 12.5474 12.5474 12.7379 12.7379 13.2412 13.2412 13.6392 13.6392 13.7570 13.7570 14.0569 14.0569 14.2621 14.2621 14.6016 14.6016 14.8434 14.8434 14.9088 14.9088 15.5753 15.5753 16.3564 16.3564 17.0631 17.0631 17.4489 17.4489 17.6750 17.6750 18.4249 18.4249 20.0342 20.0342 20.1111 20.1111 k = 0.2328 0.2328 0.2857 ( 3098 PWs) bands (ev): 2.3948 2.3948 6.9184 6.9184 7.8880 7.8880 8.4128 8.4128 8.6322 8.6322 9.8672 9.8672 10.0848 10.0848 10.2406 10.2406 10.4396 10.4396 10.4753 10.4753 10.7945 10.7945 11.0832 11.0832 11.1286 11.1286 11.5565 11.5565 11.7954 11.7954 11.9286 11.9286 12.2995 12.2995 12.5393 12.5393 12.7756 12.7756 13.2295 13.2295 13.6809 13.6809 13.7624 13.7624 14.1000 14.1000 14.2624 14.2624 14.6210 14.6210 14.8789 14.8789 14.9265 14.9265 15.6055 15.6055 16.4262 16.4262 17.0622 17.0622 17.4508 17.4508 17.7001 17.7001 18.3810 18.3810 20.1041 20.1041 20.1574 20.1574 k = 0.2241 0.2241 0.2857 ( 3098 PWs) bands (ev): 2.3632 2.3632 6.8349 6.8349 7.9121 7.9121 8.3741 8.3741 8.6444 8.6444 9.8408 9.8408 10.0758 10.0758 10.2440 10.2440 10.4289 10.4289 10.4804 10.4804 10.7361 10.7361 11.0887 11.0887 11.1284 11.1284 11.5612 11.5612 11.8347 11.8347 11.9020 11.9020 12.3419 12.3419 12.5363 12.5363 12.8379 12.8379 13.2179 13.2179 13.7091 13.7091 13.7796 13.7796 14.1444 14.1444 14.2612 14.2612 14.6424 14.6424 14.9111 14.9111 14.9390 14.9390 15.6345 15.6345 16.4963 16.4963 17.0628 17.0628 17.4585 17.4585 17.7266 17.7266 18.3371 18.3371 20.1686 20.1686 20.2044 20.2044 k = 0.2155 0.2155 0.2857 ( 3098 PWs) bands (ev): 2.3318 2.3318 6.7535 6.7535 7.9363 7.9363 8.3316 8.3316 8.6561 8.6561 9.8111 9.8111 10.0611 10.0611 10.2509 10.2509 10.4179 10.4179 10.4947 10.4947 10.6760 10.6760 11.0922 11.0922 11.1305 11.1305 11.5626 11.5626 11.8733 11.8733 11.8815 11.8815 12.3690 12.3690 12.5385 12.5385 12.9227 12.9227 13.2069 13.2069 13.7192 13.7192 13.8127 13.8127 14.1898 14.1898 14.2588 14.2588 14.6657 14.6657 14.9241 14.9241 14.9616 14.9616 15.6623 15.6623 16.5664 16.5664 17.0671 17.0671 17.4715 17.4715 17.7537 17.7537 18.2937 18.2937 20.2260 20.2260 20.2506 20.2506 k = 0.2069 0.2069 0.2857 ( 3100 PWs) bands (ev): 2.3007 2.3007 6.6744 6.6744 7.9602 7.9602 8.2877 8.2877 8.6654 8.6654 9.7787 9.7787 10.0436 10.0436 10.2575 10.2575 10.4093 10.4093 10.5135 10.5135 10.6180 10.6180 11.0911 11.0911 11.1356 11.1356 11.5612 11.5612 11.8669 11.8669 11.9131 11.9131 12.3842 12.3842 12.5457 12.5457 13.0225 13.0225 13.1986 13.1986 13.7201 13.7201 13.8526 13.8526 14.2357 14.2357 14.2557 14.2557 14.6910 14.6910 14.9156 14.9156 14.9972 14.9972 15.6891 15.6891 16.6362 16.6362 17.0771 17.0771 17.4886 17.4886 17.7808 17.7808 18.2514 18.2514 20.2698 20.2698 20.2996 20.2996 k = 0.1983 0.1983 0.2857 ( 3104 PWs) bands (ev): 2.2701 2.2701 6.5976 6.5976 7.9834 7.9834 8.2439 8.2439 8.6715 8.6715 9.7439 9.7439 10.0253 10.0253 10.2607 10.2607 10.4053 10.4053 10.5195 10.5195 10.5783 10.5783 11.0860 11.0860 11.1422 11.1422 11.5593 11.5593 11.8595 11.8595 11.9519 11.9519 12.3924 12.3924 12.5574 12.5574 13.1185 13.1185 13.2055 13.2055 13.7179 13.7179 13.8928 13.8928 14.2512 14.2512 14.2831 14.2831 14.7180 14.7180 14.8954 14.8954 15.0366 15.0366 15.7148 15.7148 16.7055 16.7055 17.0936 17.0936 17.5089 17.5089 17.8072 17.8072 18.2106 18.2106 20.2943 20.2943 20.3545 20.3545 k = 0.1897 0.1897 0.2857 ( 3096 PWs) bands (ev): 2.2399 2.2399 6.5233 6.5233 8.0052 8.0052 8.2017 8.2017 8.6743 8.6743 9.7073 9.7073 10.0068 10.0068 10.2588 10.2588 10.4077 10.4077 10.4793 10.4793 10.5885 10.5885 11.0780 11.0780 11.1489 11.1489 11.5598 11.5598 11.8563 11.8563 11.9907 11.9907 12.3973 12.3973 12.5731 12.5731 13.1503 13.1503 13.2829 13.2829 13.7147 13.7147 13.9313 13.9313 14.2469 14.2469 14.3303 14.3303 14.7461 14.7461 14.8661 14.8661 15.0789 15.0789 15.7397 15.7397 16.7740 16.7740 17.1172 17.1172 17.5316 17.5316 17.8324 17.8324 18.1721 18.1721 20.3020 20.3020 20.4118 20.4118 k = 0.1810 0.1810 0.2857 ( 3096 PWs) bands (ev): 2.2103 2.2103 6.4516 6.4516 8.0233 8.0233 8.1634 8.1634 8.6738 8.6738 9.6693 9.6693 9.9885 9.9885 10.2514 10.2514 10.4150 10.4150 10.4270 10.4270 10.6146 10.6146 11.0682 11.0682 11.1555 11.1555 11.5651 11.5651 11.8551 11.8551 12.0296 12.0296 12.4010 12.4010 12.5924 12.5924 13.1467 13.1467 13.3970 13.3970 13.7122 13.7122 13.9673 13.9673 14.2422 14.2422 14.3781 14.3781 14.7713 14.7713 14.8328 14.8328 15.1245 15.1245 15.7639 15.7639 16.8416 16.8416 17.1474 17.1474 17.5562 17.5562 17.8555 17.8555 18.1368 18.1368 20.2939 20.2939 20.4700 20.4700 k = 0.1724 0.1724 0.2857 ( 3104 PWs) bands (ev): 2.1815 2.1815 6.3825 6.3825 8.0321 8.0321 8.1353 8.1353 8.6704 8.6704 9.6304 9.6304 9.9703 9.9703 10.2396 10.2396 10.3708 10.3708 10.4313 10.4313 10.6415 10.6415 11.0575 11.0575 11.1628 11.1628 11.5766 11.5766 11.8540 11.8540 12.0685 12.0685 12.4045 12.4045 12.6149 12.6149 13.1390 13.1390 13.5098 13.5098 13.7138 13.7138 14.0017 14.0017 14.2371 14.2371 14.4261 14.4261 14.7629 14.7629 14.8276 14.8276 15.1739 15.1739 15.7875 15.7875 16.9080 16.9080 17.1836 17.1836 17.5821 17.5821 17.8756 17.8756 18.1062 18.1062 20.2715 20.2715 20.5282 20.5282 k = 0.1638 0.1638 0.2857 ( 3104 PWs) bands (ev): 2.1534 2.1534 6.3163 6.3163 8.0215 8.0215 8.1273 8.1273 8.6646 8.6646 9.5909 9.5909 9.9524 9.9524 10.2248 10.2248 10.3191 10.3191 10.4477 10.4477 10.6657 10.6657 11.0471 11.0471 11.1724 11.1724 11.5944 11.5944 11.8521 11.8521 12.1074 12.1074 12.4083 12.4083 12.6401 12.6401 13.1312 13.1312 13.6010 13.6010 13.7316 13.7316 14.0363 14.0363 14.2315 14.2315 14.4741 14.4741 14.7155 14.7155 14.8578 14.8578 15.2275 15.2275 15.8105 15.8105 16.9730 16.9730 17.2246 17.2246 17.6090 17.6090 17.8912 17.8912 18.0819 18.0819 20.2370 20.2370 20.5857 20.5857 k = 0.1552 0.1552 0.2857 ( 3104 PWs) bands (ev): 2.1261 2.1261 6.2529 6.2529 7.9939 7.9939 8.1371 8.1371 8.6568 8.6568 9.5512 9.5512 9.9346 9.9346 10.2082 10.2082 10.2701 10.2701 10.4644 10.4644 10.6862 10.6862 11.0382 11.0382 11.1859 11.1859 11.6178 11.6178 11.8488 11.8488 12.1461 12.1461 12.4122 12.4122 12.6677 12.6677 13.1243 13.1243 13.6418 13.6418 13.7869 13.7869 14.0755 14.0755 14.2252 14.2252 14.5215 14.5215 14.6588 14.6588 14.8961 14.8961 15.2854 15.2854 15.8329 15.8329 17.0363 17.0363 17.2689 17.2689 17.6366 17.6366 17.9012 17.9012 18.0660 18.0660 20.1927 20.1927 20.6413 20.6413 k = 0.1466 0.1466 0.2857 ( 3108 PWs) bands (ev): 2.0998 2.0998 6.1924 6.1924 7.9598 7.9598 8.1543 8.1543 8.6474 8.6474 9.5115 9.5115 9.9170 9.9170 10.1903 10.1903 10.2244 10.2244 10.4790 10.4790 10.7031 10.7031 11.0317 11.0317 11.2044 11.2044 11.6460 11.6460 11.8444 11.8444 12.1844 12.1844 12.4159 12.4159 12.6971 12.6971 13.1191 13.1191 13.6485 13.6485 13.8544 13.8544 14.1250 14.1250 14.2182 14.2182 14.5660 14.5660 14.6004 14.6004 14.9402 14.9402 15.3476 15.3476 15.8547 15.8547 17.0975 17.0975 17.3152 17.3152 17.6645 17.6645 17.9054 17.9054 18.0596 18.0596 20.1409 20.1409 20.6939 20.6939 k = 0.1379 0.1379 0.2857 ( 3112 PWs) bands (ev): 2.0746 2.0746 6.1350 6.1350 7.9245 7.9245 8.1737 8.1737 8.6371 8.6371 9.4722 9.4722 9.8994 9.8994 10.1710 10.1710 10.1828 10.1828 10.4891 10.4891 10.7178 10.7178 11.0275 11.0275 11.2289 11.2289 11.6778 11.6778 11.8394 11.8394 12.2218 12.2218 12.4191 12.4191 12.7277 12.7277 13.1159 13.1159 13.6454 13.6454 13.9038 13.9038 14.1781 14.1781 14.2198 14.2198 14.5351 14.5351 14.6149 14.6149 14.9913 14.9913 15.4136 15.4136 15.8758 15.8758 17.1559 17.1559 17.3616 17.3616 17.6925 17.6925 17.9065 17.9065 18.0614 18.0614 20.0839 20.0839 20.7417 20.7417 k = 0.1293 0.1293 0.2857 ( 3108 PWs) bands (ev): 2.0505 2.0505 6.0807 6.0807 7.8897 7.8897 8.1935 8.1935 8.6262 8.6262 9.4336 9.4336 9.8819 9.8819 10.1407 10.1407 10.1555 10.1555 10.4931 10.4931 10.7322 10.7322 11.0253 11.0253 11.2591 11.2591 11.7119 11.7119 11.8345 11.8345 12.2579 12.2579 12.4215 12.4215 12.7585 12.7585 13.1155 13.1155 13.6389 13.6389 13.9321 13.9321 14.1813 14.1813 14.2749 14.2749 14.4784 14.4784 14.6563 14.6563 15.0514 15.0514 15.4830 15.4830 15.8962 15.8962 17.2106 17.2106 17.4068 17.4068 17.7202 17.7202 17.9090 17.9090 18.0684 18.0684 20.0233 20.0233 20.7831 20.7831 k = 0.1207 0.1207 0.2857 ( 3116 PWs) bands (ev): 2.0275 2.0275 6.0296 6.0296 7.8561 7.8561 8.2129 8.2129 8.6152 8.6152 9.3957 9.3957 9.8645 9.8645 10.1056 10.1056 10.1366 10.1366 10.4906 10.4906 10.7481 10.7481 11.0243 11.0243 11.2947 11.2947 11.7464 11.7464 11.8316 11.8316 12.2918 12.2918 12.4234 12.4234 12.7886 12.7886 13.1185 13.1185 13.6306 13.6306 13.9448 13.9448 14.1627 14.1627 14.3339 14.3339 14.4392 14.4392 14.6943 14.6943 15.1221 15.1221 15.5547 15.5547 15.9157 15.9157 17.2600 17.2600 17.4495 17.4495 17.7475 17.7475 17.9175 17.9175 18.0780 18.0780 19.9607 19.9607 20.8161 20.8161 k = 0.1121 0.1121 0.2857 ( 3114 PWs) bands (ev): 2.0058 2.0058 5.9817 5.9817 7.8242 7.8242 8.2314 8.2314 8.6045 8.6045 9.3590 9.3590 9.8471 9.8471 10.0735 10.0735 10.1184 10.1184 10.4821 10.4821 10.7658 10.7658 11.0241 11.0241 11.3347 11.3347 11.7758 11.7758 11.8357 11.8357 12.3218 12.3218 12.4261 12.4261 12.8169 12.8169 13.1256 13.1256 13.6208 13.6208 13.9464 13.9464 14.1365 14.1365 14.3342 14.3342 14.4618 14.4618 14.7279 14.7279 15.2038 15.2038 15.6279 15.6279 15.9344 15.9344 17.3021 17.3021 17.4897 17.4897 17.7743 17.7743 17.9347 17.9347 18.0885 18.0885 19.8973 19.8973 20.8390 20.8390 k = 0.1034 0.1034 0.2857 ( 3118 PWs) bands (ev): 1.9854 1.9854 5.9371 5.9371 7.7941 7.7941 8.2487 8.2487 8.5946 8.5946 9.3236 9.3236 9.8300 9.8300 10.0448 10.0448 10.1008 10.1008 10.4694 10.4694 10.7849 10.7849 11.0242 11.0242 11.3781 11.3781 11.7900 11.7900 11.8567 11.8567 12.3442 12.3442 12.4332 12.4332 12.8423 12.8423 13.1374 13.1374 13.6093 13.6093 13.9381 13.9381 14.1056 14.1056 14.3008 14.3008 14.5187 14.5187 14.7569 14.7569 15.2956 15.2956 15.7015 15.7015 15.9523 15.9523 17.3350 17.3350 17.5276 17.5276 17.8011 17.8011 17.9613 17.9613 18.0991 18.0991 19.8342 19.8342 20.8502 20.8502 k = 0.0948 0.0948 0.2857 ( 3122 PWs) bands (ev): 1.9665 1.9665 5.8959 5.8959 7.7661 7.7661 8.2645 8.2645 8.5857 8.5857 9.2898 9.2898 9.8132 9.8132 10.0194 10.0194 10.0838 10.0838 10.4540 10.4540 10.8046 10.8046 11.0244 11.0244 11.4240 11.4240 11.7921 11.7921 11.8911 11.8911 12.3544 12.3544 12.4491 12.4491 12.8641 12.8641 13.1542 13.1542 13.5953 13.5953 13.9196 13.9196 14.0750 14.0750 14.2675 14.2675 14.5748 14.5748 14.7816 14.7816 15.3951 15.3951 15.7743 15.7743 15.9693 15.9693 17.3578 17.3578 17.5639 17.5639 17.8287 17.8287 17.9962 17.9962 18.1096 18.1096 19.7721 19.7721 20.8494 20.8494 k = 0.0862 0.0862 0.2857 ( 3122 PWs) bands (ev): 1.9489 1.9489 5.8580 5.8580 7.7403 7.7403 8.2787 8.2787 8.5781 8.5781 9.2577 9.2577 9.7968 9.7968 9.9972 9.9972 10.0676 10.0676 10.4373 10.4373 10.8240 10.8240 11.0246 11.0246 11.4716 11.4716 11.7907 11.7907 11.9299 11.9299 12.3528 12.3528 12.4738 12.4738 12.8819 12.8819 13.1754 13.1754 13.5774 13.5774 13.8915 13.8915 14.0498 14.0498 14.2374 14.2374 14.6248 14.6248 14.8025 14.8025 15.4992 15.4992 15.8450 15.8450 15.9858 15.9858 17.3711 17.3711 17.5983 17.5983 17.8572 17.8572 18.0371 18.0371 18.1205 18.1205 19.7119 19.7119 20.8373 20.8373 k = 0.0776 0.0776 0.2857 ( 3126 PWs) bands (ev): 1.9329 1.9329 5.8237 5.8237 7.7167 7.7167 8.2910 8.2910 8.5720 8.5720 9.2276 9.2276 9.7813 9.7813 9.9779 9.9779 10.0524 10.0524 10.4205 10.4205 10.8426 10.8426 11.0246 11.0246 11.5201 11.5201 11.7889 11.7889 11.9690 11.9690 12.3433 12.3433 12.5035 12.5035 12.8963 12.8963 13.2001 13.2001 13.5534 13.5534 13.8586 13.8586 14.0313 14.0313 14.2095 14.2095 14.6686 14.6686 14.8201 14.8201 15.6047 15.6047 15.9120 15.9120 16.0022 16.0022 17.3772 17.3772 17.6293 17.6293 17.8866 17.8866 18.0808 18.0808 18.1332 18.1332 19.6541 19.6541 20.8155 20.8155 k = 0.0690 0.0690 0.2857 ( 3134 PWs) bands (ev): 1.9184 1.9184 5.7928 5.7928 7.6955 7.6955 8.3013 8.3013 8.5676 8.5676 9.1997 9.1997 9.7666 9.7666 9.9613 9.9613 10.0382 10.0382 10.4042 10.4042 10.8598 10.8598 11.0245 11.0245 11.5686 11.5686 11.7877 11.7877 12.0068 12.0068 12.3290 12.3290 12.5358 12.5358 12.9080 12.9080 13.2267 13.2267 13.5210 13.5210 13.8282 13.8282 14.0177 14.0177 14.1826 14.1826 14.7066 14.7066 14.8350 14.8350 15.7083 15.7083 15.9722 15.9722 16.0210 16.0210 17.3784 17.3784 17.6551 17.6551 17.9163 17.9163 18.1202 18.1202 18.1534 18.1534 19.5995 19.5995 20.7870 20.7870 k = 0.0603 0.0603 0.2857 ( 3142 PWs) bands (ev): 1.9055 1.9055 5.7655 5.7655 7.6766 7.6766 8.3097 8.3097 8.5649 8.5649 9.1743 9.1743 9.7532 9.7532 9.9472 9.9472 10.0253 10.0253 10.3892 10.3892 10.8755 10.8755 11.0241 11.0241 11.6165 11.6165 11.7876 11.7876 12.0415 12.0415 12.3118 12.3118 12.5695 12.5695 12.9181 12.9181 13.2535 13.2535 13.4790 13.4790 13.8061 13.8061 14.0066 14.0066 14.1562 14.1562 14.7394 14.7394 14.8473 14.8473 15.8063 15.8063 16.0144 16.0144 16.0530 16.0530 17.3770 17.3770 17.6745 17.6745 17.9452 17.9452 18.1442 18.1442 18.1909 18.1909 19.5485 19.5485 20.7550 20.7550 k = 0.0517 0.0517 0.2857 ( 3146 PWs) bands (ev): 1.8943 1.8943 5.7417 5.7417 7.6601 7.6601 8.3163 8.3163 8.5635 8.5635 9.1516 9.1516 9.7412 9.7412 9.9353 9.9353 10.0138 10.0138 10.3757 10.3757 10.8894 10.8894 11.0235 11.0235 11.6626 11.6626 11.7889 11.7889 12.0718 12.0718 12.2933 12.2933 12.6039 12.6039 12.9278 12.9278 13.2790 13.2790 13.4283 13.4283 13.7946 13.7946 13.9966 13.9966 14.1304 14.1304 14.7673 14.7673 14.8575 14.8575 15.8939 15.8939 16.0386 16.0386 16.0995 16.0995 17.3745 17.3745 17.6869 17.6869 17.9723 17.9723 18.1617 18.1617 18.2354 18.2354 19.5020 19.5020 20.7227 20.7227 k = 0.0431 0.0431 0.2857 ( 3156 PWs) bands (ev): 1.8847 1.8847 5.7216 5.7216 7.6461 7.6461 8.3211 8.3211 8.5634 8.5634 9.1318 9.1318 9.7307 9.7307 9.9256 9.9256 10.0038 10.0038 10.3640 10.3640 10.9014 10.9014 11.0226 11.0226 11.7050 11.7050 11.7927 11.7927 12.0955 12.0955 12.2753 12.2753 12.6385 12.6385 12.9384 12.9384 13.3017 13.3017 13.3716 13.3716 13.7932 13.7932 13.9861 13.9861 14.1057 14.1057 14.7908 14.7908 14.8656 14.8656 15.9626 15.9626 16.0662 16.0662 16.1444 16.1444 17.3721 17.3721 17.6927 17.6927 17.9963 17.9963 18.1789 18.1789 18.2786 18.2786 19.4604 19.4604 20.6930 20.6930 k = 0.0345 0.0345 0.2857 ( 3152 PWs) bands (ev): 1.8768 1.8768 5.7051 5.7051 7.6346 7.6346 8.3246 8.3246 8.5641 8.5641 9.1151 9.1151 9.7219 9.7219 9.9178 9.9178 9.9955 9.9955 10.3542 10.3542 10.9114 10.9114 11.0216 11.0216 11.7396 11.7396 11.8020 11.8020 12.1103 12.1103 12.2605 12.2605 12.6718 12.6718 12.9513 12.9513 13.3083 13.3083 13.3242 13.3242 13.8005 13.8005 13.9739 13.9739 14.0834 14.0834 14.8100 14.8100 14.8719 14.8719 16.0025 16.0025 16.1086 16.1086 16.1828 16.1828 17.3703 17.3703 17.6932 17.6932 18.0165 18.0165 18.1961 18.1961 18.3176 18.3176 19.4247 19.4247 20.6685 20.6685 k = 0.0259 0.0259 0.2857 ( 3148 PWs) bands (ev): 1.8707 1.8707 5.6922 5.6922 7.6256 7.6256 8.3269 8.3269 8.5652 8.5652 9.1019 9.1019 9.7150 9.7150 9.9119 9.9119 9.9888 9.9888 10.3466 10.3466 10.9195 10.9195 11.0205 11.0205 11.7603 11.7603 11.8211 11.8211 12.1147 12.1147 12.2513 12.2513 12.7019 12.7019 12.9684 12.9684 13.2502 13.2502 13.3371 13.3371 13.8145 13.8145 13.9586 13.9586 14.0652 14.0652 14.8252 14.8252 14.8764 14.8764 16.0210 16.0210 16.1569 16.1569 16.2135 16.2135 17.3694 17.3694 17.6902 17.6902 18.0324 18.0324 18.2120 18.2120 18.3504 18.3504 19.3956 19.3956 20.6509 20.6509 k = 0.0172 0.0172 0.2857 ( 3148 PWs) bands (ev): 1.8663 1.8663 5.6830 5.6830 7.6192 7.6192 8.3284 8.3284 8.5663 8.5663 9.0923 9.0923 9.7100 9.7100 9.9077 9.9077 9.9840 9.9840 10.3411 10.3411 10.9254 10.9254 11.0195 11.0195 11.7690 11.7690 11.8455 11.8455 12.1104 12.1104 12.2479 12.2479 12.7261 12.7261 12.9911 12.9911 13.1930 13.1930 13.3477 13.3477 13.8331 13.8331 13.9398 13.9398 14.0523 14.0523 14.8362 14.8362 14.8793 14.8793 16.0302 16.0302 16.1971 16.1971 16.2357 16.2357 17.3692 17.3692 17.6858 17.6858 18.0439 18.0439 18.2249 18.2249 18.3753 18.3753 19.3740 19.3740 20.6407 20.6407 k = 0.0086 0.0086 0.2857 ( 3154 PWs) bands (ev): 1.8636 1.8636 5.6774 5.6774 7.6154 7.6154 8.3292 8.3292 8.5672 8.5672 9.0864 9.0864 9.7070 9.7070 9.9052 9.9052 9.9811 9.9811 10.3377 10.3377 10.9290 10.9290 11.0189 11.0189 11.7724 11.7724 11.8650 11.8650 12.1031 12.1031 12.2477 12.2477 12.7419 12.7419 13.0181 13.0181 13.1436 13.1436 13.3541 13.3541 13.8531 13.8531 13.9197 13.9197 14.0449 14.0449 14.8430 14.8430 14.8809 14.8809 16.0348 16.0348 16.2231 16.2231 16.2489 16.2489 17.3694 17.3694 17.6821 17.6821 18.0507 18.0507 18.2333 18.2333 18.3909 18.3909 19.3607 19.3607 20.6367 20.6367 k = 0.0000 0.0000 0.2857 ( 3154 PWs) bands (ev): 1.8628 1.8628 5.6756 5.6756 7.6141 7.6141 8.3294 8.3294 8.5674 8.5674 9.0845 9.0845 9.7060 9.7060 9.9044 9.9044 9.9802 9.9802 10.3366 10.3366 10.9302 10.9302 11.0186 11.0186 11.7733 11.7733 11.8724 11.8724 12.0997 12.0997 12.2479 12.2479 12.7473 12.7473 13.0352 13.0352 13.1189 13.1189 13.3562 13.3562 13.8647 13.8647 13.9081 13.9081 14.0425 14.0425 14.8453 14.8453 14.8813 14.8813 16.0362 16.0362 16.2321 16.2321 16.2533 16.2533 17.3695 17.3695 17.6807 17.6807 18.0530 18.0530 18.2362 18.2362 18.3962 18.3962 19.3562 19.3562 20.6360 20.6360 k = 0.0000 0.5000-0.0000 ( 3068 PWs) bands (ev): 2.5263 2.5263 7.5187 7.5187 8.3172 8.3172 8.6100 8.6100 8.7946 8.7946 9.2117 9.2117 9.8650 9.8650 10.1762 10.1762 10.8534 10.8534 10.8797 10.8797 11.1838 11.1838 11.2745 11.2745 11.3643 11.3643 11.6464 11.6464 11.8929 11.8929 12.0673 12.0673 12.1663 12.1663 12.4808 12.4808 12.7226 12.7226 12.7353 12.7353 13.0067 13.0067 13.5377 13.5377 13.6845 13.6845 13.8150 13.8150 13.9641 13.9641 14.1257 14.1257 14.6704 14.6704 15.0785 15.0785 15.2580 15.2580 16.1193 16.1193 16.9771 16.9771 18.5087 18.5087 19.6152 19.6152 20.8792 20.8792 21.1101 21.1101 k = 0.0000 0.5000 0.0119 ( 3068 PWs) bands (ev): 2.5264 2.5264 7.5193 7.5193 8.3101 8.3101 8.6167 8.6167 8.7951 8.7951 9.2100 9.2100 9.8672 9.8672 10.1777 10.1777 10.8536 10.8536 10.8800 10.8800 11.1840 11.1840 11.2743 11.2743 11.3645 11.3645 11.6459 11.6459 11.8909 11.8909 12.0675 12.0675 12.1654 12.1654 12.4803 12.4803 12.7222 12.7222 12.7351 12.7351 13.0028 13.0028 13.5350 13.5350 13.6822 13.6822 13.8175 13.8175 13.9651 13.9651 14.1259 14.1259 14.6736 14.6736 15.0759 15.0759 15.2555 15.2555 16.1237 16.1237 16.9841 16.9841 18.5136 18.5136 19.6133 19.6133 20.8784 20.8784 21.1079 21.1079 k = 0.0000 0.5000 0.0238 ( 3072 PWs) bands (ev): 2.5268 2.5268 7.5212 7.5212 8.2908 8.2908 8.6347 8.6347 8.7969 8.7969 9.2048 9.2048 9.8738 9.8738 10.1821 10.1821 10.8539 10.8539 10.8811 10.8811 11.1845 11.1845 11.2740 11.2740 11.3651 11.3651 11.6443 11.6443 11.8849 11.8849 12.0680 12.0680 12.1626 12.1626 12.4791 12.4791 12.7208 12.7208 12.7347 12.7347 12.9914 12.9914 13.5269 13.5269 13.6763 13.6763 13.8238 13.8238 13.9684 13.9684 14.1268 14.1268 14.6822 14.6822 15.0689 15.0689 15.2479 15.2479 16.1368 16.1368 17.0048 17.0048 18.5282 18.5282 19.6077 19.6077 20.8761 20.8761 21.1012 21.1012 k = 0.0000 0.5000 0.0357 ( 3072 PWs) bands (ev): 2.5274 2.5274 7.5243 7.5243 8.2630 8.2630 8.6594 8.6594 8.8009 8.8009 9.1964 9.1964 9.8847 9.8847 10.1892 10.1892 10.8545 10.8545 10.8829 10.8829 11.1854 11.1854 11.2735 11.2735 11.3659 11.3659 11.6415 11.6415 11.8747 11.8747 12.0690 12.0690 12.1582 12.1582 12.4773 12.4773 12.7184 12.7184 12.7336 12.7336 12.9737 12.9737 13.5134 13.5134 13.6687 13.6687 13.8315 13.8315 13.9740 13.9740 14.1288 14.1288 14.6932 14.6932 15.0602 15.0602 15.2351 15.2351 16.1585 16.1585 17.0390 17.0390 18.5523 18.5523 19.5985 19.5985 20.8720 20.8720 21.0898 21.0898 k = 0.0000 0.5000 0.0476 ( 3074 PWs) bands (ev): 2.5283 2.5283 7.5286 7.5286 8.2301 8.2301 8.6858 8.6858 8.8086 8.8086 9.1850 9.1850 9.8998 9.8998 10.1989 10.1989 10.8553 10.8553 10.8854 10.8854 11.1866 11.1866 11.2728 11.2728 11.3669 11.3669 11.6374 11.6374 11.8603 11.8603 12.0706 12.0706 12.1522 12.1522 12.4753 12.4753 12.7147 12.7147 12.7316 12.7316 12.9517 12.9517 13.4952 13.4952 13.6606 13.6606 13.8391 13.8391 13.9816 13.9816 14.1329 14.1329 14.7017 14.7017 15.0542 15.0542 15.2170 15.2170 16.1885 16.1885 17.0857 17.0857 18.5851 18.5851 19.5857 19.5857 20.8661 20.8661 21.0732 21.0732 k = 0.0000 0.5000 0.0595 ( 3072 PWs) bands (ev): 2.5294 2.5294 7.5340 7.5340 8.1945 8.1945 8.7087 8.7087 8.8230 8.8230 9.1710 9.1710 9.9190 9.9190 10.2108 10.2108 10.8562 10.8562 10.8885 10.8885 11.1879 11.1879 11.2720 11.2720 11.3678 11.3678 11.6317 11.6317 11.8417 11.8417 12.0728 12.0728 12.1450 12.1450 12.4734 12.4734 12.7093 12.7093 12.7283 12.7283 12.9276 12.9276 13.4734 13.4734 13.6517 13.6517 13.8461 13.8461 13.9902 13.9902 14.1398 14.1398 14.7026 14.7026 15.0551 15.0551 15.1942 15.1942 16.2266 16.2266 17.1442 17.1442 18.6261 18.6261 19.5696 19.5696 20.8581 20.8581 21.0511 21.0511 k = 0.0000 0.5000 0.0714 ( 3072 PWs) bands (ev): 2.5308 2.5308 7.5404 7.5404 8.1576 8.1576 8.7247 8.7247 8.8461 8.8461 9.1549 9.1549 9.9421 9.9421 10.2246 10.2246 10.8572 10.8572 10.8922 10.8922 11.1892 11.1892 11.2711 11.2711 11.3684 11.3684 11.6238 11.6238 11.8194 11.8194 12.0757 12.0757 12.1368 12.1368 12.4720 12.4720 12.7011 12.7011 12.7238 12.7238 12.9037 12.9037 13.4495 13.4495 13.6415 13.6415 13.8528 13.8528 13.9987 13.9987 14.1500 14.1500 14.6924 14.6924 15.0645 15.0645 15.1681 15.1681 16.2727 16.2727 17.2133 17.2133 18.6742 18.6742 19.5503 19.5503 20.8478 20.8478 21.0229 21.0229 k = 0.0000 0.5000 0.0833 ( 3078 PWs) bands (ev): 2.5323 2.5323 7.5478 7.5478 8.1205 8.1205 8.7336 8.7336 8.8770 8.8770 9.1373 9.1373 9.9688 9.9688 10.2399 10.2399 10.8583 10.8583 10.8965 10.8965 11.1903 11.1903 11.2701 11.2701 11.3684 11.3684 11.6128 11.6128 11.7946 11.7946 12.0792 12.0792 12.1279 12.1279 12.4712 12.4712 12.6890 12.6890 12.7189 12.7189 12.8820 12.8820 13.4248 13.4248 13.6292 13.6292 13.8599 13.8599 14.0062 14.0062 14.1637 14.1637 14.6708 14.6708 15.0756 15.0756 15.1460 15.1460 16.3267 16.3267 17.2920 17.2920 18.7285 18.7285 19.5281 19.5281 20.8349 20.8349 20.9881 20.9881 k = 0.0000 0.5000 0.0952 ( 3086 PWs) bands (ev): 2.5339 2.5339 7.5561 7.5561 8.0838 8.0838 8.7376 8.7376 8.9125 8.9125 9.1190 9.1190 9.9988 9.9988 10.2563 10.2563 10.8593 10.8593 10.9012 10.9012 11.1909 11.1909 11.2692 11.2692 11.3674 11.3674 11.5976 11.5976 11.7693 11.7693 12.0830 12.0830 12.1185 12.1185 12.4710 12.4710 12.6728 12.6728 12.7142 12.7142 12.8634 12.8634 13.4003 13.4003 13.6149 13.6149 13.8674 13.8674 14.0122 14.0122 14.1803 14.1803 14.6400 14.6400 15.0645 15.0645 15.1496 15.1496 16.3883 16.3883 17.3790 17.3790 18.7879 18.7879 19.5032 19.5032 20.8190 20.8190 20.9463 20.9463 k = 0.0000 0.5000 0.1071 ( 3090 PWs) bands (ev): 2.5357 2.5357 7.5650 7.5650 8.0481 8.0481 8.7387 8.7387 8.9489 8.9489 9.1018 9.1018 10.0320 10.0320 10.2736 10.2736 10.8604 10.8604 10.9062 10.9062 11.1904 11.1904 11.2683 11.2683 11.3652 11.3652 11.5767 11.5767 11.7457 11.7457 12.0865 12.0865 12.1093 12.1093 12.4714 12.4714 12.6534 12.6534 12.7100 12.7100 12.8477 12.8477 13.3769 13.3769 13.5987 13.5987 13.8755 13.8755 14.0168 14.0168 14.1993 14.1993 14.6033 14.6033 15.0297 15.0297 15.1778 15.1778 16.4571 16.4571 17.4732 17.4732 18.8510 18.8510 19.4763 19.4763 20.8000 20.8000 20.8975 20.8975 k = 0.0000 0.5000 0.1190 ( 3094 PWs) bands (ev): 2.5377 2.5377 7.5745 7.5745 8.0137 8.0137 8.7383 8.7383 8.9806 8.9806 9.0902 9.0902 10.0678 10.0678 10.2914 10.2914 10.8613 10.8613 10.9115 10.9115 11.1882 11.1882 11.2677 11.2677 11.3614 11.3614 11.5496 11.5496 11.7258 11.7258 12.0871 12.0871 12.1027 12.1027 12.4723 12.4723 12.6327 12.6327 12.7065 12.7065 12.8342 12.8342 13.3552 13.3552 13.5808 13.5808 13.8840 13.8840 14.0204 14.0204 14.2196 14.2196 14.5632 14.5632 14.9862 14.9862 15.2136 15.2136 16.5326 16.5326 17.5737 17.5737 18.9163 18.9163 19.4481 19.4481 20.7770 20.7770 20.8422 20.8422 k = 0.0000 0.5000 0.1310 ( 3086 PWs) bands (ev): 2.5396 2.5396 7.5844 7.5844 7.9809 7.9809 8.7370 8.7370 8.9968 8.9968 9.0947 9.0947 10.1060 10.1060 10.3095 10.3095 10.8621 10.8621 10.9169 10.9169 11.1832 11.1832 11.2674 11.2674 11.3558 11.3558 11.5169 11.5169 11.7106 11.7106 12.0811 12.0811 12.1024 12.1024 12.4732 12.4732 12.6129 12.6129 12.7036 12.7036 12.8217 12.8217 13.3356 13.3356 13.5618 13.5618 13.8926 13.8926 14.0233 14.0233 14.2406 14.2406 14.5216 14.5216 14.9389 14.9389 15.2512 15.2512 16.6141 16.6141 17.6793 17.6793 18.9815 18.9815 19.4200 19.4200 20.7465 20.7465 20.7839 20.7839 k = 0.0000 0.5000 0.1429 ( 3098 PWs) bands (ev): 2.5417 2.5417 7.5944 7.5944 7.9501 7.9501 8.7352 8.7352 8.9916 8.9916 9.1206 9.1206 10.1462 10.1462 10.3276 10.3276 10.8628 10.8628 10.9222 10.9222 11.1742 11.1742 11.2676 11.2676 11.3480 11.3480 11.4814 11.4814 11.6994 11.6994 12.0717 12.0717 12.1050 12.1050 12.4738 12.4738 12.5957 12.5957 12.7015 12.7015 12.8092 12.8092 13.3186 13.3186 13.5419 13.5419 13.9011 13.9011 14.0260 14.0260 14.2616 14.2616 14.4800 14.4800 14.8895 14.8895 15.2883 15.2883 16.7006 16.7006 17.7893 17.7893 19.0431 19.0431 19.3946 19.3946 20.6932 20.6932 20.7387 20.7387 k = 0.0000 0.5000 0.1548 ( 3098 PWs) bands (ev): 2.5437 2.5437 7.6043 7.6043 7.9216 7.9216 8.7331 8.7331 8.9754 8.9754 9.1577 9.1577 10.1877 10.1877 10.3456 10.3456 10.8632 10.8632 10.9273 10.9273 11.1599 11.1599 11.2684 11.2684 11.3379 11.3379 11.4460 11.4460 11.6914 11.6914 12.0619 12.0619 12.1077 12.1077 12.4737 12.4737 12.5825 12.5825 12.7002 12.7002 12.7962 12.7962 13.3041 13.3041 13.5216 13.5216 13.9093 13.9093 14.0288 14.0288 14.2820 14.2820 14.4394 14.4394 14.8392 14.8392 15.3238 15.3238 16.7911 16.7911 17.9026 17.9026 19.0947 19.0947 19.3775 19.3775 20.6190 20.6190 20.7054 20.7054 k = 0.0000 0.5000 0.1667 ( 3098 PWs) bands (ev): 2.5457 2.5457 7.6138 7.6138 7.8957 7.8957 8.7310 8.7310 8.9555 8.9555 9.1985 9.1985 10.2299 10.2299 10.3634 10.3634 10.8633 10.8633 10.9319 10.9319 11.1393 11.1393 11.2696 11.2696 11.3251 11.3251 11.4142 11.4142 11.6856 11.6856 12.0527 12.0527 12.1094 12.1094 12.4728 12.4728 12.5738 12.5738 12.6997 12.6997 12.7825 12.7825 13.2922 13.2922 13.5013 13.5013 13.9170 13.9170 14.0319 14.0319 14.3013 14.3013 14.4008 14.4008 14.7890 14.7890 15.3570 15.3570 16.8843 16.8843 18.0185 18.0185 19.1258 19.1258 19.3784 19.3784 20.5359 20.5359 20.6732 20.6732 k = 0.0000 0.5000 0.1786 ( 3098 PWs) bands (ev): 2.5476 2.5476 7.6227 7.6227 7.8725 7.8725 8.7291 8.7291 8.9346 8.9346 9.2401 9.2401 10.2719 10.2719 10.3815 10.3815 10.8631 10.8631 10.9356 10.9356 11.1126 11.1126 11.2701 11.2701 11.3101 11.3101 11.3882 11.3882 11.6815 11.6815 12.0446 12.0446 12.1098 12.1098 12.4714 12.4714 12.5695 12.5695 12.6998 12.6998 12.7680 12.7680 13.2827 13.2827 13.4814 13.4814 13.9241 13.9241 14.0357 14.0357 14.3183 14.3183 14.3655 14.3655 14.7396 14.7396 15.3875 15.3875 16.9791 16.9791 18.1361 18.1361 19.1289 19.1289 19.4043 19.4043 20.4469 20.4469 20.6407 20.6407 k = 0.0000 0.5000 0.1905 ( 3094 PWs) bands (ev): 2.5494 2.5494 7.6305 7.6305 7.8524 7.8524 8.7273 8.7273 8.9141 8.9141 9.2812 9.2812 10.3123 10.3123 10.4004 10.4004 10.8625 10.8625 10.9376 10.9376 11.0817 11.0817 11.2664 11.2664 11.2960 11.2960 11.3689 11.3689 11.6786 11.6786 12.0380 12.0380 12.1085 12.1085 12.4705 12.4705 12.5688 12.5688 12.7001 12.7001 12.7533 12.7533 13.2753 13.2753 13.4623 13.4623 13.9303 13.9303 14.0401 14.0401 14.3207 14.3207 14.3458 14.3458 14.6920 14.6920 15.4151 15.4151 17.0737 17.0737 18.2544 18.2544 19.1094 19.1094 19.4488 19.4488 20.3535 20.3535 20.6082 20.6082 k = 0.0000 0.5000 0.2024 ( 3094 PWs) bands (ev): 2.5511 2.5511 7.6370 7.6370 7.8355 7.8355 8.7259 8.7259 8.8944 8.8944 9.3208 9.3208 10.3484 10.3484 10.4219 10.4219 10.8613 10.8613 10.9367 10.9367 11.0499 11.0499 11.2514 11.2514 11.2905 11.2905 11.3553 11.3553 11.6765 11.6765 12.0333 12.0333 12.1055 12.1055 12.4707 12.4707 12.5705 12.5705 12.6996 12.6996 12.7396 12.7396 13.2697 13.2697 13.4444 13.4444 13.9358 13.9358 14.0455 14.0455 14.2944 14.2944 14.3561 14.3561 14.6470 14.6470 15.4397 15.4397 17.1666 17.1666 18.3719 18.3719 19.0782 19.0782 19.5006 19.5006 20.2570 20.2570 20.5766 20.5766 k = 0.0000 0.5000 0.2143 ( 3088 PWs) bands (ev): 2.5527 2.5527 7.6419 7.6419 7.8220 7.8220 8.7249 8.7249 8.8761 8.8761 9.3580 9.3580 10.3774 10.3774 10.4480 10.4480 10.8594 10.8594 10.9306 10.9306 11.0223 11.0223 11.2284 11.2284 11.2914 11.2914 11.3458 11.3458 11.6751 11.6751 12.0305 12.0305 12.1008 12.1008 12.4727 12.4727 12.5734 12.5734 12.6962 12.6962 12.7292 12.7292 13.2655 13.2655 13.4281 13.4281 13.9403 13.9403 14.0518 14.0518 14.2668 14.2668 14.3690 14.3690 14.6054 14.6054 15.4612 15.4612 17.2558 17.2558 18.4868 18.4868 19.0432 19.0432 19.5521 19.5521 20.1593 20.1593 20.5468 20.5468 k = 0.0000 0.5000 0.2262 ( 3088 PWs) bands (ev): 2.5540 2.5540 7.6453 7.6453 7.8117 7.8117 8.7243 8.7243 8.8596 8.8596 9.3919 9.3919 10.3982 10.3982 10.4786 10.4786 10.8564 10.8564 10.9174 10.9174 11.0035 11.0035 11.2031 11.2031 11.2941 11.2941 11.3388 11.3388 11.6742 11.6742 12.0298 12.0298 12.0946 12.0946 12.4765 12.4765 12.5767 12.5767 12.6877 12.6877 12.7245 12.7245 13.2624 13.2624 13.4138 13.4138 13.9440 13.9440 14.0591 14.0591 14.2417 14.2417 14.3804 14.3804 14.5682 14.5682 15.4794 15.4794 17.3391 17.3391 18.5954 18.5954 19.0108 19.0108 19.5975 19.5975 20.0631 20.0631 20.5195 20.5195 k = 0.0000 0.5000 0.2381 ( 3088 PWs) bands (ev): 2.5552 2.5552 7.6472 7.6472 7.8043 7.8043 8.7241 8.7241 8.8453 8.8453 9.4217 9.4217 10.4127 10.4127 10.5100 10.5100 10.8521 10.8521 10.8993 10.8993 10.9938 10.9938 11.1782 11.1782 11.2973 11.2973 11.3336 11.3336 11.6736 11.6736 12.0311 12.0311 12.0871 12.0871 12.4818 12.4818 12.5796 12.5796 12.6762 12.6762 12.7240 12.7240 13.2599 13.2599 13.4018 13.4018 13.9468 13.9468 14.0672 14.0672 14.2196 14.2196 14.3900 14.3900 14.5361 14.5361 15.4944 15.4944 17.4139 17.4139 18.6900 18.6900 18.9900 18.9900 19.6313 19.6313 19.9733 19.9733 20.4959 20.4959 k = 0.0000 0.5000 0.2500 ( 3080 PWs) bands (ev): 2.5561 2.5561 7.6480 7.6480 7.7995 7.7995 8.7242 8.7242 8.8335 8.8335 9.4461 9.4461 10.4231 10.4231 10.5385 10.5385 10.8464 10.8464 10.8822 10.8822 10.9893 10.9893 11.1557 11.1557 11.3005 11.3005 11.3295 11.3295 11.6732 11.6732 12.0343 12.0343 12.0789 12.0789 12.4881 12.4881 12.5814 12.5814 12.6650 12.6650 12.7252 12.7252 13.2581 13.2581 13.3924 13.3924 13.9489 13.9489 14.0758 14.0758 14.2006 14.2006 14.3975 14.3975 14.5101 14.5101 15.5061 15.5061 17.4772 17.4772 18.7555 18.7555 18.9955 18.9955 19.6450 19.6450 19.8999 19.8999 20.4766 20.4766 k = 0.0000 0.5000 0.2619 ( 3094 PWs) bands (ev): 2.5568 2.5568 7.6481 7.6481 7.7966 7.7966 8.7244 8.7244 8.8247 8.8247 9.4645 9.4645 10.4302 10.4302 10.5610 10.5610 10.8405 10.8405 10.8697 10.8697 10.9871 10.9871 11.1377 11.1377 11.3033 11.3033 11.3264 11.3264 11.6730 11.6730 12.0392 12.0392 12.0702 12.0702 12.4942 12.4942 12.5819 12.5819 12.6560 12.6560 12.7265 12.7265 13.2567 13.2567 13.3857 13.3857 13.9503 13.9503 14.0839 14.0839 14.1852 14.1852 14.4029 14.4029 14.4909 14.4909 15.5144 15.5144 17.5257 17.5257 18.7815 18.7815 19.0348 19.0348 19.6300 19.6300 19.8556 19.8556 20.4623 20.4623 k = 0.0000 0.5000 0.2738 ( 3094 PWs) bands (ev): 2.5572 2.5572 7.6480 7.6480 7.7951 7.7951 8.7247 8.7247 8.8192 8.8192 9.4758 9.4758 10.4344 10.4344 10.5753 10.5753 10.8366 10.8366 10.8618 10.8618 10.9860 10.9860 11.1259 11.1259 11.3054 11.3054 11.3242 11.3242 11.6729 11.6729 12.0455 12.0455 12.0616 12.0616 12.4989 12.4989 12.5816 12.5816 12.6503 12.6503 12.7275 12.7275 13.2558 13.2558 13.3816 13.3816 13.9510 13.9510 14.0904 14.0904 14.1747 14.1747 14.4061 14.4061 14.4791 14.4791 15.5195 15.5195 17.5564 17.5564 18.7847 18.7847 19.0824 19.0824 19.5979 19.5979 19.8394 19.8394 20.4536 20.4536 k = 0.0000 0.5000 0.2857 ( 3092 PWs) bands (ev): 2.5573 2.5573 7.6480 7.6480 7.7946 7.7946 8.7249 8.7249 8.8174 8.8174 9.4797 9.4797 10.4359 10.4359 10.5802 10.5802 10.8355 10.8355 10.8590 10.8590 10.9857 10.9857 11.1219 11.1219 11.3061 11.3061 11.3235 11.3235 11.6728 11.6728 12.0515 12.0515 12.0548 12.0548 12.5006 12.5006 12.5812 12.5812 12.6484 12.6484 12.7279 12.7279 13.2555 13.2555 13.3803 13.3803 13.9513 13.9513 14.0929 14.0929 14.1708 14.1708 14.4072 14.4072 14.4752 14.4752 15.5211 15.5211 17.5669 17.5669 18.7839 18.7839 19.1036 19.1036 19.5814 19.5814 19.8363 19.8363 20.4506 20.4506 k = 0.5000 0.5000-0.0000 ( 3076 PWs) bands (ev): 3.0187 3.0187 7.4807 7.4807 7.5608 7.5608 8.4657 8.4657 9.4581 9.4581 9.6283 9.6283 9.8542 9.8542 10.0253 10.0253 10.5096 10.5096 10.6712 10.6712 11.2381 11.2381 11.3820 11.3820 11.7543 11.7543 11.7944 11.7944 11.9085 11.9085 12.3648 12.3648 12.4385 12.4385 12.6329 12.6329 12.8362 12.8362 13.2720 13.2720 13.5586 13.5586 13.8575 13.8575 13.8674 13.8674 13.9521 13.9521 14.1260 14.1260 14.3932 14.3932 14.8377 14.8377 15.2835 15.2835 15.8979 15.8979 15.9656 15.9656 16.4036 16.4036 17.0950 17.0950 17.3012 17.3012 18.7882 18.7882 19.8839 19.8839 k = 0.5000 0.5000 0.0119 ( 3068 PWs) bands (ev): 3.0187 3.0187 7.4805 7.4805 7.5608 7.5608 8.4666 8.4666 9.4590 9.4590 9.6291 9.6291 9.8525 9.8525 10.0277 10.0277 10.5100 10.5100 10.6717 10.6717 11.2027 11.2027 11.4157 11.4157 11.7530 11.7530 11.7960 11.7960 11.9123 11.9123 12.3628 12.3628 12.4381 12.4381 12.6333 12.6333 12.8360 12.8360 13.2712 13.2712 13.5554 13.5554 13.8413 13.8413 13.8814 13.8814 13.9470 13.9470 14.1129 14.1129 14.4046 14.4046 14.8371 14.8371 15.2813 15.2813 15.9031 15.9031 15.9716 15.9716 16.4032 16.4032 17.0946 17.0946 17.3010 17.3010 18.7916 18.7916 19.8869 19.8869 k = 0.5000 0.5000 0.0238 ( 3068 PWs) bands (ev): 3.0188 3.0188 7.4800 7.4800 7.5607 7.5607 8.4693 8.4693 9.4619 9.4619 9.6315 9.6315 9.8474 9.8474 10.0345 10.0345 10.5110 10.5110 10.6732 10.6732 11.1349 11.1349 11.4779 11.4779 11.7496 11.7496 11.8004 11.8004 11.9243 11.9243 12.3567 12.3567 12.4371 12.4371 12.6347 12.6347 12.8352 12.8352 13.2688 13.2688 13.5454 13.5454 13.8199 13.8199 13.8970 13.8970 13.9319 13.9319 14.0787 14.0787 14.4336 14.4336 14.8353 14.8353 15.2746 15.2746 15.9184 15.9184 15.9895 15.9895 16.4020 16.4020 17.0937 17.0937 17.3005 17.3005 18.8019 18.8019 19.8961 19.8961 k = 0.5000 0.5000 0.0357 ( 3072 PWs) bands (ev): 3.0189 3.0189 7.4791 7.4791 7.5605 7.5605 8.4738 8.4738 9.4667 9.4667 9.6355 9.6355 9.8399 9.8399 10.0452 10.0452 10.5124 10.5124 10.6758 10.6758 11.0603 11.0603 11.5419 11.5419 11.7451 11.7451 11.8065 11.8065 11.9456 11.9456 12.3470 12.3470 12.4355 12.4355 12.6370 12.6370 12.8337 12.8337 13.2648 13.2648 13.5273 13.5273 13.7988 13.7988 13.9077 13.9077 13.9105 13.9105 14.0315 14.0315 14.4719 14.4719 14.8324 14.8324 15.2634 15.2634 15.9429 15.9429 16.0184 16.0184 16.4001 16.4001 17.0922 17.0922 17.2996 17.2996 18.8189 18.8189 19.9113 19.9113 k = 0.5000 0.5000 0.0476 ( 3068 PWs) bands (ev): 3.0190 3.0190 7.4780 7.4780 7.5603 7.5603 8.4800 8.4800 9.4733 9.4733 9.6409 9.6409 9.8305 9.8305 10.0588 10.0588 10.5140 10.5140 10.6793 10.6793 10.9848 10.9848 11.6004 11.6004 11.7400 11.7400 11.8137 11.8137 11.9779 11.9779 12.3338 12.3338 12.4333 12.4333 12.6401 12.6401 12.8313 12.8313 13.2593 13.2593 13.4999 13.4999 13.7804 13.7804 13.8758 13.8758 13.9220 13.9220 13.9770 13.9770 14.5140 14.5140 14.8286 14.8286 15.2479 15.2479 15.9754 15.9754 16.0570 16.0570 16.3978 16.3978 17.0902 17.0902 17.2983 17.2983 18.8425 18.8425 19.9328 19.9328 k = 0.5000 0.5000 0.0595 ( 3060 PWs) bands (ev): 3.0191 3.0191 7.4765 7.4765 7.5600 7.5600 8.4879 8.4879 9.4817 9.4817 9.6477 9.6477 9.8201 9.8201 10.0748 10.0748 10.5152 10.5152 10.6838 10.6838 10.9107 10.9107 11.6500 11.6500 11.7348 11.7348 11.8215 11.8215 12.0226 12.0226 12.3177 12.3177 12.4306 12.4306 12.6441 12.6441 12.8277 12.8277 13.2523 13.2523 13.4624 13.4624 13.7662 13.7662 13.8376 13.8376 13.9181 13.9181 13.9322 13.9322 14.5567 14.5567 14.8239 14.8239 15.2282 15.2282 16.0140 16.0140 16.1038 16.1038 16.3954 16.3954 17.0878 17.0878 17.2967 17.2967 18.8725 18.8725 19.9606 19.9606 k = 0.5000 0.5000 0.0714 ( 3076 PWs) bands (ev): 3.0193 3.0193 7.4747 7.4747 7.5596 7.5596 8.4974 8.4974 9.4916 9.4916 9.6558 9.6558 9.8093 9.8093 10.0924 10.0924 10.5149 10.5149 10.6892 10.6892 10.8398 10.8398 11.6901 11.6901 11.7295 11.7295 11.8297 11.8297 12.0792 12.0792 12.2993 12.2993 12.4277 12.4277 12.6488 12.6488 12.8228 12.8228 13.2438 13.2438 13.4154 13.4154 13.7567 13.7567 13.7944 13.7944 13.8567 13.8567 13.9412 13.9412 14.5983 14.5983 14.8185 14.8185 15.2045 15.2045 16.0569 16.0569 16.1573 16.1573 16.3934 16.3934 17.0853 17.0853 17.2946 17.2946 18.9086 18.9086 19.9947 19.9947 k = 0.5000 0.5000 0.0833 ( 3080 PWs) bands (ev): 3.0195 3.0195 7.4728 7.4728 7.5592 7.5592 8.5086 8.5086 9.5030 9.5030 9.6651 9.6651 9.7983 9.7983 10.1113 10.1113 10.5109 10.5109 10.6954 10.6954 10.7748 10.7748 11.7220 11.7220 11.7244 11.7244 11.8381 11.8381 12.1454 12.1454 12.2791 12.2791 12.4248 12.4248 12.6543 12.6543 12.8161 12.8161 13.2340 13.2340 13.3605 13.3605 13.7475 13.7475 13.7515 13.7515 13.7943 13.7943 13.9496 13.9496 14.6374 14.6374 14.8126 14.8126 15.1775 15.1775 16.1019 16.1019 16.2157 16.2157 16.3926 16.3926 17.0827 17.0827 17.2920 17.2920 18.9505 18.9505 20.0353 20.0353 k = 0.5000 0.5000 0.0952 ( 3088 PWs) bands (ev): 3.0197 3.0197 7.4706 7.4706 7.5588 7.5588 8.5212 8.5212 9.5158 9.5158 9.6752 9.6752 9.7877 9.7877 10.1313 10.1313 10.4995 10.4995 10.7022 10.7022 10.7198 10.7198 11.7193 11.7193 11.7476 11.7476 11.8465 11.8465 12.2177 12.2177 12.2579 12.2579 12.4229 12.4229 12.6605 12.6605 12.8076 12.8076 13.2230 13.2230 13.2998 13.2998 13.6978 13.6978 13.7323 13.7323 13.7497 13.7497 13.9574 13.9574 14.6723 14.6723 14.8061 14.8061 15.1482 15.1482 16.1467 16.1467 16.2777 16.2777 16.3940 16.3940 17.0801 17.0801 17.2889 17.2889 18.9977 18.9977 20.0824 20.0824 k = 0.5000 0.5000 0.1071 ( 3080 PWs) bands (ev): 3.0200 3.0200 7.4682 7.4682 7.5583 7.5583 8.5353 8.5353 9.5296 9.5296 9.6858 9.6858 9.7779 9.7779 10.1519 10.1519 10.4755 10.4755 10.6802 10.6802 10.7098 10.7098 11.7143 11.7143 11.7691 11.7691 11.8547 11.8547 12.2362 12.2362 12.2902 12.2902 12.4249 12.4249 12.6673 12.6673 12.7968 12.7968 13.2111 13.2111 13.2352 13.2352 13.6456 13.6456 13.6723 13.6723 13.7506 13.7506 13.9650 13.9650 14.7013 14.7013 14.7994 14.7994 15.1181 15.1181 16.1885 16.1885 16.3418 16.3418 16.3994 16.3994 17.0778 17.0778 17.2852 17.2852 19.0499 19.0499 20.1361 20.1361 k = 0.5000 0.5000 0.1190 ( 3080 PWs) bands (ev): 3.0202 3.0202 7.4658 7.4658 7.5578 7.5578 8.5506 8.5506 9.5444 9.5444 9.6961 9.6961 9.7695 9.7695 10.1731 10.1731 10.4365 10.4365 10.6584 10.6584 10.7179 10.7179 11.7093 11.7093 11.7879 11.7879 11.8627 11.8627 12.2148 12.2148 12.3478 12.3478 12.4438 12.4438 12.6749 12.6749 12.7835 12.7835 13.1689 13.1689 13.1985 13.1985 13.5917 13.5917 13.6156 13.6156 13.7533 13.7533 13.9723 13.9723 14.7215 14.7215 14.7923 14.7923 15.0898 15.0898 16.2241 16.2241 16.4068 16.4068 16.4109 16.4109 17.0758 17.0758 17.2809 17.2809 19.1064 19.1064 20.1964 20.1964 k = 0.5000 0.5000 0.1310 ( 3080 PWs) bands (ev): 3.0205 3.0205 7.4632 7.4632 7.5573 7.5573 8.5671 8.5671 9.5598 9.5598 9.7051 9.7051 9.7637 9.7637 10.1945 10.1945 10.3867 10.3867 10.6506 10.6506 10.7263 10.7263 11.7041 11.7041 11.8049 11.8049 11.8702 11.8702 12.1944 12.1944 12.3692 12.3692 12.4987 12.4987 12.6833 12.6833 12.7672 12.7672 13.1025 13.1025 13.1860 13.1860 13.5373 13.5373 13.5626 13.5626 13.7575 13.7575 13.9794 13.9794 14.7293 14.7293 14.7851 14.7851 15.0670 15.0670 16.2507 16.2507 16.4305 16.4305 16.4718 16.4718 17.0741 17.0741 17.2758 17.2758 19.1668 19.1668 20.2633 20.2633 k = 0.5000 0.5000 0.1429 ( 3088 PWs) bands (ev): 3.0208 3.0208 7.4607 7.4607 7.5567 7.5567 8.5845 8.5845 9.5756 9.5756 9.7105 9.7105 9.7624 9.7624 10.2161 10.2161 10.3316 10.3316 10.6512 10.6512 10.7351 10.7351 11.6986 11.6986 11.8206 11.8206 11.8772 11.8772 12.1756 12.1756 12.3698 12.3698 12.5720 12.5720 12.6929 12.6929 12.7474 12.7474 13.0383 13.0383 13.1746 13.1746 13.4843 13.4843 13.5131 13.5131 13.7627 13.7627 13.9864 13.9864 14.7210 14.7210 14.7778 14.7778 15.0533 15.0533 16.2679 16.2679 16.4578 16.4578 16.5358 16.5358 17.0729 17.0729 17.2700 17.2700 19.2302 19.2302 20.3367 20.3367 k = 0.5000 0.5000 0.1548 ( 3088 PWs) bands (ev): 3.0210 3.0210 7.4581 7.4581 7.5562 7.5562 8.6026 8.6026 9.5915 9.5915 9.7109 9.7109 9.7671 9.7671 10.2374 10.2374 10.2754 10.2754 10.6564 10.6564 10.7441 10.7441 11.6926 11.6926 11.8355 11.8355 11.8837 11.8837 12.1588 12.1588 12.3638 12.3638 12.6451 12.6451 12.7051 12.7051 12.7233 12.7233 12.9780 12.9780 13.1658 13.1658 13.4341 13.4341 13.4673 13.4673 13.7684 13.7684 13.9931 13.9931 14.6951 14.6951 14.7705 14.7705 15.0503 15.0503 16.2778 16.2778 16.4902 16.4902 16.5981 16.5981 17.0722 17.0722 17.2632 17.2632 19.2960 19.2960 20.4165 20.4165 k = 0.5000 0.5000 0.1667 ( 3088 PWs) bands (ev): 3.0213 3.0213 7.4556 7.4556 7.5556 7.5556 8.6213 8.6213 9.6073 9.6073 9.7074 9.7074 9.7762 9.7762 10.2201 10.2201 10.2584 10.2584 10.6642 10.6642 10.7530 10.7530 11.6861 11.6861 11.8497 11.8497 11.8900 11.8900 12.1445 12.1445 12.3549 12.3549 12.6940 12.6940 12.6976 12.6976 12.7338 12.7338 12.9239 12.9239 13.1619 13.1619 13.3876 13.3876 13.4261 13.4261 13.7745 13.7745 13.9997 13.9997 14.6535 14.6535 14.7634 14.7634 15.0563 15.0563 16.2830 16.2830 16.5246 16.5246 16.6582 16.6582 17.0719 17.0719 17.2554 17.2554 19.3633 19.3633 20.5023 20.5023 k = 0.5000 0.5000 0.1786 ( 3088 PWs) bands (ev): 3.0215 3.0215 7.4533 7.4533 7.5551 7.5551 8.6401 8.6401 9.6225 9.6225 9.7022 9.7022 9.7876 9.7876 10.1671 10.1671 10.2787 10.2787 10.6734 10.6734 10.7618 10.7618 11.6788 11.6788 11.8632 11.8632 11.8963 11.8963 12.1325 12.1325 12.3441 12.3441 12.6593 12.6593 12.7166 12.7166 12.7864 12.7864 12.8775 12.8775 13.1649 13.1649 13.3467 13.3467 13.3910 13.3910 13.7807 13.7807 14.0059 14.0059 14.5997 14.5997 14.7565 14.7565 15.0679 15.0679 16.2856 16.2856 16.5584 16.5584 16.7156 16.7156 17.0721 17.0721 17.2466 17.2466 19.4311 19.4311 20.5937 20.5937 k = 0.5000 0.5000 0.1905 ( 3080 PWs) bands (ev): 3.0218 3.0218 7.4510 7.4510 7.5546 7.5546 8.6588 8.6588 9.6370 9.6370 9.6965 9.6965 9.7997 9.7997 10.1173 10.1173 10.2980 10.2980 10.6832 10.6832 10.7703 10.7703 11.6707 11.6707 11.8760 11.8760 11.9031 11.9031 12.1225 12.1225 12.3318 12.3318 12.6200 12.6200 12.7303 12.7303 12.8303 12.8303 12.8392 12.8392 13.1716 13.1716 13.3162 13.3162 13.3651 13.3651 13.7868 13.7868 14.0119 14.0119 14.5368 14.5368 14.7500 14.7500 15.0822 15.0822 16.2868 16.2868 16.5901 16.5901 16.7700 16.7700 17.0727 17.0727 17.2364 17.2364 19.4982 19.4982 20.6901 20.6901 k = 0.5000 0.5000 0.2024 ( 3064 PWs) bands (ev): 3.0220 3.0220 7.4489 7.4489 7.5541 7.5541 8.6770 8.6770 9.6504 9.6504 9.6909 9.6909 9.8117 9.8117 10.0715 10.0715 10.3162 10.3162 10.6932 10.6932 10.7784 10.7784 11.6621 11.6621 11.8881 11.8881 11.9111 11.9111 12.1139 12.1139 12.3184 12.3184 12.5782 12.5782 12.7442 12.7442 12.8083 12.8083 12.8585 12.8585 13.1685 13.1685 13.3003 13.3003 13.3596 13.3596 13.7925 13.7925 14.0173 14.0173 14.4671 14.4671 14.7439 14.7439 15.0972 15.0972 16.2873 16.2873 16.6189 16.6189 16.8211 16.8211 17.0737 17.0737 17.2250 17.2250 19.5635 19.5635 20.7906 20.7906 k = 0.5000 0.5000 0.2143 ( 3064 PWs) bands (ev): 3.0222 3.0222 7.4471 7.4471 7.5537 7.5537 8.6942 8.6942 9.6624 9.6624 9.6858 9.6858 9.8230 9.8230 10.0304 10.0304 10.3328 10.3328 10.7027 10.7027 10.7858 10.7858 11.6531 11.6531 11.8992 11.8992 11.9206 11.9206 12.1057 12.1057 12.3044 12.3044 12.5366 12.5366 12.7591 12.7591 12.7834 12.7834 12.8732 12.8732 13.1469 13.1469 13.2870 13.2870 13.3926 13.3926 13.7979 13.7979 14.0223 14.0223 14.3922 14.3922 14.7383 14.7383 15.1116 15.1116 16.2874 16.2874 16.6442 16.6442 16.8688 16.8688 17.0749 17.0749 17.2121 17.2121 19.6254 19.6254 20.8942 20.9022 k = 0.5000 0.5000 0.2262 ( 3064 PWs) bands (ev): 3.0224 3.0224 7.4454 7.4454 7.5533 7.5533 8.7100 8.7100 9.6726 9.6726 9.6813 9.6813 9.8332 9.8332 9.9945 9.9945 10.3475 10.3475 10.7116 10.7116 10.7924 10.7924 11.6443 11.6443 11.9094 11.9094 11.9321 11.9321 12.0968 12.0968 12.2904 12.2904 12.4980 12.4980 12.7632 12.7632 12.7753 12.7753 12.8793 12.8793 13.1155 13.1155 13.2721 13.2721 13.4546 13.4546 13.8026 13.8026 14.0267 14.0267 14.3132 14.3132 14.7334 14.7334 15.1247 15.1247 16.2873 16.2873 16.6658 16.6658 16.9130 16.9130 17.0763 17.0763 17.1975 17.1975 19.6823 19.6823 20.9742 20.9742 k = 0.5000 0.5000 0.2381 ( 3068 PWs) bands (ev): 3.0226 3.0226 7.4441 7.4441 7.5530 7.5530 8.7239 8.7239 9.6775 9.6775 9.6810 9.6810 9.8420 9.8420 9.9645 9.9645 10.3601 10.3601 10.7194 10.7194 10.7981 10.7981 11.6361 11.6361 11.9182 11.9182 11.9458 11.9458 12.0862 12.0862 12.2773 12.2773 12.4643 12.4643 12.7471 12.7471 12.7927 12.7927 12.8805 12.8805 13.0819 13.0819 13.2588 13.2588 13.5310 13.5310 13.8066 13.8066 14.0304 14.0304 14.2308 14.2308 14.7293 14.7293 15.1358 15.1358 16.2872 16.2872 16.6834 16.6834 16.9537 16.9537 17.0777 17.0777 17.1813 17.1813 19.7325 19.7325 21.0355 21.0355 k = 0.5000 0.5000 0.2500 ( 3080 PWs) bands (ev): 3.0227 3.0227 7.4430 7.4430 7.5527 7.5527 8.7353 8.7353 9.6745 9.6745 9.6875 9.6875 9.8492 9.8492 9.9409 9.9409 10.3703 10.3703 10.7257 10.7257 10.8026 10.8026 11.6290 11.6290 11.9256 11.9256 11.9616 11.9616 12.0733 12.0733 12.2658 12.2658 12.4373 12.4373 12.7346 12.7346 12.8110 12.8110 12.8791 12.8791 13.0502 13.0502 13.2481 13.2481 13.6146 13.6146 13.8098 13.8098 14.0333 14.0333 14.1458 14.1458 14.7260 14.7260 15.1447 15.1447 16.2871 16.2871 16.6971 16.6971 16.9907 16.9907 17.0789 17.0789 17.1634 17.1634 19.7741 19.7741 21.0841 21.0841 k = 0.5000 0.5000 0.2619 ( 3088 PWs) bands (ev): 3.0227 3.0227 7.4422 7.4422 7.5525 7.5525 8.7439 8.7439 9.6723 9.6723 9.6919 9.6919 9.8544 9.8544 9.9238 9.9238 10.3777 10.3777 10.7305 10.7305 10.8060 10.8060 11.6235 11.6235 11.9311 11.9311 11.9791 11.9791 12.0579 12.0579 12.2568 12.2568 12.4177 12.4177 12.7256 12.7256 12.8293 12.8293 12.8762 12.8762 13.0230 13.0230 13.2404 13.2404 13.7019 13.7019 13.8122 13.8122 14.0355 14.0355 14.0588 14.0588 14.7236 14.7236 15.1512 15.1512 16.2871 16.2871 16.7068 16.7068 17.0237 17.0237 17.0799 17.0799 17.1441 17.1441 19.8053 19.8053 21.1191 21.1191 k = 0.5000 0.5000 0.2738 ( 3096 PWs) bands (ev): 3.0228 3.0228 7.4417 7.4417 7.5524 7.5524 8.7492 8.7492 9.6710 9.6710 9.6944 9.6944 9.8576 9.8576 9.9136 9.9136 10.3823 10.3823 10.7334 10.7334 10.8080 10.8080 11.6201 11.6201 11.9346 11.9346 11.9973 11.9973 12.0410 12.0410 12.2511 12.2511 12.4060 12.4060 12.7202 12.7202 12.8458 12.8458 12.8713 12.8713 13.0038 13.0038 13.2358 13.2358 13.7909 13.7909 13.8136 13.8136 13.9703 13.9703 14.0368 14.0368 14.7221 14.7221 15.1552 15.1552 16.2870 16.2870 16.7126 16.7126 17.0511 17.0511 17.0805 17.0805 17.1250 17.1250 19.8248 19.8248 21.1400 21.1400 k = 0.5000 0.5000 0.2857 ( 3080 PWs) bands (ev): 3.0228 3.0228 7.4416 7.4416 7.5524 7.5524 8.7510 8.7510 9.6706 9.6706 9.6953 9.6953 9.8587 9.8587 9.9101 9.9101 10.3838 10.3838 10.7344 10.7344 10.8087 10.8087 11.6190 11.6190 11.9358 11.9358 12.0097 12.0097 12.0290 12.0290 12.2492 12.2492 12.4021 12.4021 12.7184 12.7184 12.8553 12.8553 12.8663 12.8663 12.9967 12.9967 13.2343 13.2343 13.8141 13.8141 13.8756 13.8756 13.8859 13.8859 14.0372 14.0372 14.7216 14.7216 15.1565 15.1565 16.2870 16.2870 16.7146 16.7146 17.0646 17.0646 17.0807 17.0807 17.1143 17.1143 19.8314 19.8314 21.1470 21.1470 Writing output data file AlPPt5.save init_run : 0.41s CPU 0.55s WALL ( 1 calls) electrons : 324.34s CPU 329.31s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 324.33s CPU 329.30s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.15s CPU 0.19s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.07s WALL ( 361 calls) cegterg : 303.11s CPU 307.38s WALL ( 701 calls) Called by sum_band: Called by *egterg: h_psi : 131.11s CPU 134.02s WALL ( 11221 calls) s_psi : 19.32s CPU 19.16s WALL ( 11221 calls) g_psi : 0.32s CPU 0.40s WALL ( 10159 calls) cdiaghg : 134.32s CPU 135.93s WALL ( 10520 calls) cegterg:over : 13.55s CPU 13.69s WALL ( 10159 calls) cegterg:upda : 10.37s CPU 10.32s WALL ( 10159 calls) cegterg:last : 5.87s CPU 5.96s WALL ( 1992 calls) cdiaghg:chol : 7.79s CPU 7.89s WALL ( 10520 calls) cdiaghg:inve : 5.62s CPU 5.66s WALL ( 10520 calls) cdiaghg:para : 9.76s CPU 10.06s WALL ( 21040 calls) Called by h_psi: h_psi:vloc : 92.33s CPU 94.63s WALL ( 11221 calls) h_psi:vnl : 38.42s CPU 38.98s WALL ( 11221 calls) add_vuspsi : 22.50s CPU 22.53s WALL ( 11221 calls) General routines calbec : 15.88s CPU 16.42s WALL ( 11221 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 83.10s CPU 85.13s WALL ( 1687224 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.30s WALL ( 722 calls) Parallel routines fft_scatter : 43.50s CPU 44.70s WALL ( 1687247 calls) PWSCF : 5m44.55s CPU 6m 3.94s WALL This run was terminated on: 19:47: 2 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=