Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:11: 6 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: ./YS2.save/ file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 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 30 18 5 1530 737 121 Max 31 19 6 1541 765 130 Sum 1093 673 213 55199 26979 4517 bravais-lattice index = 14 lattice parameter (alat) = 7.2943 a.u. unit-cell volume = 788.8954 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 40.0000 Ry charge density cutoff = 258.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.294342 celldm(2)= 1.000000 celldm(3)= 2.032642 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 2.032642 ) 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 0.491970 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Y 11.00 88.90590 Y( 1.00) 16 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) 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 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) 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 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) 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 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(14) = ( 0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) 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= 352 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 2) = ( 0.0000000 0.0121951 -0.0000000), wk = 0.0028409 k( 3) = ( 0.0000000 0.0243902 -0.0000000), wk = 0.0028409 k( 4) = ( 0.0000000 0.0365854 -0.0000000), wk = 0.0028409 k( 5) = ( 0.0000000 0.0487805 -0.0000000), wk = 0.0028409 k( 6) = ( 0.0000000 0.0609756 -0.0000000), wk = 0.0028409 k( 7) = ( 0.0000000 0.0731707 -0.0000000), wk = 0.0028409 k( 8) = ( 0.0000000 0.0853658 -0.0000000), wk = 0.0028409 k( 9) = ( 0.0000000 0.0975610 -0.0000000), wk = 0.0028409 k( 10) = ( 0.0000000 0.1097561 -0.0000000), wk = 0.0028409 k( 11) = ( 0.0000000 0.1219512 -0.0000000), wk = 0.0028409 k( 12) = ( 0.0000000 0.1341463 -0.0000000), wk = 0.0028409 k( 13) = ( 0.0000000 0.1463415 -0.0000000), wk = 0.0028409 k( 14) = ( 0.0000000 0.1585366 -0.0000000), wk = 0.0028409 k( 15) = ( 0.0000000 0.1707317 -0.0000000), wk = 0.0028409 k( 16) = ( 0.0000000 0.1829268 -0.0000000), wk = 0.0028409 k( 17) = ( 0.0000000 0.1951219 -0.0000000), wk = 0.0028409 k( 18) = ( 0.0000000 0.2073171 -0.0000000), wk = 0.0028409 k( 19) = ( 0.0000000 0.2195122 -0.0000000), wk = 0.0028409 k( 20) = ( 0.0000000 0.2317073 -0.0000000), wk = 0.0028409 k( 21) = ( 0.0000000 0.2439024 -0.0000000), wk = 0.0028409 k( 22) = ( 0.0000000 0.2560976 -0.0000000), wk = 0.0028409 k( 23) = ( 0.0000000 0.2682927 -0.0000000), wk = 0.0028409 k( 24) = ( 0.0000000 0.2804878 -0.0000000), wk = 0.0028409 k( 25) = ( 0.0000000 0.2926829 -0.0000000), wk = 0.0028409 k( 26) = ( 0.0000000 0.3048781 -0.0000000), wk = 0.0028409 k( 27) = ( 0.0000000 0.3170732 -0.0000000), wk = 0.0028409 k( 28) = ( 0.0000000 0.3292683 -0.0000000), wk = 0.0028409 k( 29) = ( 0.0000000 0.3414634 -0.0000000), wk = 0.0028409 k( 30) = ( 0.0000000 0.3536585 -0.0000000), wk = 0.0028409 k( 31) = ( 0.0000000 0.3658537 -0.0000000), wk = 0.0028409 k( 32) = ( 0.0000000 0.3780488 -0.0000000), wk = 0.0028409 k( 33) = ( 0.0000000 0.3902439 -0.0000000), wk = 0.0028409 k( 34) = ( 0.0000000 0.4024390 -0.0000000), wk = 0.0028409 k( 35) = ( 0.0000000 0.4146341 -0.0000000), wk = 0.0028409 k( 36) = ( 0.0000000 0.4268293 -0.0000000), wk = 0.0028409 k( 37) = ( 0.0000000 0.4390244 -0.0000000), wk = 0.0028409 k( 38) = ( 0.0000000 0.4512195 -0.0000000), wk = 0.0028409 k( 39) = ( 0.0000000 0.4634146 -0.0000000), wk = 0.0028409 k( 40) = ( 0.0000000 0.4756098 -0.0000000), wk = 0.0028409 k( 41) = ( 0.0000000 0.4878049 -0.0000000), wk = 0.0028409 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028409 k( 43) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028409 k( 44) = ( 0.0121951 0.5000000 -0.0000000), wk = 0.0028409 k( 45) = ( 0.0243902 0.5000000 -0.0000000), wk = 0.0028409 k( 46) = ( 0.0365854 0.5000000 -0.0000000), wk = 0.0028409 k( 47) = ( 0.0487805 0.5000000 -0.0000000), wk = 0.0028409 k( 48) = ( 0.0609756 0.5000000 -0.0000000), wk = 0.0028409 k( 49) = ( 0.0731707 0.5000000 -0.0000000), wk = 0.0028409 k( 50) = ( 0.0853658 0.5000000 -0.0000000), wk = 0.0028409 k( 51) = ( 0.0975610 0.5000000 -0.0000000), wk = 0.0028409 k( 52) = ( 0.1097561 0.5000000 -0.0000000), wk = 0.0028409 k( 53) = ( 0.1219512 0.5000000 -0.0000000), wk = 0.0028409 k( 54) = ( 0.1341463 0.5000000 -0.0000000), wk = 0.0028409 k( 55) = ( 0.1463415 0.5000000 -0.0000000), wk = 0.0028409 k( 56) = ( 0.1585366 0.5000000 -0.0000000), wk = 0.0028409 k( 57) = ( 0.1707317 0.5000000 -0.0000000), wk = 0.0028409 k( 58) = ( 0.1829268 0.5000000 -0.0000000), wk = 0.0028409 k( 59) = ( 0.1951219 0.5000000 -0.0000000), wk = 0.0028409 k( 60) = ( 0.2073171 0.5000000 -0.0000000), wk = 0.0028409 k( 61) = ( 0.2195122 0.5000000 -0.0000000), wk = 0.0028409 k( 62) = ( 0.2317073 0.5000000 -0.0000000), wk = 0.0028409 k( 63) = ( 0.2439024 0.5000000 -0.0000000), wk = 0.0028409 k( 64) = ( 0.2560976 0.5000000 -0.0000000), wk = 0.0028409 k( 65) = ( 0.2682927 0.5000000 -0.0000000), wk = 0.0028409 k( 66) = ( 0.2804878 0.5000000 -0.0000000), wk = 0.0028409 k( 67) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0028409 k( 68) = ( 0.3048781 0.5000000 -0.0000000), wk = 0.0028409 k( 69) = ( 0.3170732 0.5000000 -0.0000000), wk = 0.0028409 k( 70) = ( 0.3292683 0.5000000 -0.0000000), wk = 0.0028409 k( 71) = ( 0.3414634 0.5000000 -0.0000000), wk = 0.0028409 k( 72) = ( 0.3536585 0.5000000 -0.0000000), wk = 0.0028409 k( 73) = ( 0.3658537 0.5000000 -0.0000000), wk = 0.0028409 k( 74) = ( 0.3780488 0.5000000 -0.0000000), wk = 0.0028409 k( 75) = ( 0.3902439 0.5000000 -0.0000000), wk = 0.0028409 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0028409 k( 77) = ( 0.4146341 0.5000000 -0.0000000), wk = 0.0028409 k( 78) = ( 0.4268293 0.5000000 -0.0000000), wk = 0.0028409 k( 79) = ( 0.4390244 0.5000000 -0.0000000), wk = 0.0028409 k( 80) = ( 0.4512195 0.5000000 -0.0000000), wk = 0.0028409 k( 81) = ( 0.4634146 0.5000000 -0.0000000), wk = 0.0028409 k( 82) = ( 0.4756098 0.5000000 -0.0000000), wk = 0.0028409 k( 83) = ( 0.4878049 0.5000000 -0.0000000), wk = 0.0028409 k( 84) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 85) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 86) = ( 0.4913793 0.4913793 -0.0000000), wk = 0.0028409 k( 87) = ( 0.4827586 0.4827586 -0.0000000), wk = 0.0028409 k( 88) = ( 0.4741379 0.4741379 -0.0000000), wk = 0.0028409 k( 89) = ( 0.4655172 0.4655172 -0.0000000), wk = 0.0028409 k( 90) = ( 0.4568966 0.4568965 -0.0000000), wk = 0.0028409 k( 91) = ( 0.4482759 0.4482759 -0.0000000), wk = 0.0028409 k( 92) = ( 0.4396552 0.4396552 -0.0000000), wk = 0.0028409 k( 93) = ( 0.4310345 0.4310345 -0.0000000), wk = 0.0028409 k( 94) = ( 0.4224138 0.4224138 -0.0000000), wk = 0.0028409 k( 95) = ( 0.4137931 0.4137931 -0.0000000), wk = 0.0028409 k( 96) = ( 0.4051724 0.4051724 -0.0000000), wk = 0.0028409 k( 97) = ( 0.3965517 0.3965517 -0.0000000), wk = 0.0028409 k( 98) = ( 0.3879310 0.3879310 -0.0000000), wk = 0.0028409 k( 99) = ( 0.3793103 0.3793103 -0.0000000), wk = 0.0028409 k( 100) = ( 0.3706897 0.3706897 -0.0000000), wk = 0.0028409 k( 101) = ( 0.3620690 0.3620690 -0.0000000), wk = 0.0028409 k( 102) = ( 0.3534483 0.3534483 -0.0000000), wk = 0.0028409 k( 103) = ( 0.3448276 0.3448276 -0.0000000), wk = 0.0028409 k( 104) = ( 0.3362069 0.3362069 -0.0000000), wk = 0.0028409 k( 105) = ( 0.3275862 0.3275862 -0.0000000), wk = 0.0028409 k( 106) = ( 0.3189655 0.3189655 -0.0000000), wk = 0.0028409 k( 107) = ( 0.3103448 0.3103448 -0.0000000), wk = 0.0028409 k( 108) = ( 0.3017241 0.3017241 -0.0000000), wk = 0.0028409 k( 109) = ( 0.2931034 0.2931034 -0.0000000), wk = 0.0028409 k( 110) = ( 0.2844828 0.2844828 -0.0000000), wk = 0.0028409 k( 111) = ( 0.2758621 0.2758621 -0.0000000), wk = 0.0028409 k( 112) = ( 0.2672414 0.2672414 -0.0000000), wk = 0.0028409 k( 113) = ( 0.2586207 0.2586207 -0.0000000), wk = 0.0028409 k( 114) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0028409 k( 115) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0028409 k( 116) = ( 0.2327586 0.2327586 -0.0000000), wk = 0.0028409 k( 117) = ( 0.2241379 0.2241379 -0.0000000), wk = 0.0028409 k( 118) = ( 0.2155172 0.2155172 -0.0000000), wk = 0.0028409 k( 119) = ( 0.2068966 0.2068965 -0.0000000), wk = 0.0028409 k( 120) = ( 0.1982759 0.1982759 -0.0000000), wk = 0.0028409 k( 121) = ( 0.1896552 0.1896552 -0.0000000), wk = 0.0028409 k( 122) = ( 0.1810345 0.1810345 -0.0000000), wk = 0.0028409 k( 123) = ( 0.1724138 0.1724138 -0.0000000), wk = 0.0028409 k( 124) = ( 0.1637931 0.1637931 -0.0000000), wk = 0.0028409 k( 125) = ( 0.1551724 0.1551724 -0.0000000), wk = 0.0028409 k( 126) = ( 0.1465517 0.1465517 -0.0000000), wk = 0.0028409 k( 127) = ( 0.1379310 0.1379310 -0.0000000), wk = 0.0028409 k( 128) = ( 0.1293103 0.1293103 -0.0000000), wk = 0.0028409 k( 129) = ( 0.1206897 0.1206897 -0.0000000), wk = 0.0028409 k( 130) = ( 0.1120690 0.1120690 -0.0000000), wk = 0.0028409 k( 131) = ( 0.1034483 0.1034483 -0.0000000), wk = 0.0028409 k( 132) = ( 0.0948276 0.0948276 -0.0000000), wk = 0.0028409 k( 133) = ( 0.0862069 0.0862069 -0.0000000), wk = 0.0028409 k( 134) = ( 0.0775862 0.0775862 -0.0000000), wk = 0.0028409 k( 135) = ( 0.0689655 0.0689655 -0.0000000), wk = 0.0028409 k( 136) = ( 0.0603448 0.0603448 -0.0000000), wk = 0.0028409 k( 137) = ( 0.0517241 0.0517241 -0.0000000), wk = 0.0028409 k( 138) = ( 0.0431035 0.0431034 -0.0000000), wk = 0.0028409 k( 139) = ( 0.0344828 0.0344828 -0.0000000), wk = 0.0028409 k( 140) = ( 0.0258621 0.0258621 -0.0000000), wk = 0.0028409 k( 141) = ( 0.0172414 0.0172414 -0.0000000), wk = 0.0028409 k( 142) = ( 0.0086207 0.0086207 -0.0000000), wk = 0.0028409 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 145) = ( 0.0000000 0.0000000 0.0117136), wk = 0.0028409 k( 146) = ( 0.0000000 0.0000000 0.0234272), wk = 0.0028409 k( 147) = ( 0.0000000 0.0000000 0.0351407), wk = 0.0028409 k( 148) = ( 0.0000000 0.0000000 0.0468543), wk = 0.0028409 k( 149) = ( 0.0000000 0.0000000 0.0585679), wk = 0.0028409 k( 150) = ( 0.0000000 0.0000000 0.0702815), wk = 0.0028409 k( 151) = ( 0.0000000 0.0000000 0.0819951), wk = 0.0028409 k( 152) = ( 0.0000000 0.0000000 0.0937087), wk = 0.0028409 k( 153) = ( 0.0000000 0.0000000 0.1054222), wk = 0.0028409 k( 154) = ( 0.0000000 0.0000000 0.1171358), wk = 0.0028409 k( 155) = ( 0.0000000 0.0000000 0.1288494), wk = 0.0028409 k( 156) = ( 0.0000000 0.0000000 0.1405630), wk = 0.0028409 k( 157) = ( 0.0000000 0.0000000 0.1522766), wk = 0.0028409 k( 158) = ( 0.0000000 0.0000000 0.1639901), wk = 0.0028409 k( 159) = ( 0.0000000 0.0000000 0.1757037), wk = 0.0028409 k( 160) = ( 0.0000000 0.0000000 0.1874173), wk = 0.0028409 k( 161) = ( 0.0000000 0.0000000 0.1991309), wk = 0.0028409 k( 162) = ( 0.0000000 0.0000000 0.2108445), wk = 0.0028409 k( 163) = ( 0.0000000 0.0000000 0.2225581), wk = 0.0028409 k( 164) = ( 0.0000000 0.0000000 0.2342716), wk = 0.0028409 k( 165) = ( 0.0000000 0.0000000 0.2459852), wk = 0.0028409 k( 166) = ( 0.0000000 0.0000000 0.2459852), wk = 0.0028409 k( 167) = ( 0.0000000 0.0121951 0.2459852), wk = 0.0028409 k( 168) = ( 0.0000000 0.0243902 0.2459852), wk = 0.0028409 k( 169) = ( 0.0000000 0.0365854 0.2459852), wk = 0.0028409 k( 170) = ( 0.0000000 0.0487805 0.2459852), wk = 0.0028409 k( 171) = ( 0.0000000 0.0609756 0.2459852), wk = 0.0028409 k( 172) = ( 0.0000000 0.0731707 0.2459852), wk = 0.0028409 k( 173) = ( 0.0000000 0.0853658 0.2459852), wk = 0.0028409 k( 174) = ( 0.0000000 0.0975610 0.2459852), wk = 0.0028409 k( 175) = ( 0.0000000 0.1097561 0.2459852), wk = 0.0028409 k( 176) = ( 0.0000000 0.1219512 0.2459852), wk = 0.0028409 k( 177) = ( 0.0000000 0.1341463 0.2459852), wk = 0.0028409 k( 178) = ( 0.0000000 0.1463415 0.2459852), wk = 0.0028409 k( 179) = ( 0.0000000 0.1585366 0.2459852), wk = 0.0028409 k( 180) = ( 0.0000000 0.1707317 0.2459852), wk = 0.0028409 k( 181) = ( 0.0000000 0.1829268 0.2459852), wk = 0.0028409 k( 182) = ( 0.0000000 0.1951219 0.2459852), wk = 0.0028409 k( 183) = ( 0.0000000 0.2073171 0.2459852), wk = 0.0028409 k( 184) = ( 0.0000000 0.2195122 0.2459852), wk = 0.0028409 k( 185) = ( 0.0000000 0.2317073 0.2459852), wk = 0.0028409 k( 186) = ( 0.0000000 0.2439024 0.2459852), wk = 0.0028409 k( 187) = ( 0.0000000 0.2560976 0.2459852), wk = 0.0028409 k( 188) = ( 0.0000000 0.2682927 0.2459852), wk = 0.0028409 k( 189) = ( 0.0000000 0.2804878 0.2459852), wk = 0.0028409 k( 190) = ( 0.0000000 0.2926829 0.2459852), wk = 0.0028409 k( 191) = ( 0.0000000 0.3048781 0.2459852), wk = 0.0028409 k( 192) = ( 0.0000000 0.3170732 0.2459852), wk = 0.0028409 k( 193) = ( 0.0000000 0.3292683 0.2459852), wk = 0.0028409 k( 194) = ( 0.0000000 0.3414634 0.2459852), wk = 0.0028409 k( 195) = ( 0.0000000 0.3536585 0.2459852), wk = 0.0028409 k( 196) = ( 0.0000000 0.3658537 0.2459852), wk = 0.0028409 k( 197) = ( 0.0000000 0.3780488 0.2459852), wk = 0.0028409 k( 198) = ( 0.0000000 0.3902439 0.2459852), wk = 0.0028409 k( 199) = ( 0.0000000 0.4024390 0.2459852), wk = 0.0028409 k( 200) = ( 0.0000000 0.4146341 0.2459852), wk = 0.0028409 k( 201) = ( 0.0000000 0.4268293 0.2459852), wk = 0.0028409 k( 202) = ( 0.0000000 0.4390244 0.2459852), wk = 0.0028409 k( 203) = ( 0.0000000 0.4512195 0.2459852), wk = 0.0028409 k( 204) = ( 0.0000000 0.4634146 0.2459852), wk = 0.0028409 k( 205) = ( 0.0000000 0.4756098 0.2459852), wk = 0.0028409 k( 206) = ( 0.0000000 0.4878049 0.2459852), wk = 0.0028409 k( 207) = ( 0.0000000 0.5000000 0.2459852), wk = 0.0028409 k( 208) = ( 0.0000000 0.5000000 0.2459852), wk = 0.0028409 k( 209) = ( 0.0121951 0.5000000 0.2459852), wk = 0.0028409 k( 210) = ( 0.0243902 0.5000000 0.2459852), wk = 0.0028409 k( 211) = ( 0.0365854 0.5000000 0.2459852), wk = 0.0028409 k( 212) = ( 0.0487805 0.5000000 0.2459852), wk = 0.0028409 k( 213) = ( 0.0609756 0.5000000 0.2459852), wk = 0.0028409 k( 214) = ( 0.0731707 0.5000000 0.2459852), wk = 0.0028409 k( 215) = ( 0.0853658 0.5000000 0.2459852), wk = 0.0028409 k( 216) = ( 0.0975610 0.5000000 0.2459852), wk = 0.0028409 k( 217) = ( 0.1097561 0.5000000 0.2459852), wk = 0.0028409 k( 218) = ( 0.1219512 0.5000000 0.2459852), wk = 0.0028409 k( 219) = ( 0.1341463 0.5000000 0.2459852), wk = 0.0028409 k( 220) = ( 0.1463415 0.5000000 0.2459852), wk = 0.0028409 k( 221) = ( 0.1585366 0.5000000 0.2459852), wk = 0.0028409 k( 222) = ( 0.1707317 0.5000000 0.2459852), wk = 0.0028409 k( 223) = ( 0.1829268 0.5000000 0.2459852), wk = 0.0028409 k( 224) = ( 0.1951219 0.5000000 0.2459852), wk = 0.0028409 k( 225) = ( 0.2073171 0.5000000 0.2459852), wk = 0.0028409 k( 226) = ( 0.2195122 0.5000000 0.2459852), wk = 0.0028409 k( 227) = ( 0.2317073 0.5000000 0.2459852), wk = 0.0028409 k( 228) = ( 0.2439024 0.5000000 0.2459852), wk = 0.0028409 k( 229) = ( 0.2560976 0.5000000 0.2459852), wk = 0.0028409 k( 230) = ( 0.2682927 0.5000000 0.2459852), wk = 0.0028409 k( 231) = ( 0.2804878 0.5000000 0.2459852), wk = 0.0028409 k( 232) = ( 0.2926829 0.5000000 0.2459852), wk = 0.0028409 k( 233) = ( 0.3048781 0.5000000 0.2459852), wk = 0.0028409 k( 234) = ( 0.3170732 0.5000000 0.2459852), wk = 0.0028409 k( 235) = ( 0.3292683 0.5000000 0.2459852), wk = 0.0028409 k( 236) = ( 0.3414634 0.5000000 0.2459852), wk = 0.0028409 k( 237) = ( 0.3536585 0.5000000 0.2459852), wk = 0.0028409 k( 238) = ( 0.3658537 0.5000000 0.2459852), wk = 0.0028409 k( 239) = ( 0.3780488 0.5000000 0.2459852), wk = 0.0028409 k( 240) = ( 0.3902439 0.5000000 0.2459852), wk = 0.0028409 k( 241) = ( 0.4024390 0.5000000 0.2459852), wk = 0.0028409 k( 242) = ( 0.4146341 0.5000000 0.2459852), wk = 0.0028409 k( 243) = ( 0.4268293 0.5000000 0.2459852), wk = 0.0028409 k( 244) = ( 0.4390244 0.5000000 0.2459852), wk = 0.0028409 k( 245) = ( 0.4512195 0.5000000 0.2459852), wk = 0.0028409 k( 246) = ( 0.4634146 0.5000000 0.2459852), wk = 0.0028409 k( 247) = ( 0.4756098 0.5000000 0.2459852), wk = 0.0028409 k( 248) = ( 0.4878049 0.5000000 0.2459852), wk = 0.0028409 k( 249) = ( 0.5000000 0.5000000 0.2459852), wk = 0.0028409 k( 250) = ( 0.5000000 0.5000000 0.2459852), wk = 0.0028409 k( 251) = ( 0.4913793 0.4913793 0.2459852), wk = 0.0028409 k( 252) = ( 0.4827586 0.4827586 0.2459852), wk = 0.0028409 k( 253) = ( 0.4741379 0.4741379 0.2459852), wk = 0.0028409 k( 254) = ( 0.4655172 0.4655172 0.2459852), wk = 0.0028409 k( 255) = ( 0.4568966 0.4568965 0.2459852), wk = 0.0028409 k( 256) = ( 0.4482759 0.4482759 0.2459852), wk = 0.0028409 k( 257) = ( 0.4396552 0.4396552 0.2459852), wk = 0.0028409 k( 258) = ( 0.4310345 0.4310345 0.2459852), wk = 0.0028409 k( 259) = ( 0.4224138 0.4224138 0.2459852), wk = 0.0028409 k( 260) = ( 0.4137931 0.4137931 0.2459852), wk = 0.0028409 k( 261) = ( 0.4051724 0.4051724 0.2459852), wk = 0.0028409 k( 262) = ( 0.3965517 0.3965517 0.2459852), wk = 0.0028409 k( 263) = ( 0.3879310 0.3879310 0.2459852), wk = 0.0028409 k( 264) = ( 0.3793103 0.3793103 0.2459852), wk = 0.0028409 k( 265) = ( 0.3706897 0.3706897 0.2459852), wk = 0.0028409 k( 266) = ( 0.3620690 0.3620690 0.2459852), wk = 0.0028409 k( 267) = ( 0.3534483 0.3534483 0.2459852), wk = 0.0028409 k( 268) = ( 0.3448276 0.3448276 0.2459852), wk = 0.0028409 k( 269) = ( 0.3362069 0.3362069 0.2459852), wk = 0.0028409 k( 270) = ( 0.3275862 0.3275862 0.2459852), wk = 0.0028409 k( 271) = ( 0.3189655 0.3189655 0.2459852), wk = 0.0028409 k( 272) = ( 0.3103448 0.3103448 0.2459852), wk = 0.0028409 k( 273) = ( 0.3017241 0.3017241 0.2459852), wk = 0.0028409 k( 274) = ( 0.2931034 0.2931034 0.2459852), wk = 0.0028409 k( 275) = ( 0.2844828 0.2844828 0.2459852), wk = 0.0028409 k( 276) = ( 0.2758621 0.2758621 0.2459852), wk = 0.0028409 k( 277) = ( 0.2672414 0.2672414 0.2459852), wk = 0.0028409 k( 278) = ( 0.2586207 0.2586207 0.2459852), wk = 0.0028409 k( 279) = ( 0.2500000 0.2500000 0.2459852), wk = 0.0028409 k( 280) = ( 0.2413793 0.2413793 0.2459852), wk = 0.0028409 k( 281) = ( 0.2327586 0.2327586 0.2459852), wk = 0.0028409 k( 282) = ( 0.2241379 0.2241379 0.2459852), wk = 0.0028409 k( 283) = ( 0.2155172 0.2155172 0.2459852), wk = 0.0028409 k( 284) = ( 0.2068966 0.2068965 0.2459852), wk = 0.0028409 k( 285) = ( 0.1982759 0.1982759 0.2459852), wk = 0.0028409 k( 286) = ( 0.1896552 0.1896552 0.2459852), wk = 0.0028409 k( 287) = ( 0.1810345 0.1810345 0.2459852), wk = 0.0028409 k( 288) = ( 0.1724138 0.1724138 0.2459852), wk = 0.0028409 k( 289) = ( 0.1637931 0.1637931 0.2459852), wk = 0.0028409 k( 290) = ( 0.1551724 0.1551724 0.2459852), wk = 0.0028409 k( 291) = ( 0.1465517 0.1465517 0.2459852), wk = 0.0028409 k( 292) = ( 0.1379310 0.1379310 0.2459852), wk = 0.0028409 k( 293) = ( 0.1293103 0.1293103 0.2459852), wk = 0.0028409 k( 294) = ( 0.1206897 0.1206897 0.2459852), wk = 0.0028409 k( 295) = ( 0.1120690 0.1120690 0.2459852), wk = 0.0028409 k( 296) = ( 0.1034483 0.1034483 0.2459852), wk = 0.0028409 k( 297) = ( 0.0948276 0.0948276 0.2459852), wk = 0.0028409 k( 298) = ( 0.0862069 0.0862069 0.2459852), wk = 0.0028409 k( 299) = ( 0.0775862 0.0775862 0.2459852), wk = 0.0028409 k( 300) = ( 0.0689655 0.0689655 0.2459852), wk = 0.0028409 k( 301) = ( 0.0603448 0.0603448 0.2459852), wk = 0.0028409 k( 302) = ( 0.0517241 0.0517241 0.2459852), wk = 0.0028409 k( 303) = ( 0.0431035 0.0431034 0.2459852), wk = 0.0028409 k( 304) = ( 0.0344828 0.0344828 0.2459852), wk = 0.0028409 k( 305) = ( 0.0258621 0.0258621 0.2459852), wk = 0.0028409 k( 306) = ( 0.0172414 0.0172414 0.2459852), wk = 0.0028409 k( 307) = ( 0.0086207 0.0086207 0.2459852), wk = 0.0028409 k( 308) = ( 0.0000000 0.0000000 0.2459852), wk = 0.0028409 k( 309) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028409 k( 310) = ( 0.0000000 0.5000000 0.0117136), wk = 0.0028409 k( 311) = ( 0.0000000 0.5000000 0.0234272), wk = 0.0028409 k( 312) = ( 0.0000000 0.5000000 0.0351407), wk = 0.0028409 k( 313) = ( 0.0000000 0.5000000 0.0468543), wk = 0.0028409 k( 314) = ( 0.0000000 0.5000000 0.0585679), wk = 0.0028409 k( 315) = ( 0.0000000 0.5000000 0.0702815), wk = 0.0028409 k( 316) = ( 0.0000000 0.5000000 0.0819951), wk = 0.0028409 k( 317) = ( 0.0000000 0.5000000 0.0937087), wk = 0.0028409 k( 318) = ( 0.0000000 0.5000000 0.1054222), wk = 0.0028409 k( 319) = ( 0.0000000 0.5000000 0.1171358), wk = 0.0028409 k( 320) = ( 0.0000000 0.5000000 0.1288494), wk = 0.0028409 k( 321) = ( 0.0000000 0.5000000 0.1405630), wk = 0.0028409 k( 322) = ( 0.0000000 0.5000000 0.1522766), wk = 0.0028409 k( 323) = ( 0.0000000 0.5000000 0.1639901), wk = 0.0028409 k( 324) = ( 0.0000000 0.5000000 0.1757037), wk = 0.0028409 k( 325) = ( 0.0000000 0.5000000 0.1874173), wk = 0.0028409 k( 326) = ( 0.0000000 0.5000000 0.1991309), wk = 0.0028409 k( 327) = ( 0.0000000 0.5000000 0.2108445), wk = 0.0028409 k( 328) = ( 0.0000000 0.5000000 0.2225581), wk = 0.0028409 k( 329) = ( 0.0000000 0.5000000 0.2342716), wk = 0.0028409 k( 330) = ( 0.0000000 0.5000000 0.2459852), wk = 0.0028409 k( 331) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 332) = ( 0.5000000 0.5000000 0.0117136), wk = 0.0028409 k( 333) = ( 0.5000000 0.5000000 0.0234272), wk = 0.0028409 k( 334) = ( 0.5000000 0.5000000 0.0351407), wk = 0.0028409 k( 335) = ( 0.5000000 0.5000000 0.0468543), wk = 0.0028409 k( 336) = ( 0.5000000 0.5000000 0.0585679), wk = 0.0028409 k( 337) = ( 0.5000000 0.5000000 0.0702815), wk = 0.0028409 k( 338) = ( 0.5000000 0.5000000 0.0819951), wk = 0.0028409 k( 339) = ( 0.5000000 0.5000000 0.0937087), wk = 0.0028409 k( 340) = ( 0.5000000 0.5000000 0.1054222), wk = 0.0028409 k( 341) = ( 0.5000000 0.5000000 0.1171358), wk = 0.0028409 k( 342) = ( 0.5000000 0.5000000 0.1288494), wk = 0.0028409 k( 343) = ( 0.5000000 0.5000000 0.1405630), wk = 0.0028409 k( 344) = ( 0.5000000 0.5000000 0.1522766), wk = 0.0028409 k( 345) = ( 0.5000000 0.5000000 0.1639901), wk = 0.0028409 k( 346) = ( 0.5000000 0.5000000 0.1757037), wk = 0.0028409 k( 347) = ( 0.5000000 0.5000000 0.1874173), wk = 0.0028409 k( 348) = ( 0.5000000 0.5000000 0.1991309), wk = 0.0028409 k( 349) = ( 0.5000000 0.5000000 0.2108445), wk = 0.0028409 k( 350) = ( 0.5000000 0.5000000 0.2225581), wk = 0.0028409 k( 351) = ( 0.5000000 0.5000000 0.2342716), wk = 0.0028409 k( 352) = ( 0.5000000 0.5000000 0.2459852), wk = 0.0028409 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 2) = ( 0.0000000 0.0121951 0.0000000), wk = 0.0028409 k( 3) = ( 0.0000000 0.0243902 0.0000000), wk = 0.0028409 k( 4) = ( 0.0000000 0.0365854 0.0000000), wk = 0.0028409 k( 5) = ( 0.0000000 0.0487805 -0.0000000), wk = 0.0028409 k( 6) = ( 0.0000000 0.0609756 0.0000000), wk = 0.0028409 k( 7) = ( 0.0000000 0.0731707 0.0000000), wk = 0.0028409 k( 8) = ( 0.0000000 0.0853658 0.0000000), wk = 0.0028409 k( 9) = ( 0.0000000 0.0975610 -0.0000000), wk = 0.0028409 k( 10) = ( 0.0000000 0.1097561 0.0000000), wk = 0.0028409 k( 11) = ( 0.0000000 0.1219512 0.0000000), wk = 0.0028409 k( 12) = ( 0.0000000 0.1341463 0.0000000), wk = 0.0028409 k( 13) = ( 0.0000000 0.1463415 0.0000000), wk = 0.0028409 k( 14) = ( 0.0000000 0.1585366 0.0000000), wk = 0.0028409 k( 15) = ( 0.0000000 0.1707317 -0.0000000), wk = 0.0028409 k( 16) = ( 0.0000000 0.1829268 0.0000000), wk = 0.0028409 k( 17) = ( 0.0000000 0.1951219 0.0000000), wk = 0.0028409 k( 18) = ( 0.0000000 0.2073171 -0.0000000), wk = 0.0028409 k( 19) = ( 0.0000000 0.2195122 0.0000000), wk = 0.0028409 k( 20) = ( 0.0000000 0.2317073 0.0000000), wk = 0.0028409 k( 21) = ( 0.0000000 0.2439024 0.0000000), wk = 0.0028409 k( 22) = ( 0.0000000 0.2560976 -0.0000000), wk = 0.0028409 k( 23) = ( 0.0000000 0.2682927 0.0000000), wk = 0.0028409 k( 24) = ( 0.0000000 0.2804878 -0.0000000), wk = 0.0028409 k( 25) = ( 0.0000000 0.2926829 0.0000000), wk = 0.0028409 k( 26) = ( 0.0000000 0.3048781 0.0000000), wk = 0.0028409 k( 27) = ( 0.0000000 0.3170732 0.0000000), wk = 0.0028409 k( 28) = ( 0.0000000 0.3292683 0.0000000), wk = 0.0028409 k( 29) = ( 0.0000000 0.3414634 0.0000000), wk = 0.0028409 k( 30) = ( 0.0000000 0.3536585 0.0000000), wk = 0.0028409 k( 31) = ( 0.0000000 0.3658537 0.0000000), wk = 0.0028409 k( 32) = ( 0.0000000 0.3780488 -0.0000000), wk = 0.0028409 k( 33) = ( 0.0000000 0.3902439 0.0000000), wk = 0.0028409 k( 34) = ( 0.0000000 0.4024390 0.0000000), wk = 0.0028409 k( 35) = ( 0.0000000 0.4146341 -0.0000000), wk = 0.0028409 k( 36) = ( 0.0000000 0.4268293 0.0000000), wk = 0.0028409 k( 37) = ( 0.0000000 0.4390244 0.0000000), wk = 0.0028409 k( 38) = ( 0.0000000 0.4512195 0.0000000), wk = 0.0028409 k( 39) = ( 0.0000000 0.4634146 0.0000000), wk = 0.0028409 k( 40) = ( 0.0000000 0.4756098 -0.0000000), wk = 0.0028409 k( 41) = ( 0.0000000 0.4878049 0.0000000), wk = 0.0028409 k( 42) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0028409 k( 43) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0028409 k( 44) = ( 0.0121951 0.5000000 -0.0000000), wk = 0.0028409 k( 45) = ( 0.0243902 0.5000000 0.0000000), wk = 0.0028409 k( 46) = ( 0.0365854 0.5000000 0.0000000), wk = 0.0028409 k( 47) = ( 0.0487805 0.5000000 -0.0000000), wk = 0.0028409 k( 48) = ( 0.0609756 0.5000000 0.0000000), wk = 0.0028409 k( 49) = ( 0.0731707 0.5000000 0.0000000), wk = 0.0028409 k( 50) = ( 0.0853658 0.5000000 -0.0000000), wk = 0.0028409 k( 51) = ( 0.0975610 0.5000000 0.0000000), wk = 0.0028409 k( 52) = ( 0.1097561 0.5000000 -0.0000000), wk = 0.0028409 k( 53) = ( 0.1219512 0.5000000 0.0000000), wk = 0.0028409 k( 54) = ( 0.1341463 0.5000000 0.0000000), wk = 0.0028409 k( 55) = ( 0.1463415 0.5000000 0.0000000), wk = 0.0028409 k( 56) = ( 0.1585366 0.5000000 0.0000000), wk = 0.0028409 k( 57) = ( 0.1707317 0.5000000 0.0000000), wk = 0.0028409 k( 58) = ( 0.1829268 0.5000000 0.0000000), wk = 0.0028409 k( 59) = ( 0.1951219 0.5000000 0.0000000), wk = 0.0028409 k( 60) = ( 0.2073171 0.5000000 0.0000000), wk = 0.0028409 k( 61) = ( 0.2195122 0.5000000 0.0000000), wk = 0.0028409 k( 62) = ( 0.2317073 0.5000000 0.0000000), wk = 0.0028409 k( 63) = ( 0.2439024 0.5000000 0.0000000), wk = 0.0028409 k( 64) = ( 0.2560976 0.5000000 0.0000000), wk = 0.0028409 k( 65) = ( 0.2682927 0.5000000 -0.0000000), wk = 0.0028409 k( 66) = ( 0.2804878 0.5000000 0.0000000), wk = 0.0028409 k( 67) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0028409 k( 68) = ( 0.3048781 0.5000000 -0.0000000), wk = 0.0028409 k( 69) = ( 0.3170732 0.5000000 -0.0000000), wk = 0.0028409 k( 70) = ( 0.3292683 0.5000000 -0.0000000), wk = 0.0028409 k( 71) = ( 0.3414634 0.5000000 0.0000000), wk = 0.0028409 k( 72) = ( 0.3536585 0.5000000 -0.0000000), wk = 0.0028409 k( 73) = ( 0.3658537 0.5000000 0.0000000), wk = 0.0028409 k( 74) = ( 0.3780488 0.5000000 -0.0000000), wk = 0.0028409 k( 75) = ( 0.3902439 0.5000000 -0.0000000), wk = 0.0028409 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0028409 k( 77) = ( 0.4146341 0.5000000 -0.0000000), wk = 0.0028409 k( 78) = ( 0.4268293 0.5000000 -0.0000000), wk = 0.0028409 k( 79) = ( 0.4390244 0.5000000 0.0000000), wk = 0.0028409 k( 80) = ( 0.4512195 0.5000000 0.0000000), wk = 0.0028409 k( 81) = ( 0.4634146 0.5000000 0.0000000), wk = 0.0028409 k( 82) = ( 0.4756098 0.5000000 0.0000000), wk = 0.0028409 k( 83) = ( 0.4878049 0.5000000 0.0000000), wk = 0.0028409 k( 84) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0028409 k( 85) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0028409 k( 86) = ( 0.4913793 0.4913793 -0.0000000), wk = 0.0028409 k( 87) = ( 0.4827586 0.4827586 -0.0000000), wk = 0.0028409 k( 88) = ( 0.4741379 0.4741379 0.0000000), wk = 0.0028409 k( 89) = ( 0.4655172 0.4655172 -0.0000000), wk = 0.0028409 k( 90) = ( 0.4568966 0.4568966 -0.0000000), wk = 0.0028409 k( 91) = ( 0.4482759 0.4482759 -0.0000000), wk = 0.0028409 k( 92) = ( 0.4396552 0.4396552 0.0000000), wk = 0.0028409 k( 93) = ( 0.4310345 0.4310345 0.0000000), wk = 0.0028409 k( 94) = ( 0.4224138 0.4224138 0.0000000), wk = 0.0028409 k( 95) = ( 0.4137931 0.4137931 -0.0000000), wk = 0.0028409 k( 96) = ( 0.4051724 0.4051724 0.0000000), wk = 0.0028409 k( 97) = ( 0.3965517 0.3965517 -0.0000000), wk = 0.0028409 k( 98) = ( 0.3879310 0.3879310 0.0000000), wk = 0.0028409 k( 99) = ( 0.3793103 0.3793103 0.0000000), wk = 0.0028409 k( 100) = ( 0.3706897 0.3706897 -0.0000000), wk = 0.0028409 k( 101) = ( 0.3620690 0.3620690 -0.0000000), wk = 0.0028409 k( 102) = ( 0.3534483 0.3534483 -0.0000000), wk = 0.0028409 k( 103) = ( 0.3448276 0.3448276 -0.0000000), wk = 0.0028409 k( 104) = ( 0.3362069 0.3362069 0.0000000), wk = 0.0028409 k( 105) = ( 0.3275862 0.3275862 -0.0000000), wk = 0.0028409 k( 106) = ( 0.3189655 0.3189655 -0.0000000), wk = 0.0028409 k( 107) = ( 0.3103448 0.3103448 -0.0000000), wk = 0.0028409 k( 108) = ( 0.3017241 0.3017241 0.0000000), wk = 0.0028409 k( 109) = ( 0.2931034 0.2931034 0.0000000), wk = 0.0028409 k( 110) = ( 0.2844828 0.2844828 -0.0000000), wk = 0.0028409 k( 111) = ( 0.2758621 0.2758621 0.0000000), wk = 0.0028409 k( 112) = ( 0.2672414 0.2672414 0.0000000), wk = 0.0028409 k( 113) = ( 0.2586207 0.2586207 0.0000000), wk = 0.0028409 k( 114) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0028409 k( 115) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0028409 k( 116) = ( 0.2327586 0.2327586 -0.0000000), wk = 0.0028409 k( 117) = ( 0.2241379 0.2241379 -0.0000000), wk = 0.0028409 k( 118) = ( 0.2155172 0.2155172 0.0000000), wk = 0.0028409 k( 119) = ( 0.2068966 0.2068966 -0.0000000), wk = 0.0028409 k( 120) = ( 0.1982759 0.1982759 -0.0000000), wk = 0.0028409 k( 121) = ( 0.1896552 0.1896552 0.0000000), wk = 0.0028409 k( 122) = ( 0.1810345 0.1810345 0.0000000), wk = 0.0028409 k( 123) = ( 0.1724138 0.1724138 0.0000000), wk = 0.0028409 k( 124) = ( 0.1637931 0.1637931 -0.0000000), wk = 0.0028409 k( 125) = ( 0.1551724 0.1551724 0.0000000), wk = 0.0028409 k( 126) = ( 0.1465517 0.1465517 0.0000000), wk = 0.0028409 k( 127) = ( 0.1379310 0.1379310 0.0000000), wk = 0.0028409 k( 128) = ( 0.1293103 0.1293103 0.0000000), wk = 0.0028409 k( 129) = ( 0.1206897 0.1206897 -0.0000000), wk = 0.0028409 k( 130) = ( 0.1120690 0.1120690 -0.0000000), wk = 0.0028409 k( 131) = ( 0.1034483 0.1034483 -0.0000000), wk = 0.0028409 k( 132) = ( 0.0948276 0.0948276 -0.0000000), wk = 0.0028409 k( 133) = ( 0.0862069 0.0862069 -0.0000000), wk = 0.0028409 k( 134) = ( 0.0775862 0.0775862 -0.0000000), wk = 0.0028409 k( 135) = ( 0.0689655 0.0689655 0.0000000), wk = 0.0028409 k( 136) = ( 0.0603448 0.0603448 -0.0000000), wk = 0.0028409 k( 137) = ( 0.0517241 0.0517241 -0.0000000), wk = 0.0028409 k( 138) = ( 0.0431035 0.0431035 -0.0000000), wk = 0.0028409 k( 139) = ( 0.0344828 0.0344828 0.0000000), wk = 0.0028409 k( 140) = ( 0.0258621 0.0258621 -0.0000000), wk = 0.0028409 k( 141) = ( 0.0172414 0.0172414 0.0000000), wk = 0.0028409 k( 142) = ( 0.0086207 0.0086207 0.0000000), wk = 0.0028409 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 145) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0028409 k( 146) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0028409 k( 147) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0028409 k( 148) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0028409 k( 149) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0028409 k( 150) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0028409 k( 151) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0028409 k( 152) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0028409 k( 153) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0028409 k( 154) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0028409 k( 155) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0028409 k( 156) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0028409 k( 157) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0028409 k( 158) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0028409 k( 159) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0028409 k( 160) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0028409 k( 161) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0028409 k( 162) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0028409 k( 163) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0028409 k( 164) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0028409 k( 165) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 166) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 167) = ( 0.0000000 0.0121951 0.5000000), wk = 0.0028409 k( 168) = ( 0.0000000 0.0243902 0.5000000), wk = 0.0028409 k( 169) = ( 0.0000000 0.0365854 0.5000000), wk = 0.0028409 k( 170) = ( 0.0000000 0.0487805 0.5000000), wk = 0.0028409 k( 171) = ( 0.0000000 0.0609756 0.5000000), wk = 0.0028409 k( 172) = ( 0.0000000 0.0731707 0.5000000), wk = 0.0028409 k( 173) = ( 0.0000000 0.0853658 0.5000000), wk = 0.0028409 k( 174) = ( 0.0000000 0.0975610 0.5000000), wk = 0.0028409 k( 175) = ( 0.0000000 0.1097561 0.5000000), wk = 0.0028409 k( 176) = ( 0.0000000 0.1219512 0.5000000), wk = 0.0028409 k( 177) = ( 0.0000000 0.1341463 0.5000000), wk = 0.0028409 k( 178) = ( 0.0000000 0.1463415 0.5000000), wk = 0.0028409 k( 179) = ( 0.0000000 0.1585366 0.5000000), wk = 0.0028409 k( 180) = ( 0.0000000 0.1707317 0.5000000), wk = 0.0028409 k( 181) = ( 0.0000000 0.1829268 0.5000000), wk = 0.0028409 k( 182) = ( 0.0000000 0.1951219 0.5000000), wk = 0.0028409 k( 183) = ( 0.0000000 0.2073171 0.5000000), wk = 0.0028409 k( 184) = ( 0.0000000 0.2195122 0.5000000), wk = 0.0028409 k( 185) = ( 0.0000000 0.2317073 0.5000000), wk = 0.0028409 k( 186) = ( 0.0000000 0.2439024 0.5000000), wk = 0.0028409 k( 187) = ( 0.0000000 0.2560976 0.5000000), wk = 0.0028409 k( 188) = ( 0.0000000 0.2682927 0.5000000), wk = 0.0028409 k( 189) = ( 0.0000000 0.2804878 0.5000000), wk = 0.0028409 k( 190) = ( 0.0000000 0.2926829 0.5000000), wk = 0.0028409 k( 191) = ( 0.0000000 0.3048781 0.5000000), wk = 0.0028409 k( 192) = ( 0.0000000 0.3170732 0.5000000), wk = 0.0028409 k( 193) = ( 0.0000000 0.3292683 0.5000000), wk = 0.0028409 k( 194) = ( 0.0000000 0.3414634 0.5000000), wk = 0.0028409 k( 195) = ( 0.0000000 0.3536585 0.5000000), wk = 0.0028409 k( 196) = ( 0.0000000 0.3658537 0.5000000), wk = 0.0028409 k( 197) = ( 0.0000000 0.3780488 0.5000000), wk = 0.0028409 k( 198) = ( 0.0000000 0.3902439 0.5000000), wk = 0.0028409 k( 199) = ( 0.0000000 0.4024390 0.5000000), wk = 0.0028409 k( 200) = ( 0.0000000 0.4146341 0.5000000), wk = 0.0028409 k( 201) = ( 0.0000000 0.4268293 0.5000000), wk = 0.0028409 k( 202) = ( 0.0000000 0.4390244 0.5000000), wk = 0.0028409 k( 203) = ( 0.0000000 0.4512195 0.5000000), wk = 0.0028409 k( 204) = ( 0.0000000 0.4634146 0.5000000), wk = 0.0028409 k( 205) = ( 0.0000000 0.4756098 0.5000000), wk = 0.0028409 k( 206) = ( 0.0000000 0.4878049 0.5000000), wk = 0.0028409 k( 207) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028409 k( 208) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028409 k( 209) = ( 0.0121951 0.5000000 0.5000000), wk = 0.0028409 k( 210) = ( 0.0243902 0.5000000 0.5000000), wk = 0.0028409 k( 211) = ( 0.0365854 0.5000000 0.5000000), wk = 0.0028409 k( 212) = ( 0.0487805 0.5000000 0.5000000), wk = 0.0028409 k( 213) = ( 0.0609756 0.5000000 0.5000000), wk = 0.0028409 k( 214) = ( 0.0731707 0.5000000 0.5000000), wk = 0.0028409 k( 215) = ( 0.0853658 0.5000000 0.5000000), wk = 0.0028409 k( 216) = ( 0.0975610 0.5000000 0.5000000), wk = 0.0028409 k( 217) = ( 0.1097561 0.5000000 0.5000000), wk = 0.0028409 k( 218) = ( 0.1219512 0.5000000 0.5000000), wk = 0.0028409 k( 219) = ( 0.1341463 0.5000000 0.5000000), wk = 0.0028409 k( 220) = ( 0.1463415 0.5000000 0.5000000), wk = 0.0028409 k( 221) = ( 0.1585366 0.5000000 0.5000000), wk = 0.0028409 k( 222) = ( 0.1707317 0.5000000 0.5000000), wk = 0.0028409 k( 223) = ( 0.1829268 0.5000000 0.5000000), wk = 0.0028409 k( 224) = ( 0.1951219 0.5000000 0.5000000), wk = 0.0028409 k( 225) = ( 0.2073171 0.5000000 0.5000000), wk = 0.0028409 k( 226) = ( 0.2195122 0.5000000 0.5000000), wk = 0.0028409 k( 227) = ( 0.2317073 0.5000000 0.5000000), wk = 0.0028409 k( 228) = ( 0.2439024 0.5000000 0.5000000), wk = 0.0028409 k( 229) = ( 0.2560976 0.5000000 0.5000000), wk = 0.0028409 k( 230) = ( 0.2682927 0.5000000 0.5000000), wk = 0.0028409 k( 231) = ( 0.2804878 0.5000000 0.5000000), wk = 0.0028409 k( 232) = ( 0.2926829 0.5000000 0.5000000), wk = 0.0028409 k( 233) = ( 0.3048781 0.5000000 0.5000000), wk = 0.0028409 k( 234) = ( 0.3170732 0.5000000 0.5000000), wk = 0.0028409 k( 235) = ( 0.3292683 0.5000000 0.5000000), wk = 0.0028409 k( 236) = ( 0.3414634 0.5000000 0.5000000), wk = 0.0028409 k( 237) = ( 0.3536585 0.5000000 0.5000000), wk = 0.0028409 k( 238) = ( 0.3658537 0.5000000 0.5000000), wk = 0.0028409 k( 239) = ( 0.3780488 0.5000000 0.5000000), wk = 0.0028409 k( 240) = ( 0.3902439 0.5000000 0.5000000), wk = 0.0028409 k( 241) = ( 0.4024390 0.5000000 0.5000000), wk = 0.0028409 k( 242) = ( 0.4146341 0.5000000 0.5000000), wk = 0.0028409 k( 243) = ( 0.4268293 0.5000000 0.5000000), wk = 0.0028409 k( 244) = ( 0.4390244 0.5000000 0.5000000), wk = 0.0028409 k( 245) = ( 0.4512195 0.5000000 0.5000000), wk = 0.0028409 k( 246) = ( 0.4634146 0.5000000 0.5000000), wk = 0.0028409 k( 247) = ( 0.4756098 0.5000000 0.5000000), wk = 0.0028409 k( 248) = ( 0.4878049 0.5000000 0.5000000), wk = 0.0028409 k( 249) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 k( 250) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 k( 251) = ( 0.4913793 0.4913793 0.5000000), wk = 0.0028409 k( 252) = ( 0.4827586 0.4827586 0.5000000), wk = 0.0028409 k( 253) = ( 0.4741379 0.4741379 0.5000000), wk = 0.0028409 k( 254) = ( 0.4655172 0.4655172 0.5000000), wk = 0.0028409 k( 255) = ( 0.4568966 0.4568966 0.5000000), wk = 0.0028409 k( 256) = ( 0.4482759 0.4482759 0.5000000), wk = 0.0028409 k( 257) = ( 0.4396552 0.4396552 0.5000000), wk = 0.0028409 k( 258) = ( 0.4310345 0.4310345 0.5000000), wk = 0.0028409 k( 259) = ( 0.4224138 0.4224138 0.5000000), wk = 0.0028409 k( 260) = ( 0.4137931 0.4137931 0.5000000), wk = 0.0028409 k( 261) = ( 0.4051724 0.4051724 0.5000000), wk = 0.0028409 k( 262) = ( 0.3965517 0.3965517 0.5000000), wk = 0.0028409 k( 263) = ( 0.3879310 0.3879310 0.5000000), wk = 0.0028409 k( 264) = ( 0.3793103 0.3793103 0.5000000), wk = 0.0028409 k( 265) = ( 0.3706897 0.3706897 0.5000000), wk = 0.0028409 k( 266) = ( 0.3620690 0.3620690 0.5000000), wk = 0.0028409 k( 267) = ( 0.3534483 0.3534483 0.5000000), wk = 0.0028409 k( 268) = ( 0.3448276 0.3448276 0.5000000), wk = 0.0028409 k( 269) = ( 0.3362069 0.3362069 0.5000000), wk = 0.0028409 k( 270) = ( 0.3275862 0.3275862 0.5000000), wk = 0.0028409 k( 271) = ( 0.3189655 0.3189655 0.5000000), wk = 0.0028409 k( 272) = ( 0.3103448 0.3103448 0.5000000), wk = 0.0028409 k( 273) = ( 0.3017241 0.3017241 0.5000000), wk = 0.0028409 k( 274) = ( 0.2931034 0.2931034 0.5000000), wk = 0.0028409 k( 275) = ( 0.2844828 0.2844828 0.5000000), wk = 0.0028409 k( 276) = ( 0.2758621 0.2758621 0.5000000), wk = 0.0028409 k( 277) = ( 0.2672414 0.2672414 0.5000000), wk = 0.0028409 k( 278) = ( 0.2586207 0.2586207 0.5000000), wk = 0.0028409 k( 279) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0028409 k( 280) = ( 0.2413793 0.2413793 0.5000000), wk = 0.0028409 k( 281) = ( 0.2327586 0.2327586 0.5000000), wk = 0.0028409 k( 282) = ( 0.2241379 0.2241379 0.5000000), wk = 0.0028409 k( 283) = ( 0.2155172 0.2155172 0.5000000), wk = 0.0028409 k( 284) = ( 0.2068966 0.2068966 0.5000000), wk = 0.0028409 k( 285) = ( 0.1982759 0.1982759 0.5000000), wk = 0.0028409 k( 286) = ( 0.1896552 0.1896552 0.5000000), wk = 0.0028409 k( 287) = ( 0.1810345 0.1810345 0.5000000), wk = 0.0028409 k( 288) = ( 0.1724138 0.1724138 0.5000000), wk = 0.0028409 k( 289) = ( 0.1637931 0.1637931 0.5000000), wk = 0.0028409 k( 290) = ( 0.1551724 0.1551724 0.5000000), wk = 0.0028409 k( 291) = ( 0.1465517 0.1465517 0.5000000), wk = 0.0028409 k( 292) = ( 0.1379310 0.1379310 0.5000000), wk = 0.0028409 k( 293) = ( 0.1293103 0.1293103 0.5000000), wk = 0.0028409 k( 294) = ( 0.1206897 0.1206897 0.5000000), wk = 0.0028409 k( 295) = ( 0.1120690 0.1120690 0.5000000), wk = 0.0028409 k( 296) = ( 0.1034483 0.1034483 0.5000000), wk = 0.0028409 k( 297) = ( 0.0948276 0.0948276 0.5000000), wk = 0.0028409 k( 298) = ( 0.0862069 0.0862069 0.5000000), wk = 0.0028409 k( 299) = ( 0.0775862 0.0775862 0.5000000), wk = 0.0028409 k( 300) = ( 0.0689655 0.0689655 0.5000000), wk = 0.0028409 k( 301) = ( 0.0603448 0.0603448 0.5000000), wk = 0.0028409 k( 302) = ( 0.0517241 0.0517241 0.5000000), wk = 0.0028409 k( 303) = ( 0.0431035 0.0431035 0.5000000), wk = 0.0028409 k( 304) = ( 0.0344828 0.0344828 0.5000000), wk = 0.0028409 k( 305) = ( 0.0258621 0.0258621 0.5000000), wk = 0.0028409 k( 306) = ( 0.0172414 0.0172414 0.5000000), wk = 0.0028409 k( 307) = ( 0.0086207 0.0086207 0.5000000), wk = 0.0028409 k( 308) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 309) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0028409 k( 310) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0028409 k( 311) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0028409 k( 312) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0028409 k( 313) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0028409 k( 314) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0028409 k( 315) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0028409 k( 316) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0028409 k( 317) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0028409 k( 318) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0028409 k( 319) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0028409 k( 320) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0028409 k( 321) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0028409 k( 322) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0028409 k( 323) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0028409 k( 324) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0028409 k( 325) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0028409 k( 326) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0028409 k( 327) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0028409 k( 328) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0028409 k( 329) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0028409 k( 330) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028409 k( 331) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0028409 k( 332) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0028409 k( 333) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0028409 k( 334) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0028409 k( 335) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0028409 k( 336) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0028409 k( 337) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0028409 k( 338) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0028409 k( 339) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0028409 k( 340) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0028409 k( 341) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0028409 k( 342) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0028409 k( 343) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0028409 k( 344) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0028409 k( 345) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0028409 k( 346) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0028409 k( 347) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0028409 k( 348) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0028409 k( 349) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0028409 k( 350) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0028409 k( 351) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0028409 k( 352) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 Dense grid: 55199 G-vectors FFT dimensions: ( 40, 40, 75) Smooth grid: 26979 G-vectors FFT dimensions: ( 30, 30, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.17 Mb ( 194, 56) NL pseudopotentials 0.30 Mb ( 97, 204) Each V/rho on FFT grid 0.07 Mb ( 4800) Each G-vector array 0.01 Mb ( 1532) G-vector shells 0.01 Mb ( 781) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.66 Mb ( 194, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.35 Mb ( 204, 2, 56) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./YS2.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.5 secs Computing kpt #: 2 total cpu time spent up to now is 3.3 secs Computing kpt #: 3 total cpu time spent up to now is 3.9 secs Computing kpt #: 4 total cpu time spent up to now is 4.5 secs Computing kpt #: 5 total cpu time spent up to now is 5.1 secs Computing kpt #: 6 total cpu time spent up to now is 5.7 secs Computing kpt #: 7 total cpu time spent up to now is 6.2 secs Computing kpt #: 8 total cpu time spent up to now is 6.8 secs Computing kpt #: 9 total cpu time spent up to now is 7.3 secs Computing kpt #: 10 total cpu time spent up to now is 7.7 secs Computing kpt #: 11 total cpu time spent up to now is 8.1 secs Computing kpt #: 12 total cpu time spent up to now is 8.5 secs Computing kpt #: 13 total cpu time spent up to now is 8.9 secs Computing kpt #: 14 total cpu time spent up to now is 9.3 secs Computing kpt #: 15 total cpu time spent up to now is 9.7 secs Computing kpt #: 16 total cpu time spent up to now is 10.1 secs Computing kpt #: 17 total cpu time spent up to now is 10.5 secs Computing kpt #: 18 total cpu time spent up to now is 10.9 secs Computing kpt #: 19 total cpu time spent up to now is 11.3 secs Computing kpt #: 20 total cpu time spent up to now is 11.7 secs Computing kpt #: 21 total cpu time spent up to now is 12.0 secs Computing kpt #: 22 total cpu time spent up to now is 12.4 secs Computing kpt #: 23 total cpu time spent up to now is 12.8 secs Computing kpt #: 24 total cpu time spent up to now is 13.2 secs Computing kpt #: 25 total cpu time spent up to now is 13.6 secs Computing kpt #: 26 total cpu time spent up to now is 13.9 secs Computing kpt #: 27 total cpu time spent up to now is 14.3 secs Computing kpt #: 28 total cpu time spent up to now is 14.7 secs Computing kpt #: 29 total cpu time spent up to now is 15.1 secs Computing kpt #: 30 total cpu time spent up to now is 15.5 secs Computing kpt #: 31 total cpu time spent up to now is 15.9 secs Computing kpt #: 32 total cpu time spent up to now is 16.4 secs Computing kpt #: 33 total cpu time spent up to now is 16.8 secs Computing kpt #: 34 total cpu time spent up to now is 17.3 secs Computing kpt #: 35 total cpu time spent up to now is 17.7 secs Computing kpt #: 36 total cpu time spent up to now is 18.2 secs Computing kpt #: 37 total cpu time spent up to now is 18.7 secs Computing kpt #: 38 total cpu time spent up to now is 19.3 secs Computing kpt #: 39 total cpu time spent up to now is 19.8 secs Computing kpt #: 40 total cpu time spent up to now is 20.3 secs Computing kpt #: 41 total cpu time spent up to now is 20.8 secs Computing kpt #: 42 total cpu time spent up to now is 21.4 secs Computing kpt #: 43 total cpu time spent up to now is 21.9 secs Computing kpt #: 44 total cpu time spent up to now is 22.4 secs Computing kpt #: 45 total cpu time spent up to now is 22.9 secs Computing kpt #: 46 total cpu time spent up to now is 23.5 secs Computing kpt #: 47 total cpu time spent up to now is 24.0 secs Computing kpt #: 48 total cpu time spent up to now is 24.6 secs Computing kpt #: 49 total cpu time spent up to now is 25.1 secs Computing kpt #: 50 total cpu time spent up to now is 25.6 secs Computing kpt #: 51 total cpu time spent up to now is 26.2 secs Computing kpt #: 52 total cpu time spent up to now is 26.7 secs Computing kpt #: 53 total cpu time spent up to now is 27.2 secs Computing kpt #: 54 total cpu time spent up to now is 27.8 secs Computing kpt #: 55 total cpu time spent up to now is 28.3 secs Computing kpt #: 56 total cpu time spent up to now is 28.9 secs Computing kpt #: 57 total cpu time spent up to now is 29.4 secs Computing kpt #: 58 total cpu time spent up to now is 30.0 secs Computing kpt #: 59 total cpu time spent up to now is 30.5 secs Computing kpt #: 60 total cpu time spent up to now is 31.1 secs Computing kpt #: 61 total cpu time spent up to now is 31.6 secs Computing kpt #: 62 total cpu time spent up to now is 32.2 secs Computing kpt #: 63 total cpu time spent up to now is 32.7 secs Computing kpt #: 64 total cpu time spent up to now is 33.3 secs Computing kpt #: 65 total cpu time spent up to now is 33.8 secs Computing kpt #: 66 total cpu time spent up to now is 34.4 secs Computing kpt #: 67 total cpu time spent up to now is 34.9 secs Computing kpt #: 68 total cpu time spent up to now is 35.5 secs Computing kpt #: 69 total cpu time spent up to now is 36.0 secs Computing kpt #: 70 total cpu time spent up to now is 36.6 secs Computing kpt #: 71 total cpu time spent up to now is 37.1 secs Computing kpt #: 72 total cpu time spent up to now is 37.7 secs Computing kpt #: 73 total cpu time spent up to now is 38.3 secs Computing kpt #: 74 total cpu time spent up to now is 38.8 secs Computing kpt #: 75 total cpu time spent up to now is 39.3 secs Computing kpt #: 76 total cpu time spent up to now is 39.9 secs Computing kpt #: 77 total cpu time spent up to now is 40.4 secs Computing kpt #: 78 total cpu time spent up to now is 41.0 secs Computing kpt #: 79 total cpu time spent up to now is 41.5 secs Computing kpt #: 80 total cpu time spent up to now is 42.1 secs Computing kpt #: 81 total cpu time spent up to now is 42.6 secs Computing kpt #: 82 total cpu time spent up to now is 43.2 secs Computing kpt #: 83 total cpu time spent up to now is 43.7 secs Computing kpt #: 84 total cpu time spent up to now is 44.3 secs Computing kpt #: 85 total cpu time spent up to now is 44.8 secs Computing kpt #: 86 total cpu time spent up to now is 45.4 secs Computing kpt #: 87 total cpu time spent up to now is 45.9 secs Computing kpt #: 88 total cpu time spent up to now is 46.5 secs Computing kpt #: 89 total cpu time spent up to now is 47.0 secs Computing kpt #: 90 total cpu time spent up to now is 47.6 secs Computing kpt #: 91 total cpu time spent up to now is 48.2 secs Computing kpt #: 92 total cpu time spent up to now is 48.7 secs Computing kpt #: 93 total cpu time spent up to now is 49.3 secs Computing kpt #: 94 total cpu time spent up to now is 49.8 secs Computing kpt #: 95 total cpu time spent up to now is 50.4 secs Computing kpt #: 96 total cpu time spent up to now is 51.0 secs Computing kpt #: 97 total cpu time spent up to now is 51.6 secs Computing kpt #: 98 total cpu time spent up to now is 52.2 secs Computing kpt #: 99 total cpu time spent up to now is 52.8 secs Computing kpt #: 100 total cpu time spent up to now is 53.4 secs Computing kpt #: 101 total cpu time spent up to now is 54.0 secs Computing kpt #: 102 total cpu time spent up to now is 54.6 secs Computing kpt #: 103 total cpu time spent up to now is 55.1 secs Computing kpt #: 104 total cpu time spent up to now is 55.7 secs Computing kpt #: 105 total cpu time spent up to now is 56.3 secs Computing kpt #: 106 total cpu time spent up to now is 56.8 secs Computing kpt #: 107 total cpu time spent up to now is 57.4 secs Computing kpt #: 108 total cpu time spent up to now is 58.0 secs Computing kpt #: 109 total cpu time spent up to now is 58.6 secs Computing kpt #: 110 total cpu time spent up to now is 59.1 secs Computing kpt #: 111 total cpu time spent up to now is 59.7 secs Computing kpt #: 112 total cpu time spent up to now is 60.4 secs Computing kpt #: 113 total cpu time spent up to now is 61.1 secs Computing kpt #: 114 total cpu time spent up to now is 61.6 secs Computing kpt #: 115 total cpu time spent up to now is 62.2 secs Computing kpt #: 116 total cpu time spent up to now is 62.7 secs Computing kpt #: 117 total cpu time spent up to now is 63.2 secs Computing kpt #: 118 total cpu time spent up to now is 63.7 secs Computing kpt #: 119 total cpu time spent up to now is 64.2 secs Computing kpt #: 120 total cpu time spent up to now is 64.7 secs Computing kpt #: 121 total cpu time spent up to now is 65.1 secs Computing kpt #: 122 total cpu time spent up to now is 65.6 secs Computing kpt #: 123 total cpu time spent up to now is 66.1 secs Computing kpt #: 124 total cpu time spent up to now is 66.5 secs Computing kpt #: 125 total cpu time spent up to now is 67.0 secs Computing kpt #: 126 total cpu time spent up to now is 67.5 secs Computing kpt #: 127 total cpu time spent up to now is 67.9 secs Computing kpt #: 128 total cpu time spent up to now is 68.4 secs Computing kpt #: 129 total cpu time spent up to now is 68.8 secs Computing kpt #: 130 total cpu time spent up to now is 69.3 secs Computing kpt #: 131 total cpu time spent up to now is 69.8 secs Computing kpt #: 132 total cpu time spent up to now is 70.3 secs Computing kpt #: 133 total cpu time spent up to now is 70.9 secs Computing kpt #: 134 total cpu time spent up to now is 71.4 secs Computing kpt #: 135 total cpu time spent up to now is 72.0 secs Computing kpt #: 136 total cpu time spent up to now is 72.6 secs Computing kpt #: 137 total cpu time spent up to now is 73.2 secs Computing kpt #: 138 total cpu time spent up to now is 73.8 secs Computing kpt #: 139 total cpu time spent up to now is 74.5 secs Computing kpt #: 140 total cpu time spent up to now is 75.2 secs Computing kpt #: 141 total cpu time spent up to now is 75.9 secs Computing kpt #: 142 total cpu time spent up to now is 76.6 secs Computing kpt #: 143 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 78.1 secs Computing kpt #: 144 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 79.4 secs Computing kpt #: 145 total cpu time spent up to now is 80.4 secs Computing kpt #: 146 total cpu time spent up to now is 81.0 secs Computing kpt #: 147 total cpu time spent up to now is 81.5 secs Computing kpt #: 148 total cpu time spent up to now is 82.0 secs Computing kpt #: 149 total cpu time spent up to now is 82.6 secs Computing kpt #: 150 total cpu time spent up to now is 83.1 secs Computing kpt #: 151 total cpu time spent up to now is 83.6 secs Computing kpt #: 152 total cpu time spent up to now is 84.2 secs Computing kpt #: 153 total cpu time spent up to now is 84.7 secs Computing kpt #: 154 total cpu time spent up to now is 85.3 secs Computing kpt #: 155 total cpu time spent up to now is 85.8 secs Computing kpt #: 156 total cpu time spent up to now is 86.4 secs Computing kpt #: 157 total cpu time spent up to now is 87.1 secs Computing kpt #: 158 total cpu time spent up to now is 87.7 secs Computing kpt #: 159 total cpu time spent up to now is 88.3 secs Computing kpt #: 160 total cpu time spent up to now is 88.9 secs Computing kpt #: 161 total cpu time spent up to now is 89.5 secs Computing kpt #: 162 total cpu time spent up to now is 90.1 secs Computing kpt #: 163 total cpu time spent up to now is 90.6 secs Computing kpt #: 164 total cpu time spent up to now is 91.2 secs Computing kpt #: 165 total cpu time spent up to now is 91.7 secs Computing kpt #: 166 total cpu time spent up to now is 92.3 secs Computing kpt #: 167 total cpu time spent up to now is 92.9 secs Computing kpt #: 168 total cpu time spent up to now is 93.4 secs Computing kpt #: 169 total cpu time spent up to now is 94.0 secs Computing kpt #: 170 total cpu time spent up to now is 94.5 secs Computing kpt #: 171 total cpu time spent up to now is 95.1 secs Computing kpt #: 172 total cpu time spent up to now is 95.6 secs Computing kpt #: 173 total cpu time spent up to now is 96.2 secs Computing kpt #: 174 total cpu time spent up to now is 96.8 secs Computing kpt #: 175 total cpu time spent up to now is 97.3 secs Computing kpt #: 176 total cpu time spent up to now is 97.9 secs Computing kpt #: 177 total cpu time spent up to now is 98.4 secs Computing kpt #: 178 total cpu time spent up to now is 98.9 secs Computing kpt #: 179 total cpu time spent up to now is 99.5 secs Computing kpt #: 180 total cpu time spent up to now is 100.1 secs Computing kpt #: 181 total cpu time spent up to now is 100.6 secs Computing kpt #: 182 total cpu time spent up to now is 101.2 secs Computing kpt #: 183 total cpu time spent up to now is 101.8 secs Computing kpt #: 184 total cpu time spent up to now is 102.3 secs Computing kpt #: 185 total cpu time spent up to now is 102.9 secs Computing kpt #: 186 total cpu time spent up to now is 103.5 secs Computing kpt #: 187 total cpu time spent up to now is 104.0 secs Computing kpt #: 188 total cpu time spent up to now is 104.6 secs Computing kpt #: 189 total cpu time spent up to now is 105.1 secs Computing kpt #: 190 total cpu time spent up to now is 105.7 secs Computing kpt #: 191 total cpu time spent up to now is 106.2 secs Computing kpt #: 192 total cpu time spent up to now is 106.8 secs Computing kpt #: 193 total cpu time spent up to now is 107.3 secs Computing kpt #: 194 total cpu time spent up to now is 107.9 secs Computing kpt #: 195 total cpu time spent up to now is 108.4 secs Computing kpt #: 196 total cpu time spent up to now is 108.9 secs Computing kpt #: 197 total cpu time spent up to now is 109.4 secs Computing kpt #: 198 total cpu time spent up to now is 109.9 secs Computing kpt #: 199 total cpu time spent up to now is 110.3 secs Computing kpt #: 200 total cpu time spent up to now is 110.8 secs Computing kpt #: 201 total cpu time spent up to now is 111.2 secs Computing kpt #: 202 total cpu time spent up to now is 111.7 secs Computing kpt #: 203 total cpu time spent up to now is 112.2 secs Computing kpt #: 204 total cpu time spent up to now is 112.7 secs Computing kpt #: 205 total cpu time spent up to now is 113.2 secs Computing kpt #: 206 total cpu time spent up to now is 113.6 secs Computing kpt #: 207 total cpu time spent up to now is 114.1 secs Computing kpt #: 208 total cpu time spent up to now is 114.5 secs Computing kpt #: 209 total cpu time spent up to now is 115.0 secs Computing kpt #: 210 total cpu time spent up to now is 115.4 secs Computing kpt #: 211 total cpu time spent up to now is 115.9 secs Computing kpt #: 212 total cpu time spent up to now is 116.3 secs Computing kpt #: 213 total cpu time spent up to now is 116.8 secs Computing kpt #: 214 total cpu time spent up to now is 117.3 secs Computing kpt #: 215 total cpu time spent up to now is 117.7 secs Computing kpt #: 216 total cpu time spent up to now is 118.2 secs Computing kpt #: 217 total cpu time spent up to now is 118.6 secs Computing kpt #: 218 total cpu time spent up to now is 119.1 secs Computing kpt #: 219 total cpu time spent up to now is 119.5 secs Computing kpt #: 220 total cpu time spent up to now is 120.0 secs Computing kpt #: 221 total cpu time spent up to now is 120.5 secs Computing kpt #: 222 total cpu time spent up to now is 120.9 secs Computing kpt #: 223 total cpu time spent up to now is 121.4 secs Computing kpt #: 224 total cpu time spent up to now is 121.8 secs Computing kpt #: 225 total cpu time spent up to now is 122.3 secs Computing kpt #: 226 total cpu time spent up to now is 122.8 secs Computing kpt #: 227 total cpu time spent up to now is 123.2 secs Computing kpt #: 228 total cpu time spent up to now is 123.7 secs Computing kpt #: 229 total cpu time spent up to now is 124.1 secs Computing kpt #: 230 total cpu time spent up to now is 124.6 secs Computing kpt #: 231 total cpu time spent up to now is 125.1 secs Computing kpt #: 232 total cpu time spent up to now is 125.5 secs Computing kpt #: 233 total cpu time spent up to now is 126.0 secs Computing kpt #: 234 total cpu time spent up to now is 126.5 secs Computing kpt #: 235 total cpu time spent up to now is 127.1 secs Computing kpt #: 236 total cpu time spent up to now is 127.6 secs Computing kpt #: 237 total cpu time spent up to now is 128.1 secs Computing kpt #: 238 total cpu time spent up to now is 128.7 secs Computing kpt #: 239 total cpu time spent up to now is 129.2 secs Computing kpt #: 240 total cpu time spent up to now is 129.7 secs Computing kpt #: 241 total cpu time spent up to now is 130.3 secs Computing kpt #: 242 total cpu time spent up to now is 130.8 secs Computing kpt #: 243 total cpu time spent up to now is 131.4 secs Computing kpt #: 244 total cpu time spent up to now is 131.9 secs Computing kpt #: 245 total cpu time spent up to now is 132.5 secs Computing kpt #: 246 total cpu time spent up to now is 133.0 secs Computing kpt #: 247 total cpu time spent up to now is 133.6 secs Computing kpt #: 248 total cpu time spent up to now is 134.2 secs Computing kpt #: 249 total cpu time spent up to now is 134.8 secs Computing kpt #: 250 total cpu time spent up to now is 135.4 secs Computing kpt #: 251 total cpu time spent up to now is 136.0 secs Computing kpt #: 252 total cpu time spent up to now is 136.6 secs Computing kpt #: 253 total cpu time spent up to now is 137.1 secs Computing kpt #: 254 total cpu time spent up to now is 137.7 secs Computing kpt #: 255 total cpu time spent up to now is 138.3 secs Computing kpt #: 256 total cpu time spent up to now is 138.9 secs Computing kpt #: 257 total cpu time spent up to now is 139.5 secs Computing kpt #: 258 total cpu time spent up to now is 140.2 secs Computing kpt #: 259 total cpu time spent up to now is 140.7 secs Computing kpt #: 260 total cpu time spent up to now is 141.3 secs Computing kpt #: 261 total cpu time spent up to now is 141.8 secs Computing kpt #: 262 total cpu time spent up to now is 142.4 secs Computing kpt #: 263 total cpu time spent up to now is 142.9 secs Computing kpt #: 264 total cpu time spent up to now is 143.4 secs Computing kpt #: 265 total cpu time spent up to now is 143.9 secs Computing kpt #: 266 total cpu time spent up to now is 144.5 secs Computing kpt #: 267 total cpu time spent up to now is 145.0 secs Computing kpt #: 268 total cpu time spent up to now is 145.5 secs Computing kpt #: 269 total cpu time spent up to now is 146.1 secs Computing kpt #: 270 total cpu time spent up to now is 146.6 secs Computing kpt #: 271 total cpu time spent up to now is 147.1 secs Computing kpt #: 272 total cpu time spent up to now is 147.7 secs Computing kpt #: 273 total cpu time spent up to now is 148.2 secs Computing kpt #: 274 total cpu time spent up to now is 148.8 secs Computing kpt #: 275 total cpu time spent up to now is 149.3 secs Computing kpt #: 276 total cpu time spent up to now is 149.9 secs Computing kpt #: 277 total cpu time spent up to now is 150.4 secs Computing kpt #: 278 total cpu time spent up to now is 150.9 secs Computing kpt #: 279 total cpu time spent up to now is 151.4 secs Computing kpt #: 280 total cpu time spent up to now is 152.0 secs Computing kpt #: 281 total cpu time spent up to now is 152.5 secs Computing kpt #: 282 total cpu time spent up to now is 153.0 secs Computing kpt #: 283 total cpu time spent up to now is 153.6 secs Computing kpt #: 284 total cpu time spent up to now is 154.1 secs Computing kpt #: 285 total cpu time spent up to now is 154.6 secs Computing kpt #: 286 total cpu time spent up to now is 155.2 secs Computing kpt #: 287 total cpu time spent up to now is 155.7 secs Computing kpt #: 288 total cpu time spent up to now is 156.2 secs Computing kpt #: 289 total cpu time spent up to now is 156.6 secs Computing kpt #: 290 total cpu time spent up to now is 157.2 secs Computing kpt #: 291 total cpu time spent up to now is 157.7 secs Computing kpt #: 292 total cpu time spent up to now is 158.2 secs Computing kpt #: 293 total cpu time spent up to now is 158.8 secs Computing kpt #: 294 total cpu time spent up to now is 159.3 secs Computing kpt #: 295 total cpu time spent up to now is 159.8 secs Computing kpt #: 296 total cpu time spent up to now is 160.4 secs Computing kpt #: 297 total cpu time spent up to now is 160.9 secs Computing kpt #: 298 total cpu time spent up to now is 161.5 secs Computing kpt #: 299 total cpu time spent up to now is 162.0 secs Computing kpt #: 300 total cpu time spent up to now is 162.6 secs Computing kpt #: 301 total cpu time spent up to now is 163.1 secs Computing kpt #: 302 total cpu time spent up to now is 163.7 secs Computing kpt #: 303 total cpu time spent up to now is 164.2 secs Computing kpt #: 304 total cpu time spent up to now is 164.8 secs Computing kpt #: 305 total cpu time spent up to now is 165.4 secs Computing kpt #: 306 total cpu time spent up to now is 165.9 secs Computing kpt #: 307 total cpu time spent up to now is 166.5 secs Computing kpt #: 308 total cpu time spent up to now is 167.0 secs Computing kpt #: 309 total cpu time spent up to now is 167.6 secs Computing kpt #: 310 total cpu time spent up to now is 168.1 secs Computing kpt #: 311 total cpu time spent up to now is 168.6 secs Computing kpt #: 312 total cpu time spent up to now is 169.1 secs Computing kpt #: 313 total cpu time spent up to now is 169.7 secs Computing kpt #: 314 total cpu time spent up to now is 170.2 secs Computing kpt #: 315 total cpu time spent up to now is 170.7 secs Computing kpt #: 316 total cpu time spent up to now is 171.2 secs Computing kpt #: 317 total cpu time spent up to now is 171.8 secs Computing kpt #: 318 total cpu time spent up to now is 172.3 secs Computing kpt #: 319 total cpu time spent up to now is 172.8 secs Computing kpt #: 320 total cpu time spent up to now is 173.3 secs Computing kpt #: 321 total cpu time spent up to now is 173.7 secs Computing kpt #: 322 total cpu time spent up to now is 174.2 secs Computing kpt #: 323 total cpu time spent up to now is 174.6 secs Computing kpt #: 324 total cpu time spent up to now is 175.1 secs Computing kpt #: 325 total cpu time spent up to now is 175.5 secs Computing kpt #: 326 total cpu time spent up to now is 176.0 secs Computing kpt #: 327 total cpu time spent up to now is 176.4 secs Computing kpt #: 328 total cpu time spent up to now is 176.9 secs Computing kpt #: 329 total cpu time spent up to now is 177.3 secs Computing kpt #: 330 total cpu time spent up to now is 177.7 secs Computing kpt #: 331 total cpu time spent up to now is 178.3 secs Computing kpt #: 332 total cpu time spent up to now is 178.8 secs Computing kpt #: 333 total cpu time spent up to now is 179.4 secs Computing kpt #: 334 total cpu time spent up to now is 179.9 secs Computing kpt #: 335 total cpu time spent up to now is 180.5 secs Computing kpt #: 336 total cpu time spent up to now is 181.0 secs Computing kpt #: 337 total cpu time spent up to now is 181.6 secs Computing kpt #: 338 total cpu time spent up to now is 182.1 secs Computing kpt #: 339 total cpu time spent up to now is 182.6 secs Computing kpt #: 340 total cpu time spent up to now is 183.2 secs Computing kpt #: 341 total cpu time spent up to now is 183.8 secs Computing kpt #: 342 total cpu time spent up to now is 184.3 secs Computing kpt #: 343 total cpu time spent up to now is 184.9 secs Computing kpt #: 344 total cpu time spent up to now is 185.5 secs Computing kpt #: 345 total cpu time spent up to now is 186.1 secs Computing kpt #: 346 total cpu time spent up to now is 186.7 secs Computing kpt #: 347 total cpu time spent up to now is 187.3 secs Computing kpt #: 348 total cpu time spent up to now is 187.9 secs Computing kpt #: 349 total cpu time spent up to now is 188.5 secs Computing kpt #: 350 total cpu time spent up to now is 189.0 secs Computing kpt #: 351 total cpu time spent up to now is 189.6 secs Computing kpt #: 352 total cpu time spent up to now is 190.2 secs ethr = 2.17E-08, avg # of iterations = 23.9 total cpu time spent up to now is 190.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3413 PWs) bands (ev): -32.1958 -32.1958 -32.1921 -32.1921 -13.2585 -13.2585 -13.1923 -13.1923 -11.9376 -11.9376 -11.8047 -11.8047 -11.7264 -11.7264 -11.7077 -11.7077 -5.1461 -5.1461 -2.0234 -2.0234 -1.8934 -1.8934 -1.1755 -1.1755 4.5015 4.5015 4.5238 4.5238 4.9423 4.9423 6.7070 6.7070 6.7646 6.7646 8.1338 8.1338 8.2124 8.2124 8.6752 8.6752 8.7501 8.7501 9.8244 9.8244 10.3859 10.3859 10.4762 10.4762 11.0301 11.0301 11.8622 11.8622 12.7741 12.7741 13.3487 13.3487 k = 0.0000 0.0122-0.0000 ( 3401 PWs) bands (ev): -32.1957 -32.1957 -32.1921 -32.1921 -13.2585 -13.2585 -13.1924 -13.1924 -11.9376 -11.9376 -11.8048 -11.8048 -11.7266 -11.7266 -11.7079 -11.7079 -5.1449 -5.1449 -2.0229 -2.0229 -1.8927 -1.8927 -1.1779 -1.1779 4.5026 4.5026 4.5250 4.5250 4.9425 4.9425 6.7061 6.7061 6.7656 6.7656 8.1321 8.1321 8.2106 8.2106 8.6720 8.6720 8.7468 8.7468 9.8246 9.8246 10.3821 10.3821 10.4722 10.4722 11.0348 11.0348 11.8633 11.8633 12.7723 12.7723 13.3119 13.3119 k = 0.0000 0.0244-0.0000 ( 3401 PWs) bands (ev): -32.1957 -32.1957 -32.1920 -32.1920 -13.2586 -13.2586 -13.1927 -13.1927 -11.9376 -11.9376 -11.8050 -11.8050 -11.7271 -11.7271 -11.7084 -11.7084 -5.1415 -5.1415 -2.0212 -2.0212 -1.8904 -1.8904 -1.1851 -1.1851 4.5062 4.5062 4.5285 4.5285 4.9432 4.9432 6.7033 6.7033 6.7686 6.7686 8.1267 8.1267 8.2051 8.2051 8.6624 8.6624 8.7367 8.7367 9.8252 9.8252 10.3707 10.3707 10.4605 10.4605 11.0489 11.0489 11.8665 11.8665 12.7675 12.7675 13.2536 13.2536 k = 0.0000 0.0366-0.0000 ( 3397 PWs) bands (ev): -32.1956 -32.1956 -32.1920 -32.1920 -13.2588 -13.2588 -13.1931 -13.1931 -11.9376 -11.9376 -11.8053 -11.8053 -11.7280 -11.7280 -11.7094 -11.7094 -5.1359 -5.1359 -2.0185 -2.0185 -1.8867 -1.8867 -1.1970 -1.1970 4.5121 4.5121 4.5344 4.5344 4.9444 4.9444 6.6985 6.6985 6.7737 6.7737 8.1177 8.1177 8.1965 8.1965 8.6466 8.6466 8.7201 8.7201 9.8262 9.8262 10.3517 10.3517 10.4412 10.4412 11.0721 11.0721 11.8718 11.8718 12.7606 12.7606 13.1848 13.1848 k = 0.0000 0.0488-0.0000 ( 3399 PWs) bands (ev): -32.1955 -32.1955 -32.1919 -32.1919 -13.2590 -13.2590 -13.1937 -13.1937 -11.9375 -11.9375 -11.8058 -11.8058 -11.7292 -11.7292 -11.7106 -11.7106 -5.1280 -5.1280 -2.0148 -2.0148 -1.8816 -1.8816 -1.2136 -1.2136 4.5202 4.5202 4.5425 4.5425 4.9462 4.9462 6.6913 6.6913 6.7810 6.7810 8.1048 8.1048 8.1852 8.1852 8.6249 8.6249 8.6973 8.6973 9.8273 9.8273 10.3254 10.3254 10.4146 10.4146 11.1042 11.1042 11.8792 11.8792 12.7529 12.7529 13.1122 13.1122 k = 0.0000 0.0610-0.0000 ( 3395 PWs) bands (ev): -32.1953 -32.1953 -32.1917 -32.1917 -13.2593 -13.2593 -13.1944 -13.1944 -11.9375 -11.9375 -11.8064 -11.8064 -11.7307 -11.7307 -11.7122 -11.7122 -5.1179 -5.1179 -2.0099 -2.0099 -1.8750 -1.8750 -1.2348 -1.2348 4.5305 4.5305 4.5527 4.5527 4.9488 4.9488 6.6817 6.6817 6.7906 6.7906 8.0880 8.0880 8.1719 8.1719 8.5976 8.5976 8.6688 8.6688 9.8284 9.8284 10.2918 10.2918 10.3811 10.3811 11.1447 11.1447 11.8887 11.8887 12.7456 12.7456 13.0391 13.0391 k = 0.0000 0.0732-0.0000 ( 3393 PWs) bands (ev): -32.1951 -32.1951 -32.1916 -32.1916 -13.2596 -13.2596 -13.1953 -13.1953 -11.9375 -11.9375 -11.8071 -11.8071 -11.7325 -11.7325 -11.7141 -11.7141 -5.1055 -5.1055 -2.0040 -2.0040 -1.8671 -1.8671 -1.2605 -1.2605 4.5428 4.5428 4.5649 4.5649 4.9525 4.9525 6.6695 6.6695 6.8025 6.8025 8.0674 8.0674 8.1571 8.1571 8.5653 8.5653 8.6350 8.6350 9.8292 9.8292 10.2512 10.2512 10.3412 10.3412 11.1932 11.1932 11.9000 11.9000 12.7395 12.7395 12.9676 12.9676 k = 0.0000 0.0854-0.0000 ( 3389 PWs) bands (ev): -32.1949 -32.1949 -32.1914 -32.1914 -13.2601 -13.2601 -13.1964 -13.1964 -11.9374 -11.9374 -11.8081 -11.8081 -11.7346 -11.7346 -11.7162 -11.7162 -5.0910 -5.0910 -1.9971 -1.9971 -1.8579 -1.8579 -1.2904 -1.2904 4.5570 4.5570 4.5787 4.5787 4.9575 4.9575 6.6543 6.6543 6.8167 6.8167 8.0435 8.0435 8.1412 8.1412 8.5285 8.5285 8.5965 8.5965 9.8295 9.8295 10.2042 10.2042 10.2952 10.2952 11.2492 11.2492 11.9132 11.9132 12.7353 12.7353 12.8992 12.8992 k = 0.0000 0.0976-0.0000 ( 3393 PWs) bands (ev): -32.1947 -32.1947 -32.1912 -32.1912 -13.2605 -13.2605 -13.1976 -13.1976 -11.9374 -11.9374 -11.8093 -11.8093 -11.7369 -11.7369 -11.7185 -11.7185 -5.0742 -5.0742 -1.9892 -1.9892 -1.8474 -1.8474 -1.3245 -1.3245 4.5728 4.5728 4.5939 4.5939 4.9642 4.9642 6.6361 6.6361 6.8332 6.8332 8.0166 8.0166 8.1244 8.1244 8.4878 8.4878 8.5538 8.5538 9.8289 9.8289 10.1511 10.1511 10.2434 10.2434 11.3121 11.3121 11.9281 11.9281 12.7330 12.7330 12.8353 12.8353 k = 0.0000 0.1098-0.0000 ( 3389 PWs) bands (ev): -32.1944 -32.1944 -32.1910 -32.1910 -13.2610 -13.2610 -13.1989 -13.1989 -11.9375 -11.9375 -11.8107 -11.8107 -11.7394 -11.7394 -11.7209 -11.7209 -5.0553 -5.0553 -1.9803 -1.9803 -1.8358 -1.8358 -1.3626 -1.3626 4.5896 4.5896 4.6105 4.6105 4.9732 4.9732 6.6146 6.6146 6.8519 6.8519 7.9876 7.9876 8.1067 8.1067 8.4440 8.4440 8.5075 8.5075 9.8268 9.8268 10.0927 10.0927 10.1863 10.1863 11.3815 11.3815 11.9447 11.9447 12.7304 12.7304 12.7792 12.7792 k = 0.0000 0.1220-0.0000 ( 3385 PWs) bands (ev): -32.1941 -32.1941 -32.1907 -32.1907 -13.2616 -13.2616 -13.2004 -13.2004 -11.9376 -11.9376 -11.8124 -11.8124 -11.7421 -11.7421 -11.7235 -11.7235 -5.0343 -5.0343 -1.9704 -1.9704 -1.8230 -1.8230 -1.4044 -1.4044 4.6064 4.6064 4.6289 4.6289 4.9850 4.9850 6.5896 6.5896 6.8729 6.8729 7.9571 7.9571 8.0882 8.0882 8.3974 8.3974 8.4583 8.4583 9.8223 9.8223 10.0302 10.0302 10.1242 10.1242 11.4568 11.4568 11.9627 11.9627 12.7074 12.7074 12.7520 12.7520 k = 0.0000 0.1341-0.0000 ( 3381 PWs) bands (ev): -32.1938 -32.1938 -32.1905 -32.1905 -13.2623 -13.2623 -13.2021 -13.2021 -11.9377 -11.9377 -11.8144 -11.8144 -11.7449 -11.7449 -11.7261 -11.7261 -5.0112 -5.0112 -1.9595 -1.9595 -1.8093 -1.8093 -1.4498 -1.4498 4.6218 4.6218 4.6497 4.6497 5.0003 5.0003 6.5609 6.5609 6.8960 6.8960 7.9257 7.9257 8.0691 8.0691 8.3484 8.3484 8.4070 8.4070 9.8138 9.8138 9.9655 9.9655 10.0573 10.0573 11.5375 11.5375 11.9823 11.9823 12.6633 12.6633 12.7548 12.7548 k = 0.0000 0.1463-0.0000 ( 3383 PWs) bands (ev): -32.1935 -32.1935 -32.1902 -32.1902 -13.2630 -13.2630 -13.2039 -13.2039 -11.9379 -11.9379 -11.8168 -11.8168 -11.7477 -11.7477 -11.7287 -11.7287 -4.9860 -4.9860 -1.9478 -1.9478 -1.7946 -1.7946 -1.4986 -1.4986 4.6347 4.6347 4.6734 4.6734 5.0195 5.0195 6.5284 6.5284 6.9213 6.9213 7.8942 7.8942 8.0493 8.0493 8.2971 8.2971 8.3546 8.3546 9.7965 9.7965 9.9035 9.9035 9.9860 9.9860 11.6233 11.6233 12.0031 12.0031 12.6216 12.6216 12.7647 12.7647 k = 0.0000 0.1585-0.0000 ( 3385 PWs) bands (ev): -32.1931 -32.1931 -32.1899 -32.1899 -13.2637 -13.2637 -13.2058 -13.2058 -11.9382 -11.9382 -11.8195 -11.8195 -11.7506 -11.7506 -11.7312 -11.7312 -4.9588 -4.9588 -1.9353 -1.9353 -1.7791 -1.7791 -1.5505 -1.5505 4.6447 4.6447 4.6998 4.6998 5.0432 5.0432 6.4919 6.4919 6.9488 6.9488 7.8629 7.8629 8.0291 8.0291 8.2431 8.2431 8.3025 8.3025 9.7591 9.7591 9.8551 9.8551 9.9113 9.9113 11.7136 11.7136 12.0253 12.0253 12.5859 12.5859 12.7784 12.7784 k = 0.0000 0.1707-0.0000 ( 3373 PWs) bands (ev): -32.1927 -32.1927 -32.1896 -32.1896 -13.2645 -13.2645 -13.2079 -13.2079 -11.9386 -11.9386 -11.8225 -11.8225 -11.7535 -11.7535 -11.7336 -11.7336 -4.9295 -4.9295 -1.9219 -1.9219 -1.7630 -1.7630 -1.6053 -1.6053 4.6518 4.6518 4.7288 4.7288 5.0717 5.0717 6.4513 6.4513 6.9784 6.9784 7.8323 7.8323 8.0085 8.0085 8.1861 8.1861 8.2520 8.2520 9.6969 9.6969 9.8160 9.8160 9.8427 9.8427 11.8080 11.8080 12.0488 12.0488 12.5570 12.5570 12.7955 12.7955 k = 0.0000 0.1829-0.0000 ( 3369 PWs) bands (ev): -32.1923 -32.1923 -32.1892 -32.1892 -13.2653 -13.2653 -13.2101 -13.2101 -11.9391 -11.9391 -11.8260 -11.8260 -11.7562 -11.7562 -11.7359 -11.7359 -4.8983 -4.8983 -1.9077 -1.9077 -1.7462 -1.7462 -1.6628 -1.6628 4.6560 4.6560 4.7601 4.7601 5.1049 5.1049 6.4068 6.4068 7.0101 7.0101 7.8028 7.8028 7.9876 7.9876 8.1258 8.1258 8.2040 8.2040 9.6215 9.6215 9.7415 9.7415 9.8138 9.8138 11.9060 11.9060 12.0737 12.0737 12.5353 12.5353 12.8155 12.8155 k = 0.0000 0.1951-0.0000 ( 3367 PWs) bands (ev): -32.1919 -32.1919 -32.1889 -32.1889 -13.2662 -13.2662 -13.2124 -13.2124 -11.9397 -11.9397 -11.8298 -11.8298 -11.7589 -11.7589 -11.7380 -11.7380 -4.8652 -4.8652 -1.8930 -1.8930 -1.7292 -1.7292 -1.7224 -1.7224 4.6575 4.6575 4.7937 4.7937 5.1427 5.1427 6.3584 6.3584 7.0439 7.0439 7.7747 7.7747 7.9667 7.9667 8.0627 8.0627 8.1587 8.1587 9.5404 9.5404 9.6553 9.6553 9.7940 9.7940 12.0069 12.0069 12.1005 12.1005 12.5210 12.5210 12.8386 12.8386 k = 0.0000 0.2073-0.0000 ( 3357 PWs) bands (ev): -32.1914 -32.1914 -32.1885 -32.1885 -13.2671 -13.2671 -13.2148 -13.2148 -11.9404 -11.9404 -11.8341 -11.8341 -11.7614 -11.7614 -11.7400 -11.7400 -4.8302 -4.8302 -1.8778 -1.8778 -1.7846 -1.7846 -1.7113 -1.7113 4.6568 4.6568 4.8293 4.8293 5.1850 5.1850 6.3062 6.3062 7.0797 7.0797 7.7482 7.7482 7.9459 7.9459 7.9972 7.9972 8.1162 8.1162 9.4563 9.4563 9.5653 9.5653 9.7734 9.7734 12.1043 12.1043 12.1351 12.1351 12.5143 12.5143 12.8644 12.8644 k = 0.0000 0.2195-0.0000 ( 3363 PWs) bands (ev): -32.1910 -32.1910 -32.1882 -32.1882 -13.2680 -13.2680 -13.2173 -13.2173 -11.9412 -11.9412 -11.8386 -11.8386 -11.7638 -11.7638 -11.7417 -11.7417 -4.7933 -4.7933 -1.8664 -1.8664 -1.8441 -1.8441 -1.6935 -1.6935 4.6542 4.6542 4.8671 4.8671 5.2314 5.2314 6.2505 6.2505 7.1176 7.1176 7.7234 7.7234 7.9239 7.9239 7.9314 7.9314 8.0764 8.0764 9.3703 9.3703 9.4723 9.4723 9.7504 9.7504 12.1510 12.1510 12.2246 12.2246 12.5152 12.5152 12.8929 12.8929 k = 0.0000 0.2317-0.0000 ( 3367 PWs) bands (ev): -32.1906 -32.1906 -32.1879 -32.1879 -13.2689 -13.2689 -13.2199 -13.2199 -11.9421 -11.9421 -11.8435 -11.8435 -11.7659 -11.7659 -11.7433 -11.7433 -4.7546 -4.7546 -1.9176 -1.9176 -1.8424 -1.8424 -1.6757 -1.6757 4.6500 4.6500 4.9070 4.9070 5.2815 5.2815 6.1915 6.1915 7.1574 7.1574 7.7006 7.7006 7.8604 7.8604 7.9059 7.9059 8.0390 8.0390 9.2831 9.2831 9.3771 9.3771 9.7245 9.7245 12.1827 12.1827 12.3331 12.3331 12.5237 12.5237 12.9240 12.9240 k = 0.0000 0.2439-0.0000 ( 3361 PWs) bands (ev): -32.1901 -32.1901 -32.1875 -32.1875 -13.2698 -13.2698 -13.2226 -13.2226 -11.9431 -11.9431 -11.8486 -11.8486 -11.7677 -11.7677 -11.7447 -11.7447 -4.7141 -4.7141 -1.9848 -1.9848 -1.8258 -1.8258 -1.6578 -1.6578 4.6448 4.6448 4.9489 4.9489 5.3353 5.3353 6.1298 6.1298 7.1991 7.1991 7.6796 7.6796 7.7905 7.7905 7.8865 7.8865 8.0040 8.0040 9.1950 9.1950 9.2802 9.2802 9.6953 9.6953 12.2151 12.2151 12.4446 12.4446 12.5398 12.5398 12.9576 12.9576 k = 0.0000 0.2561-0.0000 ( 3369 PWs) bands (ev): -32.1897 -32.1897 -32.1872 -32.1872 -13.2708 -13.2708 -13.2253 -13.2253 -11.9442 -11.9442 -11.8540 -11.8540 -11.7694 -11.7694 -11.7460 -11.7460 -4.6719 -4.6719 -2.0539 -2.0539 -1.8082 -1.8082 -1.6402 -1.6402 4.6389 4.6389 4.9927 4.9927 5.3922 5.3922 6.0655 6.0655 7.2427 7.2427 7.6603 7.6603 7.7199 7.7199 7.8680 7.8680 7.9712 7.9712 9.1059 9.1059 9.1824 9.1824 9.6627 9.6627 12.2493 12.2493 12.5535 12.5535 12.5677 12.5677 12.9936 12.9936 k = 0.0000 0.2683-0.0000 ( 3369 PWs) bands (ev): -32.1892 -32.1892 -32.1868 -32.1868 -13.2717 -13.2717 -13.2281 -13.2281 -11.9454 -11.9454 -11.8595 -11.8595 -11.7707 -11.7707 -11.7471 -11.7471 -4.6280 -4.6280 -2.1245 -2.1245 -1.7902 -1.7902 -1.6228 -1.6228 4.6328 4.6328 5.0386 5.0386 5.4522 5.4522 5.9992 5.9992 7.2881 7.2881 7.6368 7.6368 7.6548 7.6548 7.8505 7.8505 7.9405 7.9405 9.0155 9.0155 9.0849 9.0849 9.6265 9.6265 12.2856 12.2856 12.5919 12.5919 12.6744 12.6744 13.0320 13.0320 k = 0.0000 0.2805-0.0000 ( 3363 PWs) bands (ev): -32.1888 -32.1888 -32.1865 -32.1865 -13.2726 -13.2726 -13.2310 -13.2310 -11.9466 -11.9466 -11.8652 -11.8652 -11.7718 -11.7718 -11.7482 -11.7482 -4.5824 -4.5824 -2.1961 -2.1961 -1.7718 -1.7718 -1.6059 -1.6059 4.6267 4.6267 5.0863 5.0863 5.5151 5.5151 5.9313 5.9313 7.3352 7.3352 7.5724 7.5724 7.6319 7.6319 7.8341 7.8341 7.9117 7.9117 8.9229 8.9229 8.9893 8.9893 9.5869 9.5869 12.3243 12.3243 12.6290 12.6290 12.7903 12.7903 13.0726 13.0726 k = 0.0000 0.2927-0.0000 ( 3359 PWs) bands (ev): -32.1883 -32.1883 -32.1861 -32.1861 -13.2735 -13.2735 -13.2338 -13.2338 -11.9479 -11.9479 -11.8709 -11.8709 -11.7727 -11.7727 -11.7491 -11.7491 -4.5351 -4.5351 -2.2688 -2.2688 -1.7533 -1.7533 -1.5896 -1.5896 4.6210 4.6210 5.1360 5.1360 5.5806 5.5806 5.8622 5.8622 7.3840 7.3840 7.4998 7.4998 7.6185 7.6185 7.8191 7.8191 7.8847 7.8847 8.8270 8.8270 8.8973 8.8973 9.5437 9.5437 12.3656 12.3656 12.6722 12.6722 12.9070 12.9070 13.1155 13.1155 k = 0.0000 0.3049-0.0000 ( 3365 PWs) bands (ev): -32.1879 -32.1879 -32.1858 -32.1858 -13.2743 -13.2743 -13.2367 -13.2367 -11.9492 -11.9492 -11.8767 -11.8767 -11.7733 -11.7733 -11.7499 -11.7499 -4.4863 -4.4863 -2.3422 -2.3422 -1.7346 -1.7346 -1.5740 -1.5740 4.6160 4.6160 5.1875 5.1875 5.6487 5.6487 5.7924 5.7924 7.4261 7.4261 7.4343 7.4343 7.6076 7.6076 7.8056 7.8056 7.8594 7.8594 8.7277 8.7277 8.8097 8.8097 9.4973 9.4973 12.4097 12.4097 12.7213 12.7213 13.0237 13.0237 13.1607 13.1607 k = 0.0000 0.3171-0.0000 ( 3369 PWs) bands (ev): -32.1875 -32.1875 -32.1855 -32.1855 -13.2751 -13.2751 -13.2396 -13.2396 -11.9504 -11.9504 -11.8825 -11.8825 -11.7737 -11.7737 -11.7507 -11.7507 -4.4360 -4.4360 -2.4162 -2.4162 -1.7158 -1.7158 -1.5593 -1.5593 4.6122 4.6122 5.2408 5.2408 5.7161 5.7161 5.7253 5.7253 7.3521 7.3521 7.4855 7.4855 7.5987 7.5987 7.7936 7.7936 7.8357 7.8357 8.6256 8.6256 8.7264 8.7264 9.4476 9.4476 12.4567 12.4567 12.7759 12.7759 13.1394 13.1394 13.2088 13.2088 k = 0.0000 0.3293-0.0000 ( 3367 PWs) bands (ev): -32.1870 -32.1870 -32.1852 -32.1852 -13.2758 -13.2758 -13.2425 -13.2425 -11.9515 -11.9515 -11.8882 -11.8882 -11.7738 -11.7738 -11.7514 -11.7514 -4.3841 -4.3841 -2.4907 -2.4907 -1.6971 -1.6971 -1.5454 -1.5454 4.6097 4.6097 5.2958 5.2958 5.6518 5.6518 5.7923 5.7923 7.2776 7.2776 7.5372 7.5372 7.5920 7.5920 7.7834 7.7834 7.8139 7.8139 8.5220 8.5220 8.6469 8.6469 9.3949 9.3949 12.5068 12.5068 12.8354 12.8354 13.2426 13.2426 13.2708 13.2708 k = 0.0000 0.3415-0.0000 ( 3367 PWs) bands (ev): -32.1866 -32.1866 -32.1849 -32.1849 -13.2765 -13.2765 -13.2453 -13.2453 -11.9526 -11.9526 -11.8939 -11.8939 -11.7738 -11.7738 -11.7522 -11.7522 -4.3307 -4.3307 -2.5655 -2.5655 -1.6785 -1.6785 -1.5327 -1.5327 4.6089 4.6089 5.3524 5.3524 5.5823 5.5823 5.8673 5.8673 7.2027 7.2027 7.5792 7.5792 7.5967 7.5967 7.7747 7.7747 7.7948 7.7948 8.4179 8.4179 8.5708 8.5708 9.3393 9.3393 12.5599 12.5599 12.8992 12.8992 13.3020 13.3020 13.3775 13.3775 k = 0.0000 0.3537-0.0000 ( 3374 PWs) bands (ev): -32.1863 -32.1863 -32.1847 -32.1847 -13.2771 -13.2771 -13.2481 -13.2481 -11.9536 -11.9536 -11.8994 -11.8994 -11.7735 -11.7735 -11.7529 -11.7529 -4.2759 -4.2759 -2.6406 -2.6406 -1.6602 -1.6602 -1.5211 -1.5211 4.6100 4.6100 5.4102 5.4102 5.5141 5.5141 5.9444 5.9444 7.1275 7.1275 7.5798 7.5798 7.6415 7.6415 7.7660 7.7660 7.7820 7.7820 8.3141 8.3141 8.4980 8.4980 9.2812 9.2812 12.6162 12.6162 12.9665 12.9665 13.3552 13.3552 13.4907 13.4907 k = 0.0000 0.3659-0.0000 ( 3368 PWs) bands (ev): -32.1859 -32.1859 -32.1844 -32.1844 -13.2775 -13.2775 -13.2508 -13.2508 -11.9544 -11.9544 -11.9047 -11.9047 -11.7731 -11.7731 -11.7536 -11.7536 -4.2197 -4.2197 -2.7157 -2.7157 -1.6422 -1.6422 -1.5107 -1.5107 4.6133 4.6133 5.4401 5.4401 5.4765 5.4765 6.0236 6.0236 7.0521 7.0521 7.5776 7.5776 7.6796 7.6796 7.7578 7.7578 7.7827 7.7827 8.2120 8.2120 8.4286 8.4286 9.2207 9.2207 12.6757 12.6757 13.0366 13.0366 13.4092 13.4092 13.6028 13.6028 k = 0.0000 0.3780-0.0000 ( 3374 PWs) bands (ev): -32.1856 -32.1856 -32.1842 -32.1842 -13.2779 -13.2779 -13.2535 -13.2535 -11.9550 -11.9550 -11.9099 -11.9099 -11.7726 -11.7726 -11.7543 -11.7543 -4.1621 -4.1621 -2.7908 -2.7908 -1.6247 -1.6247 -1.5018 -1.5018 4.6190 4.6190 5.3773 5.3773 5.5345 5.5345 6.1048 6.1048 6.9764 6.9764 7.5764 7.5764 7.6902 7.6902 7.7565 7.7565 7.8051 7.8051 8.1139 8.1139 8.3625 8.3625 9.1580 9.1580 12.7381 12.7381 13.1085 13.1085 13.4644 13.4644 13.7125 13.7125 k = 0.0000 0.3902-0.0000 ( 3374 PWs) bands (ev): -32.1852 -32.1852 -32.1840 -32.1840 -13.2781 -13.2781 -13.2561 -13.2561 -11.9555 -11.9555 -11.9149 -11.9149 -11.7719 -11.7719 -11.7550 -11.7550 -4.1032 -4.1032 -2.8658 -2.8658 -1.6076 -1.6076 -1.4942 -1.4942 4.6273 4.6273 5.3129 5.3129 5.5973 5.5973 6.1879 6.1879 6.9006 6.9006 7.5763 7.5763 7.6771 7.6771 7.7589 7.7589 7.8416 7.8416 8.0268 8.0268 8.2998 8.2998 9.0936 9.0936 12.8035 12.8035 13.1809 13.1809 13.5210 13.5210 13.8187 13.8187 k = 0.0000 0.4024-0.0000 ( 3376 PWs) bands (ev): -32.1849 -32.1849 -32.1838 -32.1838 -13.2782 -13.2782 -13.2585 -13.2585 -11.9557 -11.9557 -11.9196 -11.9196 -11.7711 -11.7711 -11.7558 -11.7558 -4.0430 -4.0430 -2.9405 -2.9405 -1.5913 -1.5913 -1.4881 -1.4881 4.6384 4.6384 5.2502 5.2502 5.6619 5.6619 6.2728 6.2728 6.8247 6.8247 7.5771 7.5771 7.6521 7.6521 7.7630 7.7630 7.8513 7.8513 7.9821 7.9821 8.2406 8.2406 9.0275 9.0275 12.8715 12.8715 13.2524 13.2524 13.5787 13.5787 13.9200 13.9200 k = 0.0000 0.4146-0.0000 ( 3364 PWs) bands (ev): -32.1846 -32.1846 -32.1836 -32.1836 -13.2782 -13.2782 -13.2609 -13.2609 -11.9557 -11.9557 -11.9241 -11.9241 -11.7703 -11.7703 -11.7566 -11.7566 -3.9816 -3.9816 -3.0149 -3.0149 -1.5757 -1.5757 -1.4835 -1.4835 4.6525 4.6525 5.1896 5.1896 5.7278 5.7278 6.3595 6.3595 6.7487 6.7487 7.5781 7.5781 7.6153 7.6153 7.7690 7.7690 7.8040 7.8040 8.0106 8.0106 8.1850 8.1850 8.9600 8.9600 12.9419 12.9419 13.3211 13.3211 13.6375 13.6375 14.0135 14.0135 k = 0.0000 0.4268-0.0000 ( 3356 PWs) bands (ev): -32.1843 -32.1843 -32.1835 -32.1835 -13.2780 -13.2780 -13.2631 -13.2631 -11.9554 -11.9554 -11.9283 -11.9283 -11.7693 -11.7693 -11.7574 -11.7574 -3.9189 -3.9189 -3.0889 -3.0889 -1.5609 -1.5609 -1.4805 -1.4805 4.6697 4.6697 5.1314 5.1314 5.7952 5.7952 6.4477 6.4477 6.6728 6.6728 7.5530 7.5530 7.5869 7.5869 7.7501 7.7501 7.7791 7.7791 8.0657 8.0657 8.1332 8.1332 8.8915 8.8915 13.0142 13.0142 13.3845 13.3845 13.6973 13.6973 14.0937 14.0937 k = 0.0000 0.4390-0.0000 ( 3360 PWs) bands (ev): -32.1841 -32.1841 -32.1834 -32.1834 -13.2777 -13.2777 -13.2653 -13.2653 -11.9548 -11.9548 -11.9323 -11.9323 -11.7683 -11.7683 -11.7583 -11.7583 -3.8551 -3.8551 -3.1624 -3.1624 -1.5471 -1.5471 -1.4790 -1.4790 4.6900 4.6900 5.0758 5.0758 5.8637 5.8637 6.5370 6.5370 6.5976 6.5976 7.4790 7.4790 7.5893 7.5893 7.7127 7.7127 7.7904 7.7904 8.0831 8.0831 8.1297 8.1297 8.8220 8.8220 13.0879 13.0879 13.4391 13.4391 13.7577 13.7577 14.1500 14.1500 k = 0.0000 0.4512-0.0000 ( 3362 PWs) bands (ev): -32.1839 -32.1839 -32.1833 -32.1833 -13.2772 -13.2772 -13.2672 -13.2672 -11.9540 -11.9540 -11.9360 -11.9360 -11.7673 -11.7673 -11.7592 -11.7592 -3.7901 -3.7901 -3.2353 -3.2353 -1.5343 -1.5343 -1.4792 -1.4792 4.7137 4.7137 5.0229 5.0229 5.9334 5.9334 6.5205 6.5205 6.6299 6.6299 7.3913 7.3913 7.5944 7.5944 7.6867 7.6867 7.8049 7.8049 8.0388 8.0388 8.1945 8.1945 8.7520 8.7520 13.1621 13.1621 13.4803 13.4803 13.8188 13.8188 14.1622 14.1622 k = 0.0000 0.4634-0.0000 ( 3368 PWs) bands (ev): -32.1837 -32.1837 -32.1833 -32.1833 -13.2765 -13.2765 -13.2690 -13.2690 -11.9528 -11.9528 -11.9393 -11.9393 -11.7663 -11.7663 -11.7601 -11.7601 -3.7241 -3.7241 -3.3076 -3.3076 -1.5227 -1.5227 -1.4809 -1.4809 4.7407 4.7407 4.9730 4.9730 6.0042 6.0042 6.4454 6.4454 6.7225 6.7225 7.2977 7.2977 7.6008 7.6008 7.6672 7.6672 7.8225 7.8225 7.9975 7.9975 8.2617 8.2617 8.6815 8.6815 13.2358 13.2358 13.5025 13.5025 13.8801 13.8801 14.1349 14.1349 k = 0.0000 0.4756-0.0000 ( 3364 PWs) bands (ev): -32.1836 -32.1836 -32.1833 -32.1833 -13.2757 -13.2757 -13.2707 -13.2707 -11.9514 -11.9514 -11.9424 -11.9424 -11.7652 -11.7652 -11.7611 -11.7611 -3.6570 -3.6570 -3.3791 -3.3791 -1.5122 -1.5122 -1.4842 -1.4842 4.7711 4.7711 4.9261 4.9261 6.0759 6.0759 6.3704 6.3704 6.8166 6.8166 7.2017 7.2017 7.6084 7.6084 7.6516 7.6516 7.8433 7.8433 7.9598 7.9598 8.3302 8.3302 8.6108 8.6108 13.3073 13.3073 13.5015 13.5015 13.9413 13.9413 14.1163 14.1163 k = 0.0000 0.4878-0.0000 ( 3362 PWs) bands (ev): -32.1835 -32.1835 -32.1833 -32.1833 -13.2747 -13.2747 -13.2722 -13.2722 -11.9496 -11.9496 -11.9451 -11.9451 -11.7642 -11.7642 -11.7621 -11.7621 -3.5889 -3.5889 -3.4499 -3.4499 -1.5031 -1.5031 -1.4890 -1.4890 4.8048 4.8048 4.8824 4.8824 6.1485 6.1485 6.2958 6.2958 6.9119 6.9119 7.1048 7.1048 7.6171 7.6171 7.6384 7.6384 7.8674 7.8674 7.9255 7.9255 8.3996 8.3996 8.5401 8.5401 13.3740 13.3740 13.4766 13.4766 14.0021 14.0021 14.1077 14.1077 k = 0.0000 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2735 -13.2735 -13.2735 -13.2735 -11.9475 -11.9475 -11.9475 -11.9475 -11.7631 -11.7631 -11.7631 -11.7631 -3.5198 -3.5198 -3.5198 -3.5198 -1.4954 -1.4954 -1.4954 -1.4954 4.8419 4.8419 4.8419 4.8419 6.2218 6.2218 6.2218 6.2218 7.0080 7.0080 7.0080 7.0080 7.6270 7.6270 7.6270 7.6270 7.8947 7.8947 7.8947 7.8947 8.4697 8.4697 8.4697 8.4697 13.4322 13.4322 13.4322 13.4322 14.0614 14.0614 14.0614 14.0614 k = 0.0000 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2735 -13.2735 -13.2735 -13.2735 -11.9475 -11.9475 -11.9475 -11.9475 -11.7631 -11.7631 -11.7631 -11.7631 -3.5198 -3.5198 -3.5198 -3.5198 -1.4954 -1.4954 -1.4954 -1.4954 4.8419 4.8419 4.8419 4.8419 6.2218 6.2218 6.2218 6.2218 7.0080 7.0080 7.0080 7.0080 7.6270 7.6270 7.6270 7.6270 7.8947 7.8947 7.8947 7.8947 8.4697 8.4697 8.4697 8.4697 13.4322 13.4322 13.4322 13.4322 14.0614 14.0614 14.0614 14.0614 k = 0.0122 0.5000-0.0000 ( 3366 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2742 -13.2742 -13.2730 -13.2730 -11.9474 -11.9474 -11.9474 -11.9474 -11.7643 -11.7643 -11.7624 -11.7624 -3.5201 -3.5201 -3.5185 -3.5185 -1.4956 -1.4956 -1.4956 -1.4956 4.8431 4.8431 4.8435 4.8435 6.1955 6.1955 6.2024 6.2024 7.0280 7.0280 7.0332 7.0332 7.6221 7.6221 7.6238 7.6238 7.8960 7.8960 7.8984 7.8984 8.4689 8.4689 8.4744 8.4744 13.4304 13.4304 13.4333 13.4333 14.0592 14.0592 14.0641 14.0641 k = 0.0244 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1833 -32.1833 -32.1833 -32.1833 -13.2749 -13.2749 -13.2725 -13.2725 -11.9472 -11.9472 -11.9472 -11.9472 -11.7659 -11.7659 -11.7621 -11.7621 -3.5194 -3.5194 -3.5161 -3.5161 -1.4964 -1.4964 -1.4963 -1.4963 4.8470 4.8470 4.8477 4.8477 6.1311 6.1311 6.1433 6.1433 7.0869 7.0869 7.0955 7.0955 7.6093 7.6093 7.6130 7.6130 7.9025 7.9025 7.9068 7.9068 8.4722 8.4722 8.4829 8.4829 13.4280 13.4280 13.4339 13.4339 14.0577 14.0577 14.0674 14.0674 k = 0.0366 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1832 -32.1832 -32.1832 -32.1832 -13.2756 -13.2756 -13.2720 -13.2720 -11.9469 -11.9469 -11.9468 -11.9468 -11.7679 -11.7679 -11.7623 -11.7623 -3.5176 -3.5176 -3.5128 -3.5128 -1.4977 -1.4977 -1.4975 -1.4975 4.8534 4.8534 4.8546 4.8546 6.0421 6.0421 6.0579 6.0579 7.1704 7.1704 7.1801 7.1801 7.5897 7.5897 7.5960 7.5960 7.9145 7.9145 7.9204 7.9204 8.4790 8.4790 8.4947 8.4947 13.4252 13.4252 13.4339 13.4339 14.0572 14.0572 14.0710 14.0710 k = 0.0488 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1831 -32.1831 -32.1831 -32.1831 -13.2764 -13.2764 -13.2716 -13.2716 -11.9464 -11.9464 -11.9464 -11.9464 -11.7703 -11.7703 -11.7628 -11.7628 -3.5148 -3.5148 -3.5084 -3.5084 -1.4995 -1.4995 -1.4992 -1.4992 4.8623 4.8623 4.8639 4.8639 5.9392 5.9392 5.9574 5.9574 7.2648 7.2648 7.2733 7.2733 7.5651 7.5651 7.5752 7.5752 7.9333 7.9333 7.9404 7.9404 8.4890 8.4890 8.5092 8.5092 13.4223 13.4223 13.4334 13.4334 14.0577 14.0577 14.0752 14.0752 k = 0.0610 0.5000-0.0000 ( 3354 PWs) bands (ev): -32.1830 -32.1830 -32.1830 -32.1830 -13.2772 -13.2772 -13.2713 -13.2713 -11.9458 -11.9458 -11.9458 -11.9458 -11.7730 -11.7730 -11.7639 -11.7639 -3.5110 -3.5110 -3.5031 -3.5031 -1.5017 -1.5017 -1.5014 -1.5014 4.8734 4.8734 4.8755 4.8755 5.8291 5.8291 5.8492 5.8492 7.3576 7.3576 7.3612 7.3612 7.5396 7.5396 7.5562 7.5562 7.9610 7.9610 7.9692 7.9692 8.5013 8.5013 8.5256 8.5256 13.4194 13.4194 13.4328 13.4328 14.0594 14.0594 14.0800 14.0800 k = 0.0732 0.5000-0.0000 ( 3358 PWs) bands (ev): -32.1828 -32.1828 -32.1828 -32.1828 -13.2781 -13.2781 -13.2711 -13.2711 -11.9451 -11.9451 -11.9450 -11.9450 -11.7762 -11.7762 -11.7653 -11.7653 -3.5061 -3.5061 -3.4967 -3.4967 -1.5045 -1.5045 -1.5040 -1.5040 4.8863 4.8863 4.8889 4.8889 5.7160 5.7160 5.7376 5.7376 7.4186 7.4186 7.4247 7.4247 7.5301 7.5301 7.5572 7.5572 8.0012 8.0012 8.0105 8.0105 8.5155 8.5155 8.5433 8.5433 13.4168 13.4168 13.4321 13.4321 14.0625 14.0625 14.0855 14.0855 k = 0.0854 0.5000-0.0000 ( 3350 PWs) bands (ev): -32.1826 -32.1826 -32.1826 -32.1826 -13.2790 -13.2790 -13.2709 -13.2709 -11.9443 -11.9443 -11.9442 -11.9442 -11.7796 -11.7796 -11.7671 -11.7671 -3.5003 -3.5003 -3.4895 -3.4895 -1.5077 -1.5077 -1.5072 -1.5072 4.9002 4.9002 4.9035 4.9035 5.6029 5.6029 5.6257 5.6257 7.4204 7.4204 7.4251 7.4251 7.5717 7.5717 7.5972 7.5972 8.0576 8.0576 8.0688 8.0688 8.5309 8.5309 8.5621 8.5621 13.4148 13.4148 13.4317 13.4317 14.0671 14.0671 14.0919 14.0919 k = 0.0976 0.5000-0.0000 ( 3352 PWs) bands (ev): -32.1824 -32.1824 -32.1824 -32.1824 -13.2799 -13.2799 -13.2708 -13.2708 -11.9433 -11.9433 -11.9432 -11.9432 -11.7834 -11.7834 -11.7693 -11.7693 -3.4936 -3.4936 -3.4814 -3.4814 -1.5113 -1.5113 -1.5108 -1.5108 4.9139 4.9139 4.9178 4.9178 5.4923 5.4923 5.5163 5.5163 7.3921 7.3921 7.3922 7.3922 7.6273 7.6273 7.6472 7.6472 8.1324 8.1324 8.1459 8.1459 8.5477 8.5477 8.5820 8.5820 13.4137 13.4137 13.4318 13.4318 14.0734 14.0734 14.0995 14.0995 k = 0.1098 0.5000-0.0000 ( 3352 PWs) bands (ev): -32.1822 -32.1822 -32.1822 -32.1822 -13.2809 -13.2809 -13.2708 -13.2708 -11.9422 -11.9422 -11.9422 -11.9422 -11.7875 -11.7875 -11.7719 -11.7719 -3.4859 -3.4859 -3.4724 -3.4724 -1.5155 -1.5155 -1.5148 -1.5148 4.9248 4.9248 4.9294 4.9294 5.3877 5.3877 5.4127 5.4127 7.3514 7.3514 7.3540 7.3540 7.6721 7.6721 7.6878 7.6878 8.2230 8.2230 8.2390 8.2390 8.5668 8.5668 8.6041 8.6041 13.4136 13.4136 13.4326 13.4326 14.0815 14.0815 14.1084 14.1084 k = 0.1220 0.5000-0.0000 ( 3348 PWs) bands (ev): -32.1819 -32.1819 -32.1819 -32.1819 -13.2818 -13.2818 -13.2708 -13.2708 -11.9411 -11.9411 -11.9411 -11.9411 -11.7918 -11.7918 -11.7749 -11.7749 -3.4773 -3.4773 -3.4626 -3.4626 -1.5200 -1.5200 -1.5193 -1.5193 4.9278 4.9278 4.9326 4.9326 5.2953 5.2953 5.3207 5.3207 7.3075 7.3075 7.3119 7.3119 7.7049 7.7049 7.7175 7.7175 8.3214 8.3214 8.3393 8.3393 8.5921 8.5921 8.6317 8.6317 13.4149 13.4149 13.4343 13.4343 14.0914 14.0914 14.1188 14.1188 k = 0.1341 0.5000-0.0000 ( 3356 PWs) bands (ev): -32.1817 -32.1817 -32.1817 -32.1817 -13.2829 -13.2829 -13.2710 -13.2710 -11.9398 -11.9398 -11.9398 -11.9398 -11.7963 -11.7963 -11.7781 -11.7781 -3.4679 -3.4679 -3.4520 -3.4520 -1.5250 -1.5250 -1.5242 -1.5242 4.9135 4.9135 4.9163 4.9163 5.2266 5.2266 5.2501 5.2501 7.2620 7.2620 7.2677 7.2677 7.7286 7.7286 7.7389 7.7389 8.4146 8.4146 8.4303 8.4303 8.6351 8.6351 8.6731 8.6731 13.4176 13.4176 13.4371 13.4371 14.1035 14.1035 14.1310 14.1310 k = 0.1463 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1814 -32.1814 -32.1814 -32.1814 -13.2839 -13.2839 -13.2712 -13.2712 -11.9386 -11.9386 -11.9385 -11.9385 -11.8010 -11.8010 -11.7817 -11.7817 -3.4576 -3.4576 -3.4407 -3.4407 -1.5303 -1.5303 -1.5296 -1.5296 4.8692 4.8692 4.8715 4.8715 5.1930 5.1930 5.2116 5.2116 7.2159 7.2159 7.2224 7.2224 7.7463 7.7463 7.7547 7.7547 8.4847 8.4847 8.4899 8.4899 8.7138 8.7138 8.7417 8.7417 13.4219 13.4219 13.4412 13.4412 14.1178 14.1178 14.1452 14.1452 k = 0.1585 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1811 -32.1811 -32.1811 -32.1811 -13.2850 -13.2850 -13.2716 -13.2716 -11.9373 -11.9373 -11.9371 -11.9371 -11.8058 -11.8058 -11.7855 -11.7855 -3.4466 -3.4466 -3.4287 -3.4287 -1.5361 -1.5361 -1.5352 -1.5352 4.7946 4.7946 4.8022 4.8022 5.1915 5.1915 5.2048 5.2048 7.1694 7.1694 7.1765 7.1765 7.7597 7.7597 7.7666 7.7666 8.5180 8.5180 8.5247 8.5247 8.8257 8.8257 8.8421 8.8421 13.4279 13.4279 13.4466 13.4466 14.1344 14.1344 14.1616 14.1616 k = 0.1707 0.5000-0.0000 ( 3370 PWs) bands (ev): -32.1808 -32.1808 -32.1808 -32.1808 -13.2860 -13.2860 -13.2720 -13.2720 -11.9359 -11.9359 -11.9356 -11.9356 -11.8107 -11.8107 -11.7895 -11.7895 -3.4349 -3.4349 -3.4161 -3.4161 -1.5422 -1.5422 -1.5413 -1.5413 4.7052 4.7052 4.7167 4.7167 5.2095 5.2095 5.2188 5.2188 7.1231 7.1231 7.1306 7.1306 7.7704 7.7704 7.7759 7.7759 8.5292 8.5292 8.5436 8.5436 8.9540 8.9540 8.9632 8.9632 13.4358 13.4358 13.4536 13.4536 14.1536 14.1536 14.1803 14.1803 k = 0.1829 0.5000-0.0000 ( 3358 PWs) bands (ev): -32.1804 -32.1804 -32.1804 -32.1804 -13.2871 -13.2871 -13.2725 -13.2725 -11.9346 -11.9346 -11.9341 -11.9341 -11.8156 -11.8156 -11.7938 -11.7938 -3.4225 -3.4225 -3.4029 -3.4029 -1.5486 -1.5486 -1.5477 -1.5477 4.6100 4.6100 4.6240 4.6240 5.2380 5.2380 5.2448 5.2448 7.0772 7.0772 7.0849 7.0849 7.7790 7.7790 7.7835 7.7835 8.5318 8.5318 8.5506 8.5506 9.0894 9.0894 9.0945 9.0945 13.4455 13.4455 13.4623 13.4623 14.1753 14.1753 14.2015 14.2015 k = 0.1951 0.5000-0.0000 ( 3356 PWs) bands (ev): -32.1800 -32.1800 -32.1800 -32.1800 -13.2882 -13.2882 -13.2731 -13.2731 -11.9332 -11.9332 -11.9326 -11.9326 -11.8206 -11.8206 -11.7982 -11.7982 -3.4095 -3.4095 -3.3893 -3.3893 -1.5553 -1.5553 -1.5544 -1.5544 4.5133 4.5133 4.5288 4.5288 5.2728 5.2728 5.2779 5.2779 7.0321 7.0321 7.0399 7.0399 7.7863 7.7863 7.7898 7.7898 8.5285 8.5285 8.5500 8.5500 9.2280 9.2280 9.2306 9.2306 13.4572 13.4572 13.4727 13.4727 14.1995 14.1995 14.2252 14.2252 k = 0.2073 0.5000-0.0000 ( 3354 PWs) bands (ev): -32.1797 -32.1797 -32.1797 -32.1797 -13.2893 -13.2893 -13.2737 -13.2737 -11.9319 -11.9319 -11.9310 -11.9310 -11.8255 -11.8255 -11.8027 -11.8027 -3.3960 -3.3960 -3.3752 -3.3752 -1.5624 -1.5624 -1.5614 -1.5614 4.4171 4.4171 4.4336 4.4336 5.3118 5.3118 5.3156 5.3156 6.9879 6.9879 6.9957 6.9957 7.7925 7.7925 7.7952 7.7952 8.5207 8.5207 8.5438 8.5438 9.3676 9.3676 9.3688 9.3688 13.4711 13.4711 13.4850 13.4850 14.2263 14.2263 14.2514 14.2514 k = 0.2195 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1793 -32.1793 -32.1793 -32.1793 -13.2903 -13.2903 -13.2745 -13.2745 -11.9306 -11.9306 -11.9295 -11.9295 -11.8303 -11.8303 -11.8074 -11.8074 -3.3820 -3.3820 -3.3608 -3.3608 -1.5696 -1.5696 -1.5687 -1.5687 4.3225 4.3225 4.3397 4.3397 5.3538 5.3538 5.3566 5.3566 6.9448 6.9448 6.9526 6.9526 7.7979 7.7979 7.7999 7.7999 8.5089 8.5089 8.5331 8.5331 9.5073 9.5073 9.5075 9.5075 13.4871 13.4871 13.4994 13.4994 14.2555 14.2555 14.2801 14.2801 k = 0.2317 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1789 -32.1789 -32.1789 -32.1789 -13.2914 -13.2914 -13.2753 -13.2753 -11.9294 -11.9294 -11.9280 -11.9280 -11.8350 -11.8350 -11.8120 -11.8120 -3.3676 -3.3676 -3.3461 -3.3461 -1.5771 -1.5771 -1.5762 -1.5762 4.2303 4.2303 4.2479 4.2479 5.3982 5.3982 5.4001 5.4001 6.9030 6.9030 6.9107 6.9107 7.8026 7.8026 7.8041 7.8041 8.4936 8.4936 8.5184 8.5184 9.6457 9.6457 9.6461 9.6461 13.5055 13.5055 13.5160 13.5160 14.2869 14.2869 14.3109 14.3109 k = 0.2439 0.5000-0.0000 ( 3358 PWs) bands (ev): -32.1785 -32.1785 -32.1785 -32.1785 -13.2924 -13.2924 -13.2762 -13.2762 -11.9283 -11.9283 -11.9266 -11.9266 -11.8395 -11.8395 -11.8167 -11.8167 -3.3529 -3.3529 -3.3311 -3.3311 -1.5848 -1.5848 -1.5838 -1.5838 4.1409 4.1409 4.1587 4.1587 5.4443 5.4443 5.4455 5.4455 6.8628 6.8628 6.8703 6.8703 7.8069 7.8069 7.8080 7.8080 8.4750 8.4750 8.5001 8.5001 9.7826 9.7826 9.7834 9.7834 13.5264 13.5264 13.5350 13.5350 14.3201 14.3201 14.3436 14.3436 k = 0.2561 0.5000-0.0000 ( 3366 PWs) bands (ev): -32.1782 -32.1782 -32.1782 -32.1782 -13.2935 -13.2935 -13.2772 -13.2772 -11.9274 -11.9274 -11.9252 -11.9252 -11.8437 -11.8437 -11.8214 -11.8214 -3.3380 -3.3380 -3.3161 -3.3161 -1.5926 -1.5926 -1.5916 -1.5916 4.0544 4.0544 4.0723 4.0723 5.4917 5.4917 5.4923 5.4923 6.8242 6.8242 6.8315 6.8315 7.8108 7.8108 7.8115 7.8115 8.4535 8.4535 8.4787 8.4787 9.9175 9.9175 9.9186 9.9186 13.5498 13.5498 13.5565 13.5565 14.3547 14.3547 14.3774 14.3774 k = 0.2683 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1778 -32.1778 -32.1778 -32.1778 -13.2945 -13.2945 -13.2783 -13.2783 -11.9266 -11.9266 -11.9239 -11.9239 -11.8477 -11.8477 -11.8259 -11.8259 -3.3228 -3.3228 -3.3010 -3.3010 -1.6005 -1.6005 -1.5995 -1.5995 3.9713 3.9713 3.9890 3.9890 5.5402 5.5402 5.5402 5.5402 6.7875 6.7875 6.7945 6.7945 7.8143 7.8143 7.8148 7.8148 8.4292 8.4292 8.4544 8.4544 10.0499 10.0499 10.0512 10.0512 13.5761 13.5761 13.5808 13.5808 14.3903 14.3903 14.4117 14.4117 k = 0.2805 0.5000-0.0000 ( 3358 PWs) bands (ev): -32.1774 -32.1774 -32.1774 -32.1774 -13.2954 -13.2954 -13.2794 -13.2794 -11.9260 -11.9260 -11.9227 -11.9227 -11.8513 -11.8513 -11.8304 -11.8304 -3.3076 -3.3076 -3.2860 -3.2860 -1.6084 -1.6084 -1.6075 -1.6075 3.8916 3.8916 3.9091 3.9091 5.5888 5.5888 5.5892 5.5892 6.7527 6.7527 6.7595 6.7595 7.8175 7.8175 7.8179 7.8179 8.4024 8.4024 8.4275 8.4275 10.1792 10.1792 10.1807 10.1807 13.6052 13.6052 13.6080 13.6080 14.4263 14.4263 14.4458 14.4458 k = 0.2927 0.5000-0.0000 ( 3358 PWs) bands (ev): -32.1770 -32.1770 -32.1770 -32.1770 -13.2963 -13.2963 -13.2806 -13.2806 -11.9255 -11.9255 -11.9217 -11.9217 -11.8546 -11.8546 -11.8347 -11.8347 -3.2924 -3.2924 -3.2711 -3.2711 -1.6164 -1.6164 -1.6155 -1.6155 3.8155 3.8155 3.8327 3.8327 5.6376 5.6376 5.6385 5.6385 6.7201 6.7201 6.7265 6.7265 7.8205 7.8205 7.8209 7.8209 8.3734 8.3734 8.3983 8.3983 10.3051 10.3051 10.3066 10.3066 13.6374 13.6374 13.6382 13.6382 14.4623 14.4623 14.4790 14.4790 k = 0.3049 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1767 -32.1767 -32.1767 -32.1767 -13.2972 -13.2972 -13.2818 -13.2818 -11.9253 -11.9253 -11.9209 -11.9209 -11.8575 -11.8575 -11.8388 -11.8388 -3.2773 -3.2773 -3.2564 -3.2564 -1.6243 -1.6243 -1.6235 -1.6235 3.7431 3.7431 3.7599 3.7599 5.6864 5.6864 5.6877 5.6877 6.6897 6.6897 6.6958 6.6958 7.8233 7.8233 7.8237 7.8237 8.3425 8.3425 8.3671 8.3671 10.4269 10.4269 10.4285 10.4285 13.6716 13.6716 13.6728 13.6728 14.4977 14.4977 14.5111 14.5111 k = 0.3171 0.5000-0.0000 ( 3354 PWs) bands (ev): -32.1763 -32.1763 -32.1763 -32.1763 -13.2980 -13.2980 -13.2830 -13.2830 -11.9254 -11.9254 -11.9203 -11.9203 -11.8599 -11.8599 -11.8426 -11.8426 -3.2624 -3.2624 -3.2420 -3.2420 -1.6321 -1.6321 -1.6313 -1.6313 3.6747 3.6747 3.6909 3.6909 5.7347 5.7347 5.7364 5.7364 6.6617 6.6617 6.6675 6.6675 7.8258 7.8258 7.8264 7.8264 8.3100 8.3100 8.3343 8.3343 10.5442 10.5442 10.5459 10.5459 13.7082 13.7082 13.7113 13.7113 14.5322 14.5322 14.5420 14.5420 k = 0.3293 0.5000-0.0000 ( 3356 PWs) bands (ev): -32.1760 -32.1760 -32.1760 -32.1760 -13.2988 -13.2988 -13.2843 -13.2843 -11.9256 -11.9256 -11.9198 -11.9198 -11.8620 -11.8620 -11.8461 -11.8461 -3.2477 -3.2477 -3.2281 -3.2281 -1.6398 -1.6398 -1.6391 -1.6391 3.6102 3.6102 3.6258 3.6258 5.7821 5.7821 5.7842 5.7842 6.6364 6.6364 6.6418 6.6418 7.8282 7.8282 7.8290 7.8290 8.2763 8.2763 8.3001 8.3001 10.6566 10.6566 10.6582 10.6582 13.7482 13.7482 13.7531 13.7531 14.5656 14.5656 14.5715 14.5715 k = 0.3415 0.5000-0.0000 ( 3360 PWs) bands (ev): -32.1756 -32.1756 -32.1756 -32.1756 -13.2994 -13.2994 -13.2856 -13.2856 -11.9260 -11.9260 -11.9197 -11.9197 -11.8637 -11.8637 -11.8494 -11.8494 -3.2335 -3.2335 -3.2146 -3.2146 -1.6473 -1.6473 -1.6466 -1.6466 3.5497 3.5497 3.5647 3.5647 5.8281 5.8281 5.8305 5.8305 6.6138 6.6138 6.6189 6.6189 7.8303 7.8303 7.8316 7.8316 8.2417 8.2417 8.2650 8.2650 10.7635 10.7635 10.7652 10.7652 13.7914 13.7914 13.7982 13.7982 14.5976 14.5976 14.5997 14.5997 k = 0.3537 0.5000-0.0000 ( 3360 PWs) bands (ev): -32.1753 -32.1753 -32.1753 -32.1753 -13.3001 -13.3001 -13.2869 -13.2869 -11.9266 -11.9266 -11.9197 -11.9197 -11.8650 -11.8650 -11.8523 -11.8523 -3.2197 -3.2197 -3.2017 -3.2017 -1.6546 -1.6546 -1.6539 -1.6539 3.4935 3.4935 3.5077 3.5077 5.8723 5.8723 5.8749 5.8749 6.5942 6.5942 6.5989 6.5989 7.8323 7.8323 7.8340 7.8340 8.2065 8.2065 8.2294 8.2294 10.8647 10.8647 10.8663 10.8663 13.8379 13.8379 13.8466 13.8466 14.6264 14.6264 14.6281 14.6281 k = 0.3659 0.5000-0.0000 ( 3364 PWs) bands (ev): -32.1750 -32.1750 -32.1750 -32.1750 -13.3006 -13.3006 -13.2882 -13.2882 -11.9273 -11.9273 -11.9200 -11.9200 -11.8659 -11.8659 -11.8548 -11.8548 -3.2065 -3.2065 -3.1896 -3.1896 -1.6615 -1.6615 -1.6609 -1.6609 3.4415 3.4415 3.4548 3.4548 5.9140 5.9140 5.9168 5.9168 6.5777 6.5777 6.5821 6.5821 7.8341 7.8341 7.8364 7.8364 8.1712 8.1712 8.1936 8.1936 10.9596 10.9596 10.9612 10.9612 13.8877 13.8877 13.8981 13.8981 14.6512 14.6512 14.6567 14.6567 k = 0.3780 0.5000-0.0000 ( 3360 PWs) bands (ev): -32.1747 -32.1747 -32.1747 -32.1747 -13.3010 -13.3010 -13.2896 -13.2896 -11.9281 -11.9281 -11.9206 -11.9206 -11.8666 -11.8666 -11.8570 -11.8570 -3.1939 -3.1939 -3.1782 -3.1782 -1.6681 -1.6681 -1.6676 -1.6676 3.3938 3.3938 3.4061 3.4061 5.9529 5.9529 5.9558 5.9558 6.5646 6.5646 6.5686 6.5686 7.8358 7.8358 7.8387 7.8387 8.1363 8.1363 8.1581 8.1581 11.0478 11.0478 11.0493 11.0493 13.9404 13.9404 13.9526 13.9526 14.6737 14.6737 14.6831 14.6831 k = 0.3902 0.5000-0.0000 ( 3360 PWs) bands (ev): -32.1745 -32.1745 -32.1745 -32.1745 -13.3014 -13.3014 -13.2908 -13.2908 -11.9288 -11.9288 -11.9213 -11.9213 -11.8670 -11.8670 -11.8588 -11.8588 -3.1821 -3.1821 -3.1676 -3.1676 -1.6742 -1.6742 -1.6738 -1.6738 3.3505 3.3505 3.3618 3.3618 5.9882 5.9882 5.9912 5.9912 6.5549 6.5549 6.5585 6.5585 7.8372 7.8372 7.8409 7.8409 8.1022 8.1022 8.1234 8.1234 11.1289 11.1289 11.1303 11.1303 13.9961 13.9961 14.0099 14.0099 14.6933 14.6933 14.7068 14.7068 k = 0.4024 0.5000-0.0000 ( 3368 PWs) bands (ev): -32.1743 -32.1743 -32.1743 -32.1743 -13.3016 -13.3016 -13.2921 -13.2921 -11.9296 -11.9296 -11.9223 -11.9223 -11.8673 -11.8673 -11.8604 -11.8604 -3.1712 -3.1712 -3.1580 -3.1580 -1.6799 -1.6799 -1.6795 -1.6795 3.3116 3.3116 3.3219 3.3219 6.0196 6.0196 6.0225 6.0225 6.5486 6.5486 6.5519 6.5519 7.8386 7.8386 7.8430 7.8430 8.0694 8.0694 8.0899 8.0899 11.2026 11.2026 11.2039 11.2039 14.0543 14.0543 14.0698 14.0698 14.7092 14.7092 14.7269 14.7269 k = 0.4146 0.5000-0.0000 ( 3368 PWs) bands (ev): -32.1741 -32.1741 -32.1741 -32.1741 -13.3018 -13.3018 -13.2933 -13.2933 -11.9302 -11.9302 -11.9233 -11.9233 -11.8673 -11.8673 -11.8616 -11.8616 -3.1612 -3.1612 -3.1495 -3.1495 -1.6851 -1.6851 -1.6847 -1.6847 3.2773 3.2773 3.2865 3.2865 6.0468 6.0468 6.0496 6.0496 6.5456 6.5456 6.5485 6.5485 7.8397 7.8397 7.8450 7.8450 8.0386 8.0386 8.0582 8.0582 11.2684 11.2684 11.2697 11.2697 14.1148 14.1148 14.1319 14.1319 14.7201 14.7201 14.7423 14.7423 k = 0.4268 0.5000-0.0000 ( 3370 PWs) bands (ev): -32.1739 -32.1739 -32.1739 -32.1739 -13.3018 -13.3018 -13.2945 -13.2945 -11.9308 -11.9308 -11.9245 -11.9245 -11.8673 -11.8673 -11.8626 -11.8626 -3.1523 -3.1523 -3.1420 -3.1420 -1.6896 -1.6896 -1.6894 -1.6894 3.2476 3.2476 3.2555 3.2555 6.0696 6.0696 6.0721 6.0721 6.5455 6.5455 6.5480 6.5480 7.8408 7.8408 7.8468 7.8468 8.0102 8.0102 8.0288 8.0288 11.3262 11.3262 11.3274 11.3274 14.1771 14.1771 14.1957 14.1957 14.7248 14.7248 14.7511 14.7511 k = 0.4390 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1737 -32.1737 -32.1737 -32.1737 -13.3018 -13.3018 -13.2956 -13.2956 -11.9311 -11.9311 -11.9256 -11.9256 -11.8672 -11.8672 -11.8635 -11.8635 -3.1444 -3.1444 -3.1358 -3.1358 -1.6936 -1.6936 -1.6934 -1.6934 3.2225 3.2225 3.2291 3.2291 6.0879 6.0879 6.0902 6.0902 6.5476 6.5476 6.5498 6.5498 7.8419 7.8419 7.8484 7.8484 7.9850 7.9850 8.0023 8.0023 11.3757 11.3757 11.3766 11.3766 14.2406 14.2406 14.2607 14.2607 14.7214 14.7214 14.7510 14.7510 k = 0.4512 0.5000-0.0000 ( 3358 PWs) bands (ev): -32.1736 -32.1736 -32.1736 -32.1736 -13.3016 -13.3016 -13.2966 -13.2966 -11.9314 -11.9314 -11.9268 -11.9268 -11.8670 -11.8670 -11.8641 -11.8641 -3.1377 -3.1377 -3.1307 -3.1307 -1.6969 -1.6969 -1.6967 -1.6967 3.2020 3.2020 3.2074 3.2074 6.1022 6.1022 6.1041 6.1041 6.5512 6.5512 6.5530 6.5530 7.8429 7.8429 7.8497 7.8497 7.9636 7.9636 7.9792 7.9792 11.4165 11.4165 11.4172 11.4172 14.3046 14.3046 14.3262 14.3262 14.7085 14.7085 14.7397 14.7397 k = 0.4634 0.5000-0.0000 ( 3348 PWs) bands (ev): -32.1735 -32.1735 -32.1735 -32.1735 -13.3013 -13.3013 -13.2975 -13.2975 -11.9314 -11.9314 -11.9279 -11.9279 -11.8667 -11.8667 -11.8647 -11.8647 -3.1322 -3.1322 -3.1269 -3.1269 -1.6995 -1.6995 -1.6994 -1.6994 3.1862 3.1862 3.1902 3.1902 6.1128 6.1128 6.1142 6.1142 6.5554 6.5554 6.5568 6.5568 7.8441 7.8441 7.8505 7.8505 7.9468 7.9468 7.9599 7.9599 11.4484 11.4484 11.4490 11.4490 14.3683 14.3683 14.3911 14.3911 14.6853 14.6853 14.7165 14.7165 k = 0.4756 0.5000-0.0000 ( 3340 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.3010 -13.3010 -13.2984 -13.2984 -11.9313 -11.9313 -11.9288 -11.9288 -11.8665 -11.8665 -11.8651 -11.8651 -3.1280 -3.1280 -3.1245 -3.1245 -1.7014 -1.7014 -1.7013 -1.7013 3.1751 3.1751 3.1778 3.1778 6.1200 6.1200 6.1210 6.1210 6.5592 6.5592 6.5602 6.5602 7.8454 7.8454 7.8506 7.8506 7.9351 7.9351 7.9449 7.9449 11.4714 11.4714 11.4718 11.4718 14.4301 14.4301 14.4538 14.4538 14.6528 14.6528 14.6824 14.6824 k = 0.4878 0.5000-0.0000 ( 3344 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.3005 -13.3005 -13.2992 -13.2992 -11.9309 -11.9309 -11.9297 -11.9297 -11.8662 -11.8662 -11.8655 -11.8655 -3.1251 -3.1251 -3.1233 -3.1233 -1.7025 -1.7025 -1.7024 -1.7024 3.1687 3.1687 3.1700 3.1700 6.1243 6.1243 6.1248 6.1248 6.5619 6.5619 6.5624 6.5624 7.8470 7.8470 7.8500 7.8500 7.9292 7.9292 7.9344 7.9344 11.4853 11.4853 11.4855 11.4855 14.4877 14.4877 14.5099 14.5099 14.6151 14.6151 14.6404 14.6404 k = 0.5000 0.5000-0.0000 ( 3340 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9304 -11.9304 -11.9304 -11.9304 -11.8659 -11.8659 -11.8659 -11.8659 -3.1235 -3.1235 -3.1235 -3.1235 -1.7028 -1.7028 -1.7028 -1.7028 3.1670 3.1670 3.1670 3.1670 6.1258 6.1258 6.1258 6.1258 6.5630 6.5630 6.5630 6.5630 7.8486 7.8486 7.8486 7.8486 7.9291 7.9291 7.9291 7.9291 11.4900 11.4900 11.4900 11.4900 14.5301 14.5301 14.5301 14.5301 14.6021 14.6021 14.6021 14.6021 k = 0.5000 0.5000-0.0000 ( 3340 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9304 -11.9304 -11.9304 -11.9304 -11.8659 -11.8659 -11.8659 -11.8659 -3.1235 -3.1235 -3.1235 -3.1235 -1.7028 -1.7028 -1.7028 -1.7028 3.1670 3.1670 3.1670 3.1670 6.1258 6.1258 6.1258 6.1258 6.5630 6.5630 6.5630 6.5630 7.8486 7.8486 7.8486 7.8486 7.9291 7.9291 7.9291 7.9291 11.4900 11.4900 11.4900 11.4900 14.5301 14.5301 14.5301 14.5301 14.6021 14.6021 14.6021 14.6021 k = 0.4914 0.4914-0.0000 ( 3348 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.3005 -13.3005 -13.2992 -13.2992 -11.9309 -11.9309 -11.9297 -11.9297 -11.8662 -11.8662 -11.8655 -11.8655 -3.1261 -3.1261 -3.1224 -3.1224 -1.7026 -1.7026 -1.7024 -1.7024 3.1673 3.1673 3.1714 3.1714 6.1229 6.1229 6.1261 6.1261 6.5607 6.5607 6.5636 6.5636 7.8468 7.8468 7.8502 7.8502 7.9292 7.9292 7.9345 7.9345 11.4815 11.4815 11.4893 11.4893 14.4754 14.4754 14.5327 14.5327 14.5956 14.5956 14.6494 14.6494 k = 0.4828 0.4828-0.0000 ( 3346 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.3010 -13.3010 -13.2984 -13.2984 -11.9313 -11.9313 -11.9288 -11.9288 -11.8665 -11.8665 -11.8652 -11.8652 -3.1330 -3.1330 -3.1194 -3.1194 -1.7017 -1.7017 -1.7009 -1.7009 3.1685 3.1685 3.1843 3.1843 6.1144 6.1144 6.1268 6.1268 6.5539 6.5539 6.5652 6.5652 7.8441 7.8441 7.8521 7.8521 7.9349 7.9349 7.9450 7.9450 11.4562 11.4562 11.4872 11.4872 14.3945 14.3945 14.5254 14.5254 14.5941 14.5941 14.7045 14.7045 k = 0.4741 0.4741-0.0000 ( 3354 PWs) bands (ev): -32.1735 -32.1735 -32.1735 -32.1735 -13.3014 -13.3014 -13.2975 -13.2975 -11.9315 -11.9315 -11.9277 -11.9277 -11.8667 -11.8667 -11.8647 -11.8647 -3.1444 -3.1444 -3.1146 -3.1146 -1.7003 -1.7003 -1.6986 -1.6986 3.1706 3.1706 3.2057 3.2057 6.1004 6.1004 6.1281 6.1281 6.5428 6.5428 6.5679 6.5679 7.8405 7.8405 7.8549 7.8549 7.9458 7.9458 7.9602 7.9602 11.4144 11.4144 11.4837 11.4837 14.3089 14.3089 14.5132 14.5132 14.5916 14.5916 14.7453 14.7453 k = 0.4655 0.4655-0.0000 ( 3360 PWs) bands (ev): -32.1736 -32.1736 -32.1736 -32.1736 -13.3016 -13.3016 -13.2965 -13.2965 -11.9315 -11.9315 -11.9265 -11.9265 -11.8670 -11.8670 -11.8643 -11.8643 -3.1602 -3.1602 -3.1079 -3.1079 -1.6985 -1.6985 -1.6953 -1.6953 3.1735 3.1735 3.2355 3.2355 6.0810 6.0810 6.1298 6.1298 6.5282 6.5282 6.5717 6.5717 7.8360 7.8360 7.8586 7.8586 7.9611 7.9611 7.9799 7.9799 11.3569 11.3569 11.4789 11.4789 14.2232 14.2232 14.4965 14.4965 14.5871 14.5871 14.7682 14.7682 k = 0.4569 0.4569-0.0000 ( 3372 PWs) bands (ev): -32.1738 -32.1738 -32.1737 -32.1737 -13.3018 -13.3018 -13.2955 -13.2955 -11.9314 -11.9314 -11.9250 -11.9250 -11.8671 -11.8671 -11.8638 -11.8638 -3.1803 -3.1803 -3.0992 -3.0992 -1.6962 -1.6962 -1.6912 -1.6912 3.1773 3.1773 3.2736 3.2736 6.0566 6.0566 6.1320 6.1320 6.5106 6.5106 6.5766 6.5766 7.8310 7.8310 7.8633 7.8633 7.9799 7.9799 8.0039 8.0039 11.2846 11.2846 11.4727 11.4727 14.1398 14.1398 14.4760 14.4760 14.5796 14.5796 14.7755 14.7755 k = 0.4483 0.4483-0.0000 ( 3362 PWs) bands (ev): -32.1739 -32.1739 -32.1738 -32.1738 -13.3019 -13.3019 -13.2943 -13.2943 -11.9312 -11.9312 -11.9234 -11.9234 -11.8673 -11.8673 -11.8632 -11.8632 -3.2044 -3.2044 -3.0887 -3.0887 -1.6935 -1.6935 -1.6862 -1.6862 3.1820 3.1820 3.3197 3.3197 6.0275 6.0275 6.1348 6.1348 6.4909 6.4909 6.5826 6.5826 7.8256 7.8256 7.8690 7.8690 8.0010 8.0010 8.0320 8.0320 11.1985 11.1985 11.4651 11.4651 14.0606 14.0606 14.4521 14.4521 14.5679 14.5679 14.7717 14.7717 k = 0.4397 0.4397-0.0000 ( 3362 PWs) bands (ev): -32.1741 -32.1741 -32.1740 -32.1740 -13.3019 -13.3019 -13.2930 -13.2930 -11.9308 -11.9308 -11.9216 -11.9216 -11.8674 -11.8674 -11.8626 -11.8626 -3.2323 -3.2323 -3.0762 -3.0762 -1.6906 -1.6906 -1.6806 -1.6806 3.1877 3.1877 3.3737 3.3737 5.9942 5.9942 6.1380 6.1380 6.4698 6.4698 6.5897 6.5897 7.8200 7.8200 7.8757 7.8757 8.0234 8.0234 8.0641 8.0641 11.0996 11.0996 11.4561 11.4561 13.9869 13.9869 14.4251 14.4251 14.5511 14.5511 14.7603 14.7603 k = 0.4310 0.4310-0.0000 ( 3354 PWs) bands (ev): -32.1743 -32.1743 -32.1742 -32.1742 -13.3018 -13.3018 -13.2916 -13.2916 -11.9304 -11.9304 -11.9195 -11.9195 -11.8674 -11.8674 -11.8619 -11.8619 -3.2638 -3.2638 -3.0618 -3.0618 -1.6876 -1.6876 -1.6742 -1.6742 3.1943 3.1943 3.4353 3.4353 5.9570 5.9570 6.1416 6.1416 6.4482 6.4482 6.5979 6.5979 7.8145 7.8145 7.8834 7.8834 8.0459 8.0459 8.0999 8.0999 10.9893 10.9893 11.4459 11.4459 13.9198 13.9198 14.3957 14.3957 14.5281 14.5281 14.7432 14.7432 k = 0.4224 0.4224-0.0000 ( 3354 PWs) bands (ev): -32.1746 -32.1746 -32.1744 -32.1744 -13.3016 -13.3016 -13.2902 -13.2902 -11.9298 -11.9298 -11.9173 -11.9173 -11.8674 -11.8674 -11.8611 -11.8611 -3.2986 -3.2986 -3.0455 -3.0455 -1.6844 -1.6844 -1.6673 -1.6673 3.2019 3.2019 3.5042 3.5042 5.9163 5.9163 6.1458 6.1458 6.4267 6.4267 6.6072 6.6072 7.8092 7.8092 7.8921 7.8921 8.0677 8.0677 8.1392 8.1392 10.8686 10.8686 11.4343 11.4343 13.8603 13.8603 14.3641 14.3641 14.4982 14.4982 14.7213 14.7213 k = 0.4138 0.4138-0.0000 ( 3356 PWs) bands (ev): -32.1749 -32.1749 -32.1747 -32.1747 -13.3013 -13.3013 -13.2886 -13.2886 -11.9292 -11.9292 -11.9149 -11.9149 -11.8673 -11.8673 -11.8603 -11.8603 -3.3364 -3.3364 -3.0274 -3.0274 -1.6813 -1.6813 -1.6598 -1.6598 3.2105 3.2105 3.5802 3.5802 5.8727 5.8727 6.1504 6.1504 6.4061 6.4061 6.6176 6.6176 7.8043 7.8043 7.9020 7.9020 8.0879 8.0879 8.1815 8.1815 10.7389 10.7389 11.4214 11.4214 13.8092 13.8092 14.3305 14.3305 14.4611 14.4611 14.6950 14.6951 k = 0.4052 0.4052-0.0000 ( 3356 PWs) bands (ev): -32.1752 -32.1752 -32.1749 -32.1749 -13.3009 -13.3009 -13.2870 -13.2870 -11.9286 -11.9286 -11.9123 -11.9123 -11.8671 -11.8671 -11.8593 -11.8593 -3.3769 -3.3769 -3.0074 -3.0074 -1.6783 -1.6783 -1.6520 -1.6520 3.2202 3.2202 3.6628 3.6628 5.8266 5.8266 6.1555 6.1555 6.3870 6.3870 6.6292 6.6292 7.7999 7.7999 7.9129 7.9129 8.1058 8.1058 8.2266 8.2266 10.6011 10.6011 11.4073 11.4073 13.7671 13.7671 14.2953 14.2953 14.4165 14.4165 14.6642 14.6642 k = 0.3966 0.3966-0.0000 ( 3358 PWs) bands (ev): -32.1755 -32.1755 -32.1752 -32.1752 -13.3004 -13.3004 -13.2853 -13.2853 -11.9279 -11.9279 -11.9095 -11.9095 -11.8668 -11.8668 -11.8583 -11.8583 -3.4199 -3.4199 -2.9856 -2.9856 -1.6755 -1.6755 -1.6439 -1.6439 3.2311 3.2311 3.7519 3.7519 5.7784 5.7784 6.1610 6.1610 6.3701 6.3701 6.6418 6.6418 7.7963 7.7963 7.9249 7.9249 8.1206 8.1206 8.2742 8.2742 10.4563 10.4563 11.3919 11.3919 13.7347 13.7347 14.2584 14.2584 14.3647 14.3647 14.6280 14.6280 k = 0.3879 0.3879-0.0000 ( 3354 PWs) bands (ev): -32.1759 -32.1759 -32.1755 -32.1755 -13.2999 -13.2999 -13.2835 -13.2835 -11.9272 -11.9272 -11.9065 -11.9065 -11.8664 -11.8664 -11.8572 -11.8572 -3.4651 -3.4651 -2.9619 -2.9619 -1.6730 -1.6730 -1.6357 -1.6357 3.2432 3.2432 3.8471 3.8471 5.7286 5.7286 6.1670 6.1670 6.3558 6.3558 6.6556 6.6556 7.7935 7.7935 7.9380 7.9380 8.1319 8.1319 8.3241 8.3241 10.3056 10.3056 11.3753 11.3753 13.7121 13.7121 14.2200 14.2200 14.3058 14.3058 14.5849 14.5849 k = 0.3793 0.3793-0.0000 ( 3352 PWs) bands (ev): -32.1763 -32.1763 -32.1758 -32.1758 -13.2992 -13.2992 -13.2816 -13.2816 -11.9265 -11.9265 -11.9033 -11.9033 -11.8658 -11.8658 -11.8559 -11.8559 -3.5123 -3.5123 -2.9364 -2.9364 -1.6710 -1.6710 -1.6274 -1.6274 3.2565 3.2565 3.9479 3.9479 5.6776 5.6776 6.1735 6.1735 6.3447 6.3447 6.6704 6.6704 7.7916 7.7916 7.9522 7.9522 8.1392 8.1392 8.3759 8.3759 10.1498 10.1498 11.3576 11.3576 13.6996 13.6996 14.1799 14.1799 14.2407 14.2407 14.5329 14.5329 k = 0.3707 0.3707-0.0000 ( 3348 PWs) bands (ev): -32.1767 -32.1767 -32.1762 -32.1762 -13.2985 -13.2985 -13.2796 -13.2796 -11.9259 -11.9259 -11.8999 -11.8999 -11.8651 -11.8651 -11.8546 -11.8546 -3.5610 -3.5610 -2.9092 -2.9092 -1.6694 -1.6694 -1.6191 -1.6191 3.2710 3.2710 4.0542 4.0542 5.6258 5.6258 6.1804 6.1804 6.3372 6.3372 6.6862 6.6862 7.7908 7.7908 7.9676 7.9676 8.1421 8.1421 8.4294 8.4294 9.9897 9.9897 11.3388 11.3388 13.6972 13.6972 14.1372 14.1372 14.1704 14.1704 14.4726 14.4727 k = 0.3621 0.3621-0.0000 ( 3356 PWs) bands (ev): -32.1772 -32.1772 -32.1766 -32.1766 -13.2977 -13.2977 -13.2776 -13.2776 -11.9254 -11.9254 -11.8964 -11.8964 -11.8642 -11.8642 -11.8531 -11.8531 -3.6113 -3.6113 -2.8801 -2.8801 -1.6684 -1.6684 -1.6112 -1.6112 3.2869 3.2869 4.1654 4.1654 5.5737 5.5737 6.1878 6.1878 6.3338 6.3338 6.7031 6.7031 7.7911 7.7911 7.9841 7.9841 8.1406 8.1406 8.4844 8.4844 9.8263 9.8263 11.3189 11.3189 13.7047 13.7047 14.0834 14.0834 14.1040 14.1040 14.4069 14.4069 k = 0.3534 0.3534-0.0000 ( 3368 PWs) bands (ev): -32.1777 -32.1777 -32.1770 -32.1770 -13.2968 -13.2968 -13.2754 -13.2754 -11.9249 -11.9249 -11.8926 -11.8926 -11.8632 -11.8632 -11.8514 -11.8514 -3.6627 -3.6627 -2.8494 -2.8494 -1.6681 -1.6681 -1.6035 -1.6035 3.3042 3.3042 4.2813 4.2813 5.5216 5.5216 6.1956 6.1956 6.3347 6.3347 6.7210 6.7210 7.7926 7.7926 8.0017 8.0017 8.1345 8.1345 8.5406 8.5406 9.6601 9.6601 11.2980 11.2980 13.7213 13.7213 14.0058 14.0058 14.0547 14.0547 14.3387 14.3387 k = 0.3448 0.3448-0.0000 ( 3372 PWs) bands (ev): -32.1782 -32.1782 -32.1774 -32.1774 -13.2959 -13.2959 -13.2732 -13.2732 -11.9245 -11.9245 -11.8887 -11.8887 -11.8620 -11.8620 -11.8495 -11.8495 -3.7150 -3.7150 -2.8169 -2.8169 -1.6685 -1.6685 -1.5963 -1.5963 3.3229 3.3229 4.4015 4.4015 5.4699 5.4699 6.2039 6.2039 6.3405 6.3405 6.7399 6.7399 7.7952 7.7952 8.0205 8.0205 8.1239 8.1239 8.5979 8.5979 9.4918 9.4918 11.2762 11.2762 13.7460 13.7460 13.9203 13.9203 14.0072 14.0072 14.2703 14.2703 k = 0.3362 0.3362-0.0000 ( 3372 PWs) bands (ev): -32.1787 -32.1787 -32.1778 -32.1778 -13.2949 -13.2949 -13.2710 -13.2710 -11.9243 -11.9243 -11.8846 -11.8846 -11.8606 -11.8606 -11.8475 -11.8475 -3.7681 -3.7681 -2.7827 -2.7827 -1.6697 -1.6697 -1.5898 -1.5898 3.3430 3.3430 4.5255 4.5255 5.4190 5.4190 6.2126 6.2126 6.3514 6.3514 6.7596 6.7596 7.7989 7.7989 8.0404 8.0404 8.1090 8.1090 8.6560 8.6560 9.3221 9.3221 11.2535 11.2535 13.7753 13.7753 13.8320 13.8320 13.9583 13.9583 14.2045 14.2045 k = 0.3276 0.3276-0.0000 ( 3368 PWs) bands (ev): -32.1792 -32.1792 -32.1782 -32.1782 -13.2938 -13.2938 -13.2686 -13.2686 -11.9241 -11.9241 -11.8804 -11.8804 -11.8591 -11.8591 -11.8452 -11.8452 -3.8218 -3.8218 -2.7469 -2.7469 -1.6717 -1.6717 -1.5840 -1.5840 3.3646 3.3646 4.6529 4.6529 5.3693 5.3693 6.2217 6.2217 6.3678 6.3678 6.7801 6.7801 7.8037 7.8037 8.0613 8.0613 8.0900 8.0900 8.7148 8.7148 9.1516 9.1516 11.2300 11.2300 13.7354 13.7354 13.8104 13.8104 13.9083 13.9083 14.1458 14.1458 k = 0.3190 0.3190-0.0000 ( 3368 PWs) bands (ev): -32.1797 -32.1797 -32.1787 -32.1787 -13.2927 -13.2927 -13.2662 -13.2662 -11.9241 -11.9241 -11.8760 -11.8760 -11.8576 -11.8576 -11.8427 -11.8427 -3.8758 -3.8758 -2.7095 -2.7095 -1.6745 -1.6745 -1.5790 -1.5790 3.3876 3.3876 4.7833 4.7833 5.3210 5.3210 6.2312 6.2312 6.3901 6.3901 6.8012 6.8012 7.8096 7.8096 8.0671 8.0671 8.0834 8.0834 8.7740 8.7740 8.9808 8.9808 11.2058 11.2058 13.6411 13.6411 13.8230 13.8230 13.8650 13.8650 14.1038 14.1038 k = 0.3103 0.3103-0.0000 ( 3372 PWs) bands (ev): -32.1803 -32.1803 -32.1791 -32.1791 -13.2915 -13.2915 -13.2638 -13.2638 -11.9242 -11.9242 -11.8714 -11.8714 -11.8559 -11.8559 -11.8400 -11.8400 -3.9300 -3.9300 -2.6705 -2.6705 -1.6783 -1.6783 -1.5749 -1.5749 3.4122 3.4122 4.9161 4.9161 5.2744 5.2744 6.2411 6.2411 6.4185 6.4185 6.8228 6.8228 7.8165 7.8165 8.0412 8.0412 8.1063 8.1063 8.8102 8.8102 8.8336 8.8336 11.1808 11.1808 13.5445 13.5445 13.7837 13.7837 13.8451 13.8451 14.0955 14.0955 k = 0.3017 0.3017-0.0000 ( 3374 PWs) bands (ev): -32.1809 -32.1809 -32.1796 -32.1796 -13.2903 -13.2903 -13.2613 -13.2613 -11.9244 -11.9244 -11.8667 -11.8667 -11.8541 -11.8541 -11.8370 -11.8370 -3.9843 -3.9843 -2.6300 -2.6300 -1.6830 -1.6830 -1.5720 -1.5720 3.4383 3.4383 5.0508 5.0508 5.2300 5.2300 6.2515 6.2515 6.4533 6.4533 6.8447 6.8447 7.8242 7.8242 8.0123 8.0123 8.1302 8.1302 8.6409 8.6409 8.8931 8.8931 11.1553 11.1553 13.4468 13.4468 13.7250 13.7250 13.8090 13.8090 14.1224 14.1224 k = 0.2931 0.2931-0.0000 ( 3374 PWs) bands (ev): -32.1815 -32.1815 -32.1801 -32.1801 -13.2890 -13.2890 -13.2587 -13.2587 -11.9247 -11.9247 -11.8619 -11.8619 -11.8523 -11.8523 -11.8337 -11.8337 -4.0385 -4.0385 -2.5881 -2.5881 -1.6886 -1.6886 -1.5701 -1.5701 3.4658 3.4658 5.1816 5.1816 5.1930 5.1930 6.2622 6.2622 6.4947 6.4947 6.8664 6.8664 7.8328 7.8328 7.9812 7.9812 8.1548 8.1548 8.4733 8.4733 8.9526 8.9526 11.1292 11.1292 13.3486 13.3486 13.6607 13.6607 13.7554 13.7554 14.1168 14.1168 k = 0.2845 0.2845-0.0000 ( 3374 PWs) bands (ev): -32.1820 -32.1820 -32.1806 -32.1806 -13.2878 -13.2878 -13.2561 -13.2561 -11.9251 -11.9251 -11.8569 -11.8569 -11.8504 -11.8504 -11.8302 -11.8302 -4.0924 -4.0924 -2.5447 -2.5447 -1.6951 -1.6951 -1.5695 -1.5695 3.4948 3.4948 5.1475 5.1475 5.3240 5.3240 6.2735 6.2735 6.5432 6.5432 6.8874 6.8874 7.8420 7.8420 7.9485 7.9485 8.1799 8.1799 8.3087 8.3087 9.0118 9.0118 11.1026 11.1026 13.2506 13.2506 13.5921 13.5921 13.6944 13.6944 14.0706 14.0706 k = 0.2759 0.2759-0.0000 ( 3366 PWs) bands (ev): -32.1826 -32.1826 -32.1811 -32.1811 -13.2864 -13.2864 -13.2535 -13.2535 -11.9256 -11.9256 -11.8519 -11.8519 -11.8485 -11.8485 -11.8264 -11.8264 -4.1459 -4.1459 -2.5000 -2.5000 -1.7025 -1.7025 -1.5701 -1.5701 3.5252 3.5252 5.1104 5.1104 5.4607 5.4607 6.2851 6.2851 6.5987 6.5987 6.9067 6.9067 7.8515 7.8515 7.9150 7.9150 8.1449 8.1449 8.2088 8.2088 9.0705 9.0705 11.0756 11.0756 13.1533 13.1533 13.5195 13.5195 13.6308 13.6308 14.0211 14.0211 k = 0.2672 0.2672-0.0000 ( 3374 PWs) bands (ev): -32.1832 -32.1832 -32.1816 -32.1816 -13.2851 -13.2851 -13.2508 -13.2508 -11.9261 -11.9261 -11.8474 -11.8474 -11.8460 -11.8460 -11.8225 -11.8225 -4.1989 -4.1989 -2.4539 -2.4539 -1.7108 -1.7108 -1.5721 -1.5721 3.5569 3.5569 5.0761 5.0761 5.5966 5.5966 6.2973 6.2973 6.6616 6.6616 6.9230 6.9230 7.8593 7.8593 7.8827 7.8827 7.9915 7.9915 8.2343 8.2343 9.1286 9.1286 11.0483 11.0483 13.0574 13.0574 13.4428 13.4428 13.5665 13.5665 13.9703 13.9703 k = 0.2586 0.2586-0.0000 ( 3370 PWs) bands (ev): -32.1838 -32.1838 -32.1821 -32.1821 -13.2838 -13.2838 -13.2481 -13.2481 -11.9267 -11.9267 -11.8450 -11.8450 -11.8412 -11.8412 -11.8183 -11.8183 -4.2512 -4.2512 -2.4067 -2.4067 -1.7200 -1.7200 -1.5754 -1.5754 3.5899 3.5899 5.0447 5.0447 5.7308 5.7308 6.3099 6.3099 6.7317 6.7317 6.9337 6.9337 7.8312 7.8312 7.8524 7.8524 7.8805 7.8805 8.2615 8.2615 9.1858 9.1858 11.0207 11.0207 12.9632 12.9632 13.3620 13.3620 13.5029 13.5029 13.9167 13.9167 k = 0.2500 0.2500-0.0000 ( 3366 PWs) bands (ev): -32.1844 -32.1844 -32.1826 -32.1826 -13.2824 -13.2824 -13.2454 -13.2454 -11.9274 -11.9274 -11.8430 -11.8430 -11.8359 -11.8359 -11.8139 -11.8139 -4.3029 -4.3029 -2.3583 -2.3583 -1.7300 -1.7300 -1.5800 -1.5800 3.6241 3.6241 5.0164 5.0164 5.8627 5.8627 6.3230 6.3230 6.8085 6.8085 6.9347 6.9347 7.7055 7.7055 7.8164 7.8164 7.8877 7.8877 8.2891 8.2891 9.2420 9.2420 10.9930 10.9930 12.8712 12.8712 13.2774 13.2774 13.4406 13.4406 13.8518 13.8518 k = 0.2414 0.2414-0.0000 ( 3368 PWs) bands (ev): -32.1850 -32.1850 -32.1831 -32.1831 -13.2811 -13.2811 -13.2427 -13.2427 -11.9280 -11.9280 -11.8410 -11.8410 -11.8306 -11.8306 -11.8093 -11.8093 -4.3536 -4.3536 -2.3089 -2.3089 -1.7407 -1.7407 -1.5860 -1.5860 3.6595 3.6595 4.9912 4.9912 5.9913 5.9913 6.3365 6.3365 6.8906 6.8906 6.9201 6.9201 7.5909 7.5909 7.7890 7.7890 7.8987 7.8987 8.3170 8.3170 9.2969 9.2969 10.9650 10.9650 12.7821 12.7821 13.1891 13.1891 13.3798 13.3798 13.7752 13.7752 k = 0.2328 0.2328-0.0000 ( 3374 PWs) bands (ev): -32.1856 -32.1856 -32.1836 -32.1836 -13.2797 -13.2797 -13.2400 -13.2400 -11.9287 -11.9287 -11.8391 -11.8391 -11.8252 -11.8252 -11.8046 -11.8046 -4.4035 -4.4035 -2.2585 -2.2585 -1.7521 -1.7521 -1.5933 -1.5933 3.6957 3.6957 4.9691 4.9691 6.1160 6.1160 6.3505 6.3505 6.8790 6.8790 6.9786 6.9786 7.5037 7.5037 7.7682 7.7682 7.9103 7.9103 8.3450 8.3450 9.3503 9.3503 10.9370 10.9370 12.6961 12.6961 13.0975 13.0975 13.3209 13.3209 13.6973 13.6973 k = 0.2241 0.2241-0.0000 ( 3382 PWs) bands (ev): -32.1862 -32.1862 -32.1841 -32.1841 -13.2784 -13.2784 -13.2372 -13.2372 -11.9293 -11.9293 -11.8371 -11.8371 -11.8197 -11.8197 -11.7998 -11.7998 -4.4524 -4.4524 -2.2072 -2.2072 -1.7641 -1.7641 -1.6019 -1.6019 3.7329 3.7329 4.9502 4.9502 6.2364 6.2364 6.3649 6.3649 6.8095 6.8095 7.0655 7.0655 7.4499 7.4499 7.7576 7.7576 7.9221 7.9221 8.3729 8.3729 9.4019 9.4019 10.9090 10.9090 12.6138 12.6138 13.0028 13.0028 13.2641 13.2641 13.6215 13.6215 k = 0.2155 0.2155-0.0000 ( 3382 PWs) bands (ev): -32.1868 -32.1868 -32.1846 -32.1846 -13.2770 -13.2770 -13.2345 -13.2345 -11.9300 -11.9300 -11.8352 -11.8352 -11.8142 -11.8142 -11.7949 -11.7949 -4.5001 -4.5001 -2.1552 -2.1552 -1.7767 -1.7767 -1.6117 -1.6117 3.7708 3.7708 4.9344 4.9344 6.3518 6.3518 6.3797 6.3797 6.7130 6.7130 7.1474 7.1474 7.4269 7.4269 7.7632 7.7632 7.9340 7.9340 8.4006 8.4006 9.4515 9.4515 10.8810 10.8810 12.5356 12.5356 12.9056 12.9056 13.2095 13.2095 13.5489 13.5489 k = 0.2069 0.2069-0.0000 ( 3376 PWs) bands (ev): -32.1874 -32.1874 -32.1851 -32.1851 -13.2757 -13.2757 -13.2318 -13.2318 -11.9307 -11.9307 -11.8333 -11.8333 -11.8088 -11.8088 -11.7899 -11.7899 -4.5466 -4.5466 -2.1026 -2.1026 -1.7897 -1.7897 -1.6225 -1.6225 3.8092 3.8092 4.9216 4.9216 6.3942 6.3942 6.4620 6.4620 6.5983 6.5983 7.2170 7.2170 7.4266 7.4266 7.7922 7.7922 7.9461 7.9461 8.4279 8.4279 9.4989 9.4989 10.8532 10.8532 12.4618 12.4618 12.8063 12.8063 13.1573 13.1573 13.4800 13.4800 k = 0.1983 0.1983-0.0000 ( 3374 PWs) bands (ev): -32.1880 -32.1880 -32.1856 -32.1856 -13.2745 -13.2745 -13.2291 -13.2291 -11.9313 -11.9313 -11.8314 -11.8314 -11.8034 -11.8034 -11.7848 -11.7848 -4.5919 -4.5919 -2.0495 -2.0495 -1.8031 -1.8031 -1.6345 -1.6345 3.8481 3.8481 4.9116 4.9116 6.4062 6.4062 6.4758 6.4758 6.5661 6.5661 7.2688 7.2688 7.4411 7.4411 7.8503 7.8503 7.9585 7.9585 8.4547 8.4547 9.5438 9.5438 10.8255 10.8255 12.3927 12.3927 12.7053 12.7053 13.1075 13.1075 13.4155 13.4155 k = 0.1897 0.1897-0.0000 ( 3383 PWs) bands (ev): -32.1886 -32.1886 -32.1861 -32.1861 -13.2732 -13.2732 -13.2265 -13.2265 -11.9319 -11.9319 -11.8295 -11.8295 -11.7980 -11.7980 -11.7798 -11.7798 -4.6358 -4.6358 -1.9960 -1.9960 -1.8167 -1.8167 -1.6473 -1.6473 3.8873 3.8873 4.9045 4.9045 6.3350 6.3350 6.4319 6.4319 6.6623 6.6623 7.3040 7.3040 7.4649 7.4649 7.9344 7.9344 7.9743 7.9743 8.4807 8.4807 9.5860 9.5860 10.7981 10.7981 12.3287 12.3287 12.6031 12.6031 13.0602 13.0602 13.3557 13.3557 k = 0.1810 0.1810-0.0000 ( 3379 PWs) bands (ev): -32.1892 -32.1892 -32.1865 -32.1865 -13.2720 -13.2720 -13.2239 -13.2239 -11.9325 -11.9325 -11.8276 -11.8276 -11.7926 -11.7926 -11.7747 -11.7747 -4.6783 -4.6783 -1.9426 -1.9426 -1.8304 -1.8304 -1.6609 -1.6609 3.9266 3.9266 4.8999 4.8999 6.2044 6.2044 6.4460 6.4460 6.7487 6.7487 7.3302 7.3302 7.4947 7.4947 7.9772 7.9772 8.0553 8.0553 8.5058 8.5058 9.6251 9.6251 10.7710 10.7710 12.2700 12.2700 12.5002 12.5002 13.0156 13.0156 13.3009 13.3009 k = 0.1724 0.1724-0.0000 ( 3381 PWs) bands (ev): -32.1897 -32.1897 -32.1870 -32.1870 -13.2708 -13.2708 -13.2213 -13.2213 -11.9331 -11.9331 -11.8258 -11.8258 -11.7874 -11.7874 -11.7696 -11.7696 -4.7193 -4.7193 -1.8898 -1.8898 -1.8435 -1.8435 -1.6752 -1.6752 3.9659 3.9659 4.8976 4.8976 6.0723 6.0723 6.4622 6.4622 6.8215 6.8215 7.3576 7.3576 7.5286 7.5286 7.9904 7.9904 8.1826 8.1826 8.5299 8.5299 9.6610 9.6610 10.7443 10.7443 12.2166 12.2166 12.3971 12.3971 12.9737 12.9737 13.2515 13.2515 k = 0.1638 0.1638-0.0000 ( 3373 PWs) bands (ev): -32.1902 -32.1902 -32.1874 -32.1874 -13.2697 -13.2697 -13.2188 -13.2188 -11.9336 -11.9336 -11.8240 -11.8240 -11.7822 -11.7822 -11.7646 -11.7646 -4.7588 -4.7588 -1.8618 -1.8618 -1.8320 -1.8320 -1.6900 -1.6900 4.0051 4.0051 4.8974 4.8974 5.9416 5.9416 6.4790 6.4790 6.8768 6.8768 7.3949 7.3949 7.5654 7.5654 8.0023 8.0023 8.3221 8.3221 8.5529 8.5529 9.6936 9.6936 10.7180 10.7180 12.1688 12.1688 12.2942 12.2942 12.9346 12.9346 13.2079 13.2079 k = 0.1552 0.1552-0.0000 ( 3377 PWs) bands (ev): -32.1908 -32.1908 -32.1878 -32.1878 -13.2686 -13.2686 -13.2164 -13.2164 -11.9341 -11.9341 -11.8223 -11.8223 -11.7772 -11.7772 -11.7597 -11.7597 -4.7966 -4.7966 -1.8739 -1.8739 -1.7808 -1.7808 -1.7050 -1.7050 4.0439 4.0439 4.8990 4.8990 5.8134 5.8134 6.4960 6.4960 6.9124 6.9124 7.4474 7.4474 7.6045 7.6045 8.0140 8.0140 8.4685 8.4685 8.5750 8.5750 9.7226 9.7226 10.6924 10.6924 12.1262 12.1262 12.1921 12.1921 12.8986 12.8986 13.1702 13.1702 k = 0.1466 0.1466-0.0000 ( 3377 PWs) bands (ev): -32.1913 -32.1913 -32.1883 -32.1883 -13.2675 -13.2675 -13.2140 -13.2140 -11.9346 -11.9346 -11.8206 -11.8206 -11.7723 -11.7723 -11.7548 -11.7548 -4.8328 -4.8328 -1.8874 -1.8874 -1.7312 -1.7312 -1.7177 -1.7177 4.0824 4.0824 4.9020 4.9020 5.6887 5.6887 6.5131 6.5131 6.9300 6.9300 7.5155 7.5155 7.6451 7.6451 8.0256 8.0256 8.5899 8.5899 8.6251 8.6251 9.7480 9.7480 10.6674 10.6674 12.0855 12.0855 12.0946 12.0946 12.8655 12.8655 13.1387 13.1387 k = 0.1379 0.1379-0.0000 ( 3379 PWs) bands (ev): -32.1917 -32.1917 -32.1887 -32.1887 -13.2665 -13.2665 -13.2118 -13.2118 -11.9350 -11.9350 -11.8189 -11.8189 -11.7676 -11.7676 -11.7501 -11.7501 -4.8673 -4.8673 -1.9008 -1.9008 -1.7372 -1.7372 -1.6755 -1.6755 4.1203 4.1203 4.9062 4.9062 5.5679 5.5679 6.5302 6.5302 6.9338 6.9338 7.5959 7.5959 7.6869 7.6869 8.0372 8.0372 8.6115 8.6115 8.7756 8.7756 9.7698 9.7698 10.6432 10.6432 11.9909 11.9909 12.0575 12.0575 12.8357 12.8357 13.1136 13.1136 k = 0.1293 0.1293-0.0000 ( 3375 PWs) bands (ev): -32.1922 -32.1922 -32.1890 -32.1890 -13.2656 -13.2656 -13.2096 -13.2096 -11.9354 -11.9354 -11.8174 -11.8174 -11.7630 -11.7630 -11.7455 -11.7455 -4.8999 -4.8999 -1.9139 -1.9139 -1.7524 -1.7524 -1.6249 -1.6249 4.1575 4.1575 4.9111 4.9111 5.4516 5.4516 6.5472 6.5472 6.9284 6.9284 7.6842 7.6842 7.7299 7.7299 8.0489 8.0489 8.6285 8.6285 8.9296 8.9296 9.7882 9.7882 10.6199 10.6199 11.8936 11.8936 12.0297 12.0297 12.8092 12.8092 13.0951 13.0951 k = 0.1207 0.1207-0.0000 ( 3379 PWs) bands (ev): -32.1926 -32.1926 -32.1894 -32.1894 -13.2647 -13.2647 -13.2075 -13.2075 -11.9357 -11.9357 -11.8159 -11.8159 -11.7587 -11.7587 -11.7411 -11.7411 -4.9307 -4.9307 -1.9266 -1.9266 -1.7677 -1.7677 -1.5754 -1.5754 4.1940 4.1940 4.9165 4.9165 5.3403 5.3403 6.5641 6.5641 6.9173 6.9173 7.7657 7.7657 7.7851 7.7851 8.0608 8.0608 8.6437 8.6437 9.0828 9.0828 9.8032 9.8032 10.5975 10.5975 11.7988 11.7988 12.0061 12.0061 12.7862 12.7862 13.0831 13.0831 k = 0.1121 0.1121-0.0000 ( 3379 PWs) bands (ev): -32.1930 -32.1930 -32.1897 -32.1897 -13.2638 -13.2638 -13.2055 -13.2055 -11.9360 -11.9360 -11.8144 -11.8144 -11.7545 -11.7545 -11.7369 -11.7369 -4.9597 -4.9597 -1.9388 -1.9388 -1.7827 -1.7827 -1.5274 -1.5274 4.2295 4.2295 4.9220 4.9220 5.2344 5.2344 6.5806 6.5806 6.9029 6.9029 7.8118 7.8118 7.8778 7.8778 8.0728 8.0728 8.6572 8.6572 9.2338 9.2338 9.8153 9.8153 10.5763 10.5763 11.7070 11.7070 11.9860 11.9860 12.7667 12.7667 13.0779 13.0779 k = 0.1034 0.1034-0.0000 ( 3381 PWs) bands (ev): -32.1934 -32.1934 -32.1901 -32.1901 -13.2630 -13.2630 -13.2037 -13.2037 -11.9363 -11.9363 -11.8131 -11.8131 -11.7506 -11.7506 -11.7329 -11.7329 -4.9866 -4.9866 -1.9504 -1.9504 -1.7972 -1.7972 -1.4812 -1.4812 4.2640 4.2640 4.9274 4.9274 5.1343 5.1343 6.5966 6.5966 6.8870 6.8870 7.8540 7.8540 7.9746 7.9746 8.0850 8.0850 8.6690 8.6690 9.3810 9.3810 9.8248 9.8248 10.5562 10.5562 11.6188 11.6188 11.9687 11.9687 12.7509 12.7509 13.0792 13.0792 k = 0.0948 0.0948-0.0000 ( 3377 PWs) bands (ev): -32.1938 -32.1938 -32.1904 -32.1904 -13.2623 -13.2623 -13.2019 -13.2019 -11.9366 -11.9366 -11.8118 -11.8118 -11.7469 -11.7469 -11.7291 -11.7291 -5.0116 -5.0116 -1.9614 -1.9614 -1.8111 -1.8111 -1.4371 -1.4371 4.2973 4.2973 4.9322 4.9322 5.0404 5.0404 6.6121 6.6121 6.8704 6.8704 7.8947 7.8947 8.0706 8.0706 8.0974 8.0974 8.6791 8.6791 9.5228 9.5228 9.8325 9.8325 10.5375 10.5375 11.5345 11.5345 11.9536 11.9536 12.7389 12.7389 13.0872 13.0872 k = 0.0862 0.0862-0.0000 ( 3383 PWs) bands (ev): -32.1941 -32.1941 -32.1907 -32.1907 -13.2617 -13.2617 -13.2003 -13.2003 -11.9368 -11.9368 -11.8106 -11.8106 -11.7435 -11.7435 -11.7256 -11.7256 -5.0346 -5.0346 -1.9716 -1.9716 -1.8243 -1.8243 -1.3954 -1.3954 4.3292 4.3292 4.9353 4.9353 4.9542 4.9542 6.6269 6.6269 6.8541 6.8541 7.9338 7.9338 8.1099 8.1099 8.1644 8.1644 8.6878 8.6878 9.6565 9.6565 9.8401 9.8401 10.5203 10.5203 11.4549 11.4549 11.9401 11.9401 12.7307 12.7307 13.1016 13.1016 k = 0.0776 0.0776-0.0000 ( 3381 PWs) bands (ev): -32.1944 -32.1944 -32.1909 -32.1909 -13.2611 -13.2611 -13.1989 -13.1989 -11.9369 -11.9369 -11.8095 -11.8095 -11.7403 -11.7403 -11.7223 -11.7223 -5.0556 -5.0556 -1.9811 -1.9811 -1.8366 -1.8366 -1.3564 -1.3564 4.3596 4.3596 4.8721 4.8721 4.9405 4.9405 6.6408 6.6408 6.8384 6.8384 7.9708 7.9708 8.1226 8.1226 8.2544 8.2544 8.6951 8.6951 9.7711 9.7711 9.8576 9.8576 10.5046 10.5046 11.3803 11.3803 11.9278 11.9278 12.7264 12.7264 13.1223 13.1223 k = 0.0690 0.0690-0.0000 ( 3381 PWs) bands (ev): -32.1946 -32.1946 -32.1912 -32.1912 -13.2605 -13.2605 -13.1975 -13.1975 -11.9371 -11.9371 -11.8085 -11.8085 -11.7375 -11.7375 -11.7193 -11.7193 -5.0744 -5.0744 -1.9897 -1.9897 -1.8480 -1.8480 -1.3205 -1.3205 4.3880 4.3880 4.7991 4.7991 4.9428 4.9428 6.6537 6.6537 6.8238 6.8238 8.0052 8.0052 8.1354 8.1354 8.3394 8.3394 8.7013 8.7013 9.8191 9.8191 9.9315 9.9315 10.4906 10.4906 11.3114 11.3114 11.9164 11.9164 12.7258 12.7258 13.1490 13.1490 k = 0.0603 0.0603-0.0000 ( 3385 PWs) bands (ev): -32.1949 -32.1949 -32.1914 -32.1914 -13.2601 -13.2601 -13.1963 -13.1963 -11.9372 -11.9372 -11.8077 -11.8077 -11.7350 -11.7350 -11.7167 -11.7167 -5.0910 -5.0910 -1.9974 -1.9974 -1.8582 -1.8582 -1.2880 -1.2880 4.4144 4.4144 4.7338 4.7338 4.9444 4.9444 6.6656 6.6656 6.8105 6.8105 8.0362 8.0362 8.1483 8.1483 8.4180 8.4180 8.7066 8.7066 9.8268 9.8268 10.0343 10.0343 10.4786 10.4786 11.2488 11.2488 11.9056 11.9056 12.7286 12.7286 13.1813 13.1813 k = 0.0517 0.0517-0.0000 ( 3389 PWs) bands (ev): -32.1951 -32.1951 -32.1916 -32.1916 -13.2596 -13.2596 -13.1953 -13.1953 -11.9374 -11.9374 -11.8069 -11.8069 -11.7327 -11.7327 -11.7143 -11.7143 -5.1056 -5.1056 -2.0042 -2.0042 -1.8673 -1.8673 -1.2591 -1.2591 4.4383 4.4383 4.6764 4.6764 4.9451 4.9451 6.6761 6.6761 6.7987 6.7987 8.0632 8.0632 8.1613 8.1613 8.4888 8.4888 8.7115 8.7115 9.8282 9.8282 10.1308 10.1308 10.4687 10.4687 11.1930 11.1930 11.8956 11.8956 12.7343 12.7343 13.2017 13.2017 k = 0.0431 0.0431-0.0000 ( 3399 PWs) bands (ev): -32.1953 -32.1953 -32.1917 -32.1917 -13.2593 -13.2593 -13.1944 -13.1944 -11.9374 -11.9374 -11.8062 -11.8062 -11.7308 -11.7308 -11.7123 -11.7123 -5.1179 -5.1179 -2.0100 -2.0100 -1.8751 -1.8751 -1.2342 -1.2342 4.4594 4.4594 4.6273 4.6273 4.9451 4.9451 6.6853 6.6853 6.7884 6.7884 8.0859 8.0859 8.1740 8.1740 8.5501 8.5501 8.7163 8.7163 9.8280 9.8280 10.2149 10.2149 10.4613 10.4613 11.1446 11.1446 11.8864 11.8864 12.7421 12.7421 13.2092 13.2092 k = 0.0345 0.0345-0.0000 ( 3399 PWs) bands (ev): -32.1955 -32.1955 -32.1919 -32.1919 -13.2590 -13.2590 -13.1937 -13.1937 -11.9375 -11.9375 -11.8057 -11.8057 -11.7293 -11.7293 -11.7107 -11.7107 -5.1280 -5.1280 -2.0148 -2.0148 -1.8816 -1.8816 -1.2134 -1.2134 4.4772 4.4772 4.5870 4.5870 4.9447 4.9447 6.6929 6.6929 6.7800 6.7800 8.1039 8.1039 8.1861 8.1861 8.6002 8.6002 8.7220 8.7220 9.8271 9.8271 10.2840 10.2840 10.4574 10.4574 11.1041 11.1041 11.8783 11.8783 12.7511 12.7511 13.2239 13.2239 k = 0.0259 0.0259-0.0000 ( 3399 PWs) bands (ev): -32.1956 -32.1956 -32.1920 -32.1920 -13.2588 -13.2588 -13.1931 -13.1931 -11.9376 -11.9376 -11.8053 -11.8053 -11.7280 -11.7280 -11.7094 -11.7094 -5.1359 -5.1359 -2.0185 -2.0185 -1.8867 -1.8867 -1.1969 -1.1969 4.4910 4.4910 4.5560 4.5560 4.9439 4.9439 6.6990 6.6990 6.7733 6.7733 8.1174 8.1174 8.1968 8.1968 8.6372 8.6372 8.7295 8.7295 9.8261 9.8261 10.3352 10.3352 10.4582 10.4582 11.0721 11.0721 11.8715 11.8715 12.7599 12.7599 13.2468 13.2468 k = 0.0172 0.0172-0.0000 ( 3403 PWs) bands (ev): -32.1957 -32.1957 -32.1920 -32.1920 -13.2586 -13.2586 -13.1927 -13.1927 -11.9376 -11.9376 -11.8050 -11.8050 -11.7271 -11.7271 -11.7084 -11.7084 -5.1416 -5.1416 -2.0212 -2.0212 -1.8904 -1.8904 -1.1851 -1.1851 4.4998 4.4998 4.5350 4.5350 4.9431 4.9431 6.7034 6.7034 6.7685 6.7685 8.1267 8.1267 8.2052 8.2052 8.6603 8.6603 8.7387 8.7387 9.8252 9.8252 10.3669 10.3669 10.4644 10.4644 11.0489 11.0489 11.8664 11.8664 12.7674 12.7674 13.2782 13.2782 k = 0.0086 0.0086-0.0000 ( 3403 PWs) bands (ev): -32.1957 -32.1957 -32.1921 -32.1921 -13.2585 -13.2585 -13.1924 -13.1924 -11.9376 -11.9376 -11.8048 -11.8048 -11.7266 -11.7266 -11.7079 -11.7079 -5.1449 -5.1449 -2.0229 -2.0229 -1.8927 -1.8927 -1.1779 -1.1779 4.5021 4.5021 4.5255 4.5255 4.9425 4.9425 6.7061 6.7061 6.7656 6.7656 8.1321 8.1321 8.2106 8.2106 8.6719 8.6719 8.7469 8.7469 9.8246 9.8246 10.3819 10.3819 10.4725 10.4725 11.0348 11.0348 11.8633 11.8633 12.7723 12.7723 13.3157 13.3157 k = 0.0000 0.0000 0.0000 ( 3413 PWs) bands (ev): -32.1958 -32.1958 -32.1921 -32.1921 -13.2585 -13.2585 -13.1923 -13.1923 -11.9376 -11.9376 -11.8047 -11.8047 -11.7264 -11.7264 -11.7077 -11.7077 -5.1461 -5.1461 -2.0234 -2.0234 -1.8934 -1.8934 -1.1755 -1.1755 4.5015 4.5015 4.5238 4.5238 4.9423 4.9423 6.7070 6.7070 6.7646 6.7646 8.1338 8.1338 8.2124 8.2124 8.6752 8.6752 8.7501 8.7501 9.8244 9.8244 10.3859 10.3859 10.4762 10.4762 11.0301 11.0301 11.8622 11.8622 12.7741 12.7741 13.3413 13.3452 k = 0.0000 0.0000 0.0000 ( 3413 PWs) bands (ev): -32.1958 -32.1958 -32.1921 -32.1921 -13.2585 -13.2585 -13.1923 -13.1923 -11.9376 -11.9376 -11.8047 -11.8047 -11.7264 -11.7264 -11.7077 -11.7077 -5.1461 -5.1461 -2.0234 -2.0234 -1.8934 -1.8934 -1.1755 -1.1755 4.5015 4.5015 4.5238 4.5238 4.9423 4.9423 6.7070 6.7070 6.7646 6.7646 8.1338 8.1338 8.2124 8.2124 8.6752 8.6752 8.7501 8.7501 9.8244 9.8244 10.3859 10.3859 10.4762 10.4762 11.0301 11.0301 11.8622 11.8622 12.7741 12.7741 13.3454 13.3487 k = 0.0000 0.0000 0.0117 ( 3393 PWs) bands (ev): -32.1957 -32.1957 -32.1921 -32.1921 -13.2585 -13.2585 -13.1924 -13.1924 -11.9376 -11.9376 -11.8048 -11.8048 -11.7264 -11.7264 -11.7077 -11.7077 -5.1458 -5.1458 -2.0300 -2.0300 -1.8869 -1.8869 -1.1755 -1.1755 4.5015 4.5015 4.5238 4.5238 4.9402 4.9402 6.7068 6.7068 6.7692 6.7692 8.1330 8.1330 8.2116 8.2116 8.6763 8.6763 8.7513 8.7513 9.8199 9.8199 10.3858 10.3858 10.4761 10.4761 11.0315 11.0315 11.8648 11.8648 12.7744 12.7744 13.3417 13.3482 k = 0.0000 0.0000 0.0234 ( 3393 PWs) bands (ev): -32.1957 -32.1957 -32.1921 -32.1921 -13.2584 -13.2584 -13.1925 -13.1925 -11.9374 -11.9374 -11.8050 -11.8050 -11.7264 -11.7264 -11.7077 -11.7077 -5.1452 -5.1452 -2.0469 -2.0469 -1.8705 -1.8705 -1.1755 -1.1755 4.5015 4.5015 4.5238 4.5238 4.9340 4.9340 6.7065 6.7065 6.7829 6.7829 8.1307 8.1307 8.2091 8.2091 8.6796 8.6796 8.7548 8.7548 9.8065 9.8065 10.3855 10.3855 10.4760 10.4760 11.0356 11.0356 11.8728 11.8728 12.7753 12.7753 13.3426 13.3467 k = 0.0000 0.0000 0.0351 ( 3397 PWs) bands (ev): -32.1957 -32.1957 -32.1921 -32.1921 -13.2582 -13.2582 -13.1927 -13.1927 -11.9371 -11.9371 -11.8054 -11.8054 -11.7263 -11.7263 -11.7078 -11.7078 -5.1441 -5.1441 -2.0692 -2.0692 -1.8488 -1.8488 -1.1755 -1.1755 4.5015 4.5015 4.5238 4.5238 4.9239 4.9239 6.7059 6.7059 6.8054 6.8054 8.1269 8.1269 8.2050 8.2050 8.6850 8.6850 8.7605 8.7605 9.7842 9.7842 10.3851 10.3851 10.4759 10.4759 11.0423 11.0423 11.8861 11.8861 12.7769 12.7769 13.3443 13.3443 k = 0.0000 0.0000 0.0469 ( 3398 PWs) bands (ev): -32.1957 -32.1957 -32.1921 -32.1921 -13.2579 -13.2579 -13.1929 -13.1929 -11.9366 -11.9366 -11.8060 -11.8060 -11.7262 -11.7262 -11.7079 -11.7079 -5.1426 -5.1426 -2.0941 -2.0941 -1.8249 -1.8249 -1.1755 -1.1755 4.5016 4.5016 4.5239 4.5239 4.9103 4.9103 6.7051 6.7051 6.8362 6.8362 8.1218 8.1218 8.1995 8.1995 8.6922 8.6922 8.7682 8.7682 9.7534 9.7534 10.3845 10.3845 10.4756 10.4756 11.0516 11.0516 11.9048 11.9048 12.7791 12.7791 13.3409 13.3409 k = 0.0000 0.0000 0.0586 ( 3398 PWs) bands (ev): -32.1957 -32.1957 -32.1921 -32.1921 -13.2576 -13.2576 -13.1933 -13.1933 -11.9361 -11.9361 -11.8066 -11.8066 -11.7261 -11.7261 -11.7080 -11.7080 -5.1408 -5.1408 -2.1201 -2.1201 -1.8001 -1.8001 -1.1755 -1.1755 4.5017 4.5017 4.5239 4.5239 4.8939 4.8939 6.7040 6.7040 6.8749 6.8749 8.1157 8.1157 8.1929 8.1929 8.7011 8.7011 8.7777 8.7777 9.7144 9.7144 10.3838 10.3838 10.4753 10.4753 11.0633 11.0633 11.9289 11.9289 12.7818 12.7818 13.3367 13.3367 k = 0.0000 0.0000 0.0703 ( 3398 PWs) bands (ev): -32.1957 -32.1957 -32.1922 -32.1922 -13.2572 -13.2572 -13.1937 -13.1937 -11.9354 -11.9354 -11.8074 -11.8074 -11.7260 -11.7260 -11.7081 -11.7081 -5.1386 -5.1386 -2.1463 -2.1463 -1.7754 -1.7754 -1.1755 -1.1755 4.5018 4.5018 4.5240 4.5240 4.8750 4.8750 6.7028 6.7028 6.9208 6.9208 8.1087 8.1087 8.1853 8.1853 8.7113 8.7113 8.7885 8.7885 9.6677 9.6677 10.3830 10.3830 10.4749 10.4749 11.0773 11.0773 11.9584 11.9584 12.7851 12.7851 13.3317 13.3317 k = 0.0000 0.0000 0.0820 ( 3398 PWs) bands (ev): -32.1956 -32.1956 -32.1922 -32.1922 -13.2567 -13.2567 -13.1941 -13.1941 -11.9346 -11.9346 -11.8083 -11.8083 -11.7258 -11.7258 -11.7083 -11.7083 -5.1361 -5.1361 -2.1722 -2.1722 -1.7511 -1.7511 -1.1755 -1.1755 4.5019 4.5019 4.5240 4.5240 4.8544 4.8544 6.7015 6.7015 6.9733 6.9733 8.1010 8.1010 8.1771 8.1771 8.7226 8.7226 8.8005 8.8005 9.6138 9.6138 10.3822 10.3822 10.4744 10.4744 11.0933 11.0933 11.9933 11.9933 12.7888 12.7888 13.3259 13.3259 k = 0.0000 0.0000 0.0937 ( 3394 PWs) bands (ev): -32.1956 -32.1956 -32.1922 -32.1922 -13.2562 -13.2562 -13.1946 -13.1946 -11.9338 -11.9338 -11.8093 -11.8093 -11.7257 -11.7257 -11.7085 -11.7085 -5.1334 -5.1334 -2.1974 -2.1974 -1.7275 -1.7275 -1.1755 -1.1755 4.5020 4.5020 4.5241 4.5241 4.8327 4.8327 6.7000 6.7000 7.0315 7.0315 8.0929 8.0929 8.1685 8.1685 8.7346 8.7346 8.8132 8.8132 9.5534 9.5534 10.3813 10.3813 10.4739 10.4739 11.1111 11.1111 12.0334 12.0334 12.7930 12.7930 13.3195 13.3195 k = 0.0000 0.0000 0.1054 ( 3402 PWs) bands (ev): -32.1956 -32.1956 -32.1923 -32.1923 -13.2556 -13.2556 -13.1951 -13.1951 -11.9329 -11.9329 -11.8104 -11.8104 -11.7255 -11.7255 -11.7086 -11.7086 -5.1305 -5.1305 -2.2218 -2.2218 -1.7050 -1.7050 -1.1754 -1.1754 4.5021 4.5021 4.5242 4.5242 4.8103 4.8103 6.6984 6.6984 7.0948 7.0948 8.0847 8.0847 8.1596 8.1596 8.7471 8.7471 8.8265 8.8265 9.4873 9.4873 10.3804 10.3804 10.4733 10.4733 11.1303 11.1303 12.0787 12.0787 12.7976 12.7976 13.3126 13.3126 k = 0.0000 0.0000 0.1171 ( 3402 PWs) bands (ev): -32.1955 -32.1955 -32.1923 -32.1923 -13.2551 -13.2551 -13.1957 -13.1957 -11.9319 -11.9319 -11.8115 -11.8115 -11.7253 -11.7253 -11.7088 -11.7088 -5.1275 -5.1275 -2.2450 -2.2450 -1.6838 -1.6838 -1.1754 -1.1754 4.5022 4.5022 4.5243 4.5243 4.7879 4.7879 6.6968 6.6968 7.1625 7.1625 8.0764 8.0764 8.1508 8.1508 8.7597 8.7597 8.8399 8.8399 9.4162 9.4162 10.3794 10.3794 10.4726 10.4726 11.1507 11.1507 12.1287 12.1287 12.8023 12.8023 13.3052 13.3052 k = 0.0000 0.0000 0.1288 ( 3410 PWs) bands (ev): -32.1955 -32.1955 -32.1924 -32.1924 -13.2545 -13.2545 -13.1962 -13.1962 -11.9310 -11.9310 -11.8127 -11.8127 -11.7251 -11.7251 -11.7090 -11.7090 -5.1245 -5.1245 -2.2669 -2.2669 -1.6639 -1.6639 -1.1754 -1.1754 4.5023 4.5023 4.5243 4.5243 4.7659 4.7659 6.6952 6.6952 7.2338 7.2338 8.0683 8.0683 8.1422 8.1422 8.7721 8.7721 8.8532 8.8532 9.3410 9.3410 10.3785 10.3785 10.4718 10.4718 11.1719 11.1719 12.1833 12.1833 12.8073 12.8073 13.2975 13.2975 k = 0.0000 0.0000 0.1406 ( 3410 PWs) bands (ev): -32.1954 -32.1954 -32.1924 -32.1924 -13.2539 -13.2539 -13.1968 -13.1968 -11.9300 -11.9300 -11.8139 -11.8139 -11.7249 -11.7249 -11.7092 -11.7092 -5.1215 -5.1215 -2.2872 -2.2872 -1.6455 -1.6455 -1.1754 -1.1754 4.5025 4.5025 4.5244 4.5244 4.7449 4.7449 6.6936 6.6936 7.3080 7.3080 8.0606 8.0606 8.1339 8.1339 8.7840 8.7840 8.8661 8.8661 9.2627 9.2627 10.3775 10.3775 10.4711 10.4711 11.1934 11.1934 12.2419 12.2419 12.8124 12.8124 13.2897 13.2897 k = 0.0000 0.0000 0.1523 ( 3402 PWs) bands (ev): -32.1954 -32.1954 -32.1925 -32.1925 -13.2533 -13.2533 -13.1974 -13.1974 -11.9290 -11.9290 -11.8150 -11.8150 -11.7247 -11.7247 -11.7094 -11.7094 -5.1185 -5.1185 -2.3059 -2.3059 -1.6287 -1.6287 -1.1754 -1.1754 4.5026 4.5026 4.5245 4.5245 4.7250 4.7250 6.6921 6.6921 7.3840 7.3840 8.0534 8.0534 8.1262 8.1262 8.7952 8.7952 8.8784 8.8784 9.1825 9.1825 10.3766 10.3766 10.4703 10.4703 11.2147 11.2147 12.3041 12.3041 12.8174 12.8174 13.2741 13.2741 k = 0.0000 0.0000 0.1640 ( 3402 PWs) bands (ev): -32.1953 -32.1953 -32.1925 -32.1925 -13.2527 -13.2527 -13.1979 -13.1979 -11.9281 -11.9281 -11.8161 -11.8161 -11.7245 -11.7245 -11.7096 -11.7096 -5.1158 -5.1158 -2.3227 -2.3227 -1.6137 -1.6137 -1.1753 -1.1753 4.5027 4.5027 4.5246 4.5246 4.7068 4.7068 6.6906 6.6906 7.4611 7.4611 8.0467 8.0467 8.1191 8.1191 8.8051 8.8051 8.8898 8.8898 9.1018 9.1018 10.3757 10.3757 10.4695 10.4695 11.2354 11.2354 12.3691 12.3691 12.8222 12.8222 13.2534 13.2534 k = 0.0000 0.0000 0.1757 ( 3398 PWs) bands (ev): -32.1953 -32.1953 -32.1925 -32.1925 -13.2522 -13.2522 -13.1984 -13.1984 -11.9272 -11.9272 -11.8171 -11.8171 -11.7243 -11.7243 -11.7098 -11.7098 -5.1132 -5.1132 -2.3376 -2.3376 -1.6004 -1.6004 -1.1753 -1.1753 4.5028 4.5028 4.5246 4.5246 4.6904 4.6904 6.6893 6.6893 7.5377 7.5377 8.0409 8.0409 8.1127 8.1127 8.8131 8.8131 8.9002 8.9002 9.0225 9.0225 10.3748 10.3748 10.4688 10.4688 11.2548 11.2548 12.4362 12.4362 12.8268 12.8268 13.2265 13.2265 k = 0.0000 0.0000 0.1874 ( 3390 PWs) bands (ev): -32.1953 -32.1953 -32.1925 -32.1925 -13.2517 -13.2517 -13.1989 -13.1989 -11.9264 -11.9264 -11.8180 -11.8180 -11.7242 -11.7242 -11.7100 -11.7100 -5.1109 -5.1109 -2.3504 -2.3504 -1.5891 -1.5891 -1.1753 -1.1753 4.5029 4.5029 4.5247 4.5247 4.6762 4.6762 6.6881 6.6881 7.6123 7.6123 8.0358 8.0358 8.1072 8.1072 8.8175 8.8175 8.9093 8.9093 8.9480 8.9480 10.3741 10.3741 10.4681 10.4681 11.2724 11.2724 12.5043 12.5043 12.8309 12.8309 13.1931 13.1931 k = 0.0000 0.0000 0.1991 ( 3394 PWs) bands (ev): -32.1953 -32.1953 -32.1925 -32.1925 -13.2513 -13.2513 -13.1993 -13.1993 -11.9257 -11.9257 -11.8188 -11.8188 -11.7240 -11.7240 -11.7101 -11.7101 -5.1090 -5.1090 -2.3610 -2.3610 -1.5798 -1.5798 -1.1753 -1.1753 4.5030 4.5030 4.5247 4.5247 4.6643 4.6643 6.6871 6.6871 7.6825 7.6825 8.0317 8.0317 8.1026 8.1026 8.8108 8.8108 8.8880 8.8880 8.9169 8.9169 10.3734 10.3734 10.4674 10.4674 11.2878 11.2878 12.5720 12.5720 12.8346 12.8346 13.1545 13.1545 k = 0.0000 0.0000 0.2108 ( 3402 PWs) bands (ev): -32.1953 -32.1953 -32.1926 -32.1926 -13.2510 -13.2510 -13.1996 -13.1996 -11.9252 -11.9252 -11.8195 -11.8195 -11.7239 -11.7239 -11.7102 -11.7102 -5.1075 -5.1075 -2.3693 -2.3693 -1.5724 -1.5724 -1.1753 -1.1753 4.5030 4.5030 4.5248 4.5248 4.6549 4.6549 6.6863 6.6863 7.7451 7.7451 8.0286 8.0286 8.0989 8.0989 8.7770 8.7770 8.8617 8.8617 8.9230 8.9230 10.3729 10.3729 10.4669 10.4669 11.3004 11.3004 12.6372 12.6372 12.8375 12.8375 13.1124 13.1124 k = 0.0000 0.0000 0.2226 ( 3402 PWs) bands (ev): -32.1952 -32.1952 -32.1926 -32.1926 -13.2507 -13.2507 -13.1999 -13.1999 -11.9248 -11.9248 -11.8200 -11.8200 -11.7238 -11.7238 -11.7103 -11.7103 -5.1063 -5.1063 -2.3753 -2.3753 -1.5672 -1.5672 -1.1753 -1.1753 4.5031 4.5031 4.5248 4.5248 4.6480 4.6480 6.6857 6.6857 7.7958 7.7958 8.0265 8.0265 8.0963 8.0963 8.7324 8.7324 8.8574 8.8574 8.9275 8.9275 10.3725 10.3725 10.4666 10.4666 11.3097 11.3097 12.6960 12.6960 12.8397 12.8397 13.0702 13.0702 k = 0.0000 0.0000 0.2343 ( 3394 PWs) bands (ev): -32.1952 -32.1952 -32.1926 -32.1926 -13.2506 -13.2506 -13.2000 -13.2000 -11.9245 -11.9245 -11.8202 -11.8202 -11.7238 -11.7238 -11.7104 -11.7104 -5.1056 -5.1056 -2.3790 -2.3790 -1.5640 -1.5640 -1.1753 -1.1753 4.5031 4.5031 4.5248 4.5248 4.6439 4.6439 6.6853 6.6853 7.8294 7.8294 8.0254 8.0254 8.0947 8.0947 8.6997 8.6997 8.8573 8.8573 8.9302 8.9302 10.3723 10.3723 10.4663 10.4663 11.3154 11.3154 12.7411 12.7411 12.8410 12.8410 13.0353 13.0353 k = 0.0000 0.0000 0.2460 ( 3406 PWs) bands (ev): -32.1952 -32.1952 -32.1926 -32.1926 -13.2505 -13.2505 -13.2001 -13.2001 -11.9244 -11.9244 -11.8203 -11.8203 -11.7237 -11.7237 -11.7104 -11.7104 -5.1054 -5.1054 -2.3802 -2.3802 -1.5629 -1.5629 -1.1753 -1.1753 4.5031 4.5031 4.5248 4.5248 4.6425 4.6425 6.6852 6.6852 7.8412 7.8412 8.0250 8.0250 8.0942 8.0942 8.6879 8.6879 8.8575 8.8575 8.9311 8.9311 10.3722 10.3722 10.4663 10.4663 11.3174 11.3174 12.7591 12.7591 12.8415 12.8415 13.0207 13.0207 k = 0.0000 0.0000 0.2460 ( 3406 PWs) bands (ev): -32.1952 -32.1952 -32.1926 -32.1926 -13.2505 -13.2505 -13.2001 -13.2001 -11.9244 -11.9244 -11.8203 -11.8203 -11.7237 -11.7237 -11.7104 -11.7104 -5.1054 -5.1054 -2.3802 -2.3802 -1.5629 -1.5629 -1.1753 -1.1753 4.5031 4.5031 4.5248 4.5248 4.6425 4.6425 6.6852 6.6852 7.8412 7.8412 8.0250 8.0250 8.0942 8.0942 8.6879 8.6879 8.8575 8.8575 8.9311 8.9311 10.3722 10.3722 10.4663 10.4663 11.3174 11.3174 12.7591 12.7591 12.8415 12.8415 13.0207 13.0207 k = 0.0000 0.0122 0.2460 ( 3398 PWs) bands (ev): -32.1952 -32.1952 -32.1926 -32.1926 -13.2505 -13.2505 -13.2001 -13.2001 -11.9244 -11.9244 -11.8204 -11.8204 -11.7239 -11.7239 -11.7106 -11.7106 -5.1043 -5.1043 -2.3792 -2.3792 -1.5626 -1.5626 -1.1777 -1.1777 4.5021 4.5021 4.5238 4.5238 4.6483 4.6483 6.6841 6.6841 7.8400 7.8400 8.0217 8.0217 8.0905 8.0905 8.6915 8.6915 8.8557 8.8557 8.9288 8.9288 10.3679 10.3679 10.4619 10.4619 11.3219 11.3219 12.7601 12.7601 12.8293 12.8293 13.0087 13.0087 k = 0.0000 0.0244 0.2460 ( 3398 PWs) bands (ev): -32.1952 -32.1952 -32.1925 -32.1925 -13.2507 -13.2507 -13.2004 -13.2004 -11.9244 -11.9244 -11.8205 -11.8205 -11.7244 -11.7244 -11.7111 -11.7111 -5.1010 -5.1010 -2.3764 -2.3764 -1.5616 -1.5616 -1.1849 -1.1849 4.4981 4.4981 4.5232 4.5232 4.6642 4.6642 6.6807 6.6807 7.8362 7.8362 8.0112 8.0112 8.0805 8.0805 8.7016 8.7016 8.8505 8.8505 8.9222 8.9222 10.3552 10.3552 10.4489 10.4489 11.3356 11.3356 12.7618 12.7618 12.7992 12.7992 12.9686 12.9686 k = 0.0000 0.0366 0.2460 ( 3388 PWs) bands (ev): -32.1951 -32.1951 -32.1924 -32.1924 -13.2509 -13.2509 -13.2007 -13.2007 -11.9245 -11.9245 -11.8208 -11.8208 -11.7253 -11.7253 -11.7120 -11.7120 -5.0956 -5.0956 -2.3718 -2.3718 -1.5600 -1.5600 -1.1968 -1.1968 4.4906 4.4906 4.5263 4.5263 4.6873 4.6873 6.6750 6.6750 7.8298 7.8298 7.9928 7.9928 8.0662 8.0662 8.7168 8.7168 8.8424 8.8424 8.9113 8.9113 10.3341 10.3341 10.4275 10.4275 11.3580 11.3580 12.7472 12.7472 12.7777 12.7777 12.9054 12.9054 k = 0.0000 0.0488 0.2460 ( 3396 PWs) bands (ev): -32.1949 -32.1949 -32.1924 -32.1924 -13.2512 -13.2512 -13.2012 -13.2012 -11.9246 -11.9246 -11.8212 -11.8212 -11.7265 -11.7265 -11.7132 -11.7132 -5.0880 -5.0880 -2.3653 -2.3653 -1.5577 -1.5577 -1.2134 -1.2134 4.4820 4.4820 4.5329 4.5329 4.7155 4.7155 6.6669 6.6669 7.8206 7.8206 7.9662 7.9662 8.0496 8.0496 8.7346 8.7346 8.8327 8.8327 8.8967 8.8967 10.3050 10.3050 10.3981 10.3981 11.3888 11.3888 12.7055 12.7055 12.7804 12.7804 12.8347 12.8347 k = 0.0000 0.0610 0.2460 ( 3388 PWs) bands (ev): -32.1948 -32.1948 -32.1922 -32.1922 -13.2515 -13.2515 -13.2019 -13.2019 -11.9247 -11.9247 -11.8217 -11.8217 -11.7280 -11.7280 -11.7147 -11.7147 -5.0782 -5.0782 -2.3569 -2.3569 -1.5548 -1.5548 -1.2346 -1.2346 4.4741 4.4741 4.5422 4.5422 4.7475 4.7475 6.6561 6.6561 7.8084 7.8084 7.9326 7.9326 8.0315 8.0315 8.7506 8.7506 8.8244 8.8244 8.8790 8.8790 10.2681 10.2681 10.3614 10.3614 11.4273 11.4273 12.6613 12.6613 12.7497 12.7497 12.8014 12.8014 k = 0.0000 0.0732 0.2460 ( 3388 PWs) bands (ev): -32.1946 -32.1946 -32.1921 -32.1921 -13.2520 -13.2520 -13.2027 -13.2027 -11.9248 -11.9248 -11.8223 -11.8223 -11.7298 -11.7298 -11.7164 -11.7164 -5.0663 -5.0663 -2.3469 -2.3469 -1.5514 -1.5514 -1.2603 -1.2603 4.4679 4.4679 4.5539 4.5539 4.7825 4.7825 6.6425 6.6425 7.7931 7.7931 7.8938 7.8938 8.0118 8.0118 8.7571 8.7571 8.8242 8.8242 8.8589 8.8589 10.2239 10.2239 10.3179 10.3179 11.4728 11.4728 12.6183 12.6183 12.6803 12.6803 12.8122 12.8122 k = 0.0000 0.0854 0.2460 ( 3388 PWs) bands (ev): -32.1944 -32.1944 -32.1919 -32.1919 -13.2525 -13.2525 -13.2036 -13.2036 -11.9250 -11.9250 -11.8232 -11.8232 -11.7319 -11.7319 -11.7184 -11.7184 -5.0523 -5.0523 -2.3350 -2.3350 -1.5473 -1.5473 -1.2902 -1.2902 4.4637 4.4637 4.5679 4.5679 4.8201 4.8201 6.6259 6.6259 7.7745 7.7745 7.8515 7.8515 7.9901 7.9901 8.7490 8.7490 8.8351 8.8351 8.8387 8.8387 10.1730 10.1730 10.2685 10.2685 11.5248 11.5248 12.5754 12.5754 12.6152 12.6152 12.8280 12.8280 k = 0.0000 0.0976 0.2460 ( 3384 PWs) bands (ev): -32.1942 -32.1942 -32.1917 -32.1917 -13.2532 -13.2532 -13.2047 -13.2047 -11.9252 -11.9252 -11.8242 -11.8242 -11.7342 -11.7342 -11.7206 -11.7206 -5.0362 -5.0362 -2.3215 -2.3215 -1.5427 -1.5427 -1.3243 -1.3243 4.4618 4.4618 4.5842 4.5842 4.8599 4.8599 6.6061 6.6061 7.7523 7.7523 7.8073 7.8073 7.9662 7.9662 8.7313 8.7313 8.8156 8.8156 8.8552 8.8552 10.1157 10.1157 10.2141 10.2141 11.5824 11.5824 12.5262 12.5262 12.5647 12.5647 12.8466 12.8466 k = 0.0000 0.1098 0.2460 ( 3392 PWs) bands (ev): -32.1940 -32.1940 -32.1914 -32.1914 -13.2538 -13.2538 -13.2060 -13.2060 -11.9255 -11.9255 -11.8254 -11.8254 -11.7366 -11.7366 -11.7230 -11.7230 -5.0180 -5.0180 -2.3064 -2.3064 -1.5377 -1.5377 -1.3624 -1.3624 4.4624 4.4624 4.6027 4.6027 4.9016 4.9016 6.5828 6.5828 7.7266 7.7266 7.7622 7.7622 7.9399 7.9399 8.7080 8.7080 8.7953 8.7953 8.8746 8.8746 10.0529 10.0529 10.1555 10.1555 11.6450 11.6450 12.4711 12.4711 12.5300 12.5300 12.8674 12.8674 k = 0.0000 0.1220 0.2460 ( 3392 PWs) bands (ev): -32.1936 -32.1936 -32.1912 -32.1912 -13.2546 -13.2546 -13.2073 -13.2073 -11.9259 -11.9259 -11.8268 -11.8268 -11.7393 -11.7393 -11.7254 -11.7254 -4.9977 -4.9977 -2.2897 -2.2897 -1.5322 -1.5322 -1.4042 -1.4042 4.4654 4.4654 4.6233 4.6233 4.9449 4.9449 6.5559 6.5559 7.6973 7.6973 7.7173 7.7173 7.9113 7.9113 8.6806 8.6806 8.7779 8.7779 8.8924 8.8924 9.9849 9.9849 10.0939 10.0939 11.7118 11.7118 12.4182 12.4182 12.5034 12.5034 12.8902 12.8902 k = 0.0000 0.1341 0.2460 ( 3390 PWs) bands (ev): -32.1933 -32.1933 -32.1910 -32.1910 -13.2554 -13.2554 -13.2088 -13.2088 -11.9264 -11.9264 -11.8285 -11.8285 -11.7420 -11.7420 -11.7279 -11.7279 -4.9754 -4.9754 -2.2715 -2.2715 -1.5264 -1.5264 -1.4494 -1.4494 4.4709 4.4709 4.6461 4.6461 4.9896 4.9896 6.5252 6.5252 7.6646 7.6646 7.6732 7.6732 7.8803 7.8803 8.6496 8.6496 8.7640 8.7640 8.9073 8.9073 9.9126 9.9126 10.0304 10.0304 11.7823 11.7823 12.3710 12.3710 12.4825 12.4825 12.9148 12.9148 k = 0.0000 0.1463 0.2460 ( 3388 PWs) bands (ev): -32.1930 -32.1930 -32.1907 -32.1907 -13.2563 -13.2563 -13.2105 -13.2105 -11.9269 -11.9269 -11.8305 -11.8305 -11.7448 -11.7448 -11.7305 -11.7305 -4.9510 -4.9510 -2.2519 -2.2519 -1.5208 -1.5208 -1.4974 -1.4974 4.4787 4.4787 4.6711 4.6711 5.0355 5.0355 6.4908 6.4908 7.6283 7.6283 7.6308 7.6308 7.8471 7.8471 8.6157 8.6157 8.7541 8.7541 8.9179 8.9179 9.8365 9.8365 9.9661 9.9661 11.8559 11.8559 12.3304 12.3304 12.4664 12.4664 12.9410 12.9410 k = 0.0000 0.1585 0.2460 ( 3392 PWs) bands (ev): -32.1926 -32.1926 -32.1904 -32.1904 -13.2573 -13.2573 -13.2122 -13.2122 -11.9276 -11.9276 -11.8328 -11.8328 -11.7475 -11.7475 -11.7329 -11.7329 -4.9247 -4.9247 -2.2309 -2.2309 -1.5510 -1.5510 -1.5125 -1.5125 4.4889 4.4889 4.6981 4.6981 5.0823 5.0823 6.4526 6.4526 7.5880 7.5880 7.5912 7.5912 7.8116 7.8116 8.5796 8.5796 8.7483 8.7483 8.9232 8.9232 9.7573 9.7573 9.9026 9.9026 11.9319 11.9319 12.2972 12.2972 12.4548 12.4548 12.9686 12.9686 k = 0.0000 0.1707 0.2460 ( 3384 PWs) bands (ev): -32.1923 -32.1923 -32.1900 -32.1900 -13.2583 -13.2583 -13.2141 -13.2141 -11.9284 -11.9284 -11.8354 -11.8354 -11.7503 -11.7503 -11.7354 -11.7354 -4.8965 -4.8965 -2.2087 -2.2087 -1.6054 -1.6054 -1.5061 -1.5061 4.5013 4.5013 4.7273 4.7273 5.1300 5.1300 6.4108 6.4108 7.5478 7.5478 7.5511 7.5511 7.7740 7.7740 8.5419 8.5419 8.7462 8.7462 8.9219 8.9219 9.6756 9.6756 9.8414 9.8414 12.0100 12.0100 12.2717 12.2717 12.4477 12.4477 12.9974 12.9974 k = 0.0000 0.1829 0.2460 ( 3390 PWs) bands (ev): -32.1919 -32.1919 -32.1897 -32.1897 -13.2594 -13.2594 -13.2161 -13.2161 -11.9293 -11.9293 -11.8384 -11.8384 -11.7529 -11.7529 -11.7377 -11.7377 -4.8663 -4.8663 -2.1854 -2.1854 -1.6627 -1.6627 -1.4991 -1.4991 4.5159 4.5159 4.7586 4.7586 5.1781 5.1781 6.3657 6.3657 7.5068 7.5068 7.5119 7.5119 7.7344 7.7344 8.5031 8.5031 8.7477 8.7477 8.9127 8.9127 9.5919 9.5919 9.7842 9.7842 12.0896 12.0896 12.2543 12.2543 12.4448 12.4448 13.0270 13.0270 k = 0.0000 0.1951 0.2460 ( 3390 PWs) bands (ev): -32.1915 -32.1915 -32.1894 -32.1894 -13.2605 -13.2605 -13.2182 -13.2182 -11.9304 -11.9304 -11.8417 -11.8417 -11.7555 -11.7555 -11.7398 -11.7398 -4.8342 -4.8342 -2.1611 -2.1611 -1.7225 -1.7225 -1.4921 -1.4921 4.5324 4.5324 4.7919 4.7919 5.2267 5.2267 6.3175 6.3175 7.4639 7.4639 7.4751 7.4751 7.6929 7.6929 8.4637 8.4637 8.7524 8.7524 8.8945 8.8945 9.5068 9.5068 9.7328 9.7328 12.1699 12.1699 12.2455 12.2455 12.4461 12.4461 13.0572 13.0572 k = 0.0000 0.2073 0.2460 ( 3390 PWs) bands (ev): -32.1911 -32.1911 -32.1890 -32.1890 -13.2616 -13.2616 -13.2204 -13.2204 -11.9316 -11.9316 -11.8454 -11.8454 -11.7578 -11.7578 -11.7418 -11.7418 -4.8002 -4.8002 -2.1360 -2.1360 -1.7844 -1.7844 -1.4850 -1.4850 4.5508 4.5508 4.8273 4.8273 5.2754 5.2754 6.2667 6.2667 7.4202 7.4202 7.4402 7.4402 7.6496 7.6496 8.4241 8.4241 8.7599 8.7599 8.8665 8.8665 9.4207 9.4207 9.6884 9.6884 12.2365 12.2365 12.2597 12.2597 12.4514 12.4514 13.0877 13.0877 k = 0.0000 0.2195 0.2460 ( 3388 PWs) bands (ev): -32.1906 -32.1906 -32.1887 -32.1887 -13.2628 -13.2628 -13.2227 -13.2227 -11.9329 -11.9329 -11.8494 -11.8494 -11.7600 -11.7600 -11.7436 -11.7436 -4.7645 -4.7645 -2.1103 -2.1103 -1.8480 -1.8480 -1.4779 -1.4779 4.5710 4.5710 4.8648 4.8648 5.3243 5.3243 6.2136 6.2136 7.3767 7.3767 7.4065 7.4065 7.6045 7.6045 8.3847 8.3847 8.7684 8.7684 8.8297 8.8297 9.3342 9.3342 9.6519 9.6519 12.2483 12.2483 12.3374 12.3374 12.4608 12.4608 13.1179 13.1179 k = 0.0000 0.2317 0.2460 ( 3384 PWs) bands (ev): -32.1902 -32.1902 -32.1883 -32.1883 -13.2640 -13.2640 -13.2251 -13.2251 -11.9344 -11.9344 -11.8537 -11.8537 -11.7619 -11.7619 -11.7452 -11.7452 -4.7269 -4.7269 -2.0847 -2.0847 -1.9126 -1.9126 -1.4709 -1.4709 4.5926 4.5926 4.9042 4.9042 5.3730 5.3730 6.1587 6.1587 7.3339 7.3339 7.3738 7.3738 7.5577 7.5577 8.3456 8.3456 8.7617 8.7617 8.8006 8.8006 9.2478 9.2478 9.6234 9.6234 12.2637 12.2637 12.4198 12.4198 12.4743 12.4743 13.1476 13.1476 k = 0.0000 0.2439 0.2460 ( 3370 PWs) bands (ev): -32.1897 -32.1897 -32.1879 -32.1879 -13.2652 -13.2652 -13.2275 -13.2275 -11.9359 -11.9359 -11.8583 -11.8583 -11.7636 -11.7636 -11.7467 -11.7467 -4.6876 -4.6876 -2.0622 -2.0622 -1.9752 -1.9752 -1.4642 -1.4642 4.6157 4.6157 4.9456 4.9456 5.4215 5.4215 6.1026 6.1026 7.2924 7.2924 7.3418 7.3418 7.5093 7.5093 8.3073 8.3073 8.7113 8.7113 8.8081 8.8081 9.1619 9.1619 9.6024 9.6024 12.2867 12.2867 12.4873 12.4873 12.5072 12.5072 13.1760 13.1760 k = 0.0000 0.2561 0.2460 ( 3374 PWs) bands (ev): -32.1893 -32.1893 -32.1876 -32.1876 -13.2664 -13.2664 -13.2300 -13.2300 -11.9375 -11.9375 -11.8632 -11.8632 -11.7651 -11.7651 -11.7480 -11.7480 -4.6465 -4.6465 -2.0707 -2.0707 -2.0075 -2.0075 -1.4577 -1.4577 4.6399 4.6399 4.9889 4.9889 5.4698 5.4698 6.0455 6.0455 7.2527 7.2527 7.3103 7.3103 7.4594 7.4594 8.2698 8.2698 8.6456 8.6456 8.8246 8.8246 9.0774 9.0774 9.5877 9.5877 12.3173 12.3173 12.5099 12.5099 12.5891 12.5891 13.2028 13.2028 k = 0.0000 0.2683 0.2460 ( 3372 PWs) bands (ev): -32.1889 -32.1889 -32.1872 -32.1872 -13.2676 -13.2676 -13.2326 -13.2326 -11.9392 -11.9392 -11.8682 -11.8682 -11.7663 -11.7663 -11.7491 -11.7491 -4.6038 -4.6038 -2.1306 -2.1306 -1.9893 -1.9893 -1.4516 -1.4516 4.6651 4.6651 5.0342 5.0342 5.5177 5.5177 5.9880 5.9880 7.2154 7.2154 7.2790 7.2790 7.4081 7.4081 8.2336 8.2336 8.5725 8.5725 8.8429 8.8429 8.9955 8.9955 9.5781 9.5781 12.3554 12.3554 12.5341 12.5341 12.6732 12.6732 13.2274 13.2274 k = 0.0000 0.2805 0.2460 ( 3360 PWs) bands (ev): -32.1884 -32.1884 -32.1868 -32.1868 -13.2688 -13.2688 -13.2352 -13.2352 -11.9410 -11.9410 -11.8733 -11.8733 -11.7673 -11.7673 -11.7501 -11.7501 -4.5594 -4.5594 -2.1999 -2.1999 -1.9624 -1.9624 -1.4460 -1.4460 4.6910 4.6910 5.0814 5.0814 5.5652 5.5652 5.9304 5.9304 7.1807 7.1807 7.2475 7.2475 7.3553 7.3553 8.1987 8.1987 8.4942 8.4942 8.8551 8.8551 8.9237 8.9237 9.5723 9.5723 12.4005 12.4005 12.5616 12.5616 12.7578 12.7578 13.2493 13.2493 k = 0.0000 0.2927 0.2460 ( 3364 PWs) bands (ev): -32.1880 -32.1880 -32.1865 -32.1865 -13.2700 -13.2700 -13.2378 -13.2378 -11.9428 -11.9428 -11.8786 -11.8786 -11.7681 -11.7681 -11.7509 -11.7509 -4.5133 -4.5133 -2.2715 -2.2715 -1.9340 -1.9340 -1.4409 -1.4409 4.7175 4.7175 5.1304 5.1304 5.6125 5.6125 5.8731 5.8731 7.1491 7.1491 7.2157 7.2157 7.3012 7.3012 8.1654 8.1654 8.4122 8.4122 8.8154 8.8154 8.9077 8.9077 9.5693 9.5693 12.4523 12.4523 12.5925 12.5925 12.8427 12.8427 13.2679 13.2679 k = 0.0000 0.3049 0.2460 ( 3356 PWs) bands (ev): -32.1875 -32.1875 -32.1861 -32.1861 -13.2711 -13.2711 -13.2405 -13.2405 -11.9445 -11.9445 -11.8839 -11.8839 -11.7686 -11.7686 -11.7517 -11.7517 -4.4657 -4.4657 -2.3443 -2.3443 -1.9050 -1.9050 -1.4365 -1.4365 4.7443 4.7443 5.1812 5.1812 5.6594 5.6594 5.8165 5.8165 7.1209 7.1209 7.1832 7.1832 7.2461 7.2461 8.1337 8.1337 8.3278 8.3278 8.7429 8.7429 8.9286 8.9286 9.5681 9.5681 12.5101 12.5101 12.6268 12.6268 12.9280 12.9280 13.2828 13.2828 k = 0.0000 0.3171 0.2460 ( 3358 PWs) bands (ev): -32.1871 -32.1871 -32.1858 -32.1858 -13.2721 -13.2721 -13.2432 -13.2432 -11.9462 -11.9462 -11.8892 -11.8892 -11.7689 -11.7689 -11.7523 -11.7523 -4.4165 -4.4165 -2.4179 -2.4179 -1.8759 -1.8759 -1.4328 -1.4328 4.7712 4.7712 5.2337 5.2337 5.7060 5.7060 5.7610 5.7610 7.0961 7.0961 7.1494 7.1494 7.1904 7.1904 8.1039 8.1039 8.2422 8.2422 8.6689 8.6689 8.9552 8.9552 9.5678 9.5678 12.5732 12.5732 12.6645 12.6645 13.0136 13.0136 13.2937 13.2937 k = 0.0000 0.3293 0.2460 ( 3348 PWs) bands (ev): -32.1867 -32.1867 -32.1854 -32.1854 -13.2731 -13.2731 -13.2458 -13.2458 -11.9479 -11.9479 -11.8945 -11.8945 -11.7690 -11.7690 -11.7529 -11.7529 -4.3658 -4.3658 -2.4920 -2.4920 -1.8468 -1.8468 -1.4299 -1.4299 4.7980 4.7980 5.2880 5.2880 5.7061 5.7061 5.7533 5.7533 7.0744 7.0744 7.1121 7.1121 7.1369 7.1369 8.0758 8.0758 8.1563 8.1563 8.5969 8.5969 8.9840 8.9840 9.5680 9.5680 12.6403 12.6403 12.7061 12.7061 13.0994 13.0994 13.3004 13.3004 k = 0.0000 0.3415 0.2460 ( 3356 PWs) bands (ev): -32.1864 -32.1864 -32.1851 -32.1851 -13.2740 -13.2740 -13.2484 -13.2484 -11.9494 -11.9494 -11.8998 -11.8998 -11.7690 -11.7690 -11.7534 -11.7534 -4.3135 -4.3135 -2.5665 -2.5665 -1.8179 -1.8179 -1.4279 -1.4279 4.8246 4.8246 5.3438 5.3438 5.6533 5.6533 5.8001 5.8001 7.0504 7.0504 7.0692 7.0692 7.0929 7.0929 8.0473 8.0473 8.0734 8.0734 8.5277 8.5277 9.0143 9.0143 9.5679 9.5679 12.7088 12.7088 12.7531 12.7531 13.1847 13.1847 13.3035 13.3035 k = 0.0000 0.3537 0.2460 ( 3362 PWs) bands (ev): -32.1860 -32.1860 -32.1849 -32.1849 -13.2748 -13.2748 -13.2510 -13.2510 -11.9508 -11.9508 -11.9049 -11.9049 -11.7688 -11.7688 -11.7539 -11.7539 -4.2599 -4.2599 -2.6412 -2.6412 -1.7894 -1.7894 -1.4269 -1.4269 4.8508 4.8508 5.4012 5.4012 5.6022 5.6022 5.8473 5.8473 6.9997 6.9997 7.0433 7.0433 7.0602 7.0602 7.9818 7.9818 8.0307 8.0307 8.4619 8.4619 9.0458 9.0458 9.5672 9.5672 12.7725 12.7725 12.8097 12.8097 13.2623 13.2623 13.3106 13.3106 k = 0.0000 0.3659 0.2460 ( 3362 PWs) bands (ev): -32.1856 -32.1856 -32.1846 -32.1846 -13.2755 -13.2755 -13.2535 -13.2535 -11.9520 -11.9520 -11.9099 -11.9099 -11.7684 -11.7684 -11.7544 -11.7544 -4.2048 -4.2048 -2.7160 -2.7160 -1.7614 -1.7614 -1.4269 -1.4269 4.8764 4.8764 5.4596 5.4596 5.5534 5.5534 5.8952 5.8952 6.9389 6.9389 7.0113 7.0113 7.0452 7.0452 7.8995 7.8995 8.0091 8.0091 8.3997 8.3997 9.0781 9.0781 9.5655 9.5655 12.8283 12.8283 12.8767 12.8767 13.2847 13.2847 13.3223 13.3223 k = 0.0000 0.3780 0.2460 ( 3358 PWs) bands (ev): -32.1853 -32.1853 -32.1844 -32.1844 -13.2761 -13.2761 -13.2560 -13.2560 -11.9531 -11.9531 -11.9147 -11.9147 -11.7680 -11.7680 -11.7549 -11.7549 -4.1482 -4.1482 -2.7908 -2.7908 -1.7339 -1.7339 -1.4281 -1.4281 4.9015 4.9015 5.4989 5.4989 5.5270 5.5270 5.9437 5.9437 6.8756 6.8756 6.9736 6.9736 7.0398 7.0398 7.8184 7.8184 7.9909 7.9909 8.3412 8.3412 9.1110 9.1110 9.5625 9.5625 12.8816 12.8816 12.9448 12.9448 13.2815 13.2815 13.3255 13.3255 k = 0.0000 0.3902 0.2460 ( 3354 PWs) bands (ev): -32.1850 -32.1850 -32.1841 -32.1841 -13.2766 -13.2766 -13.2583 -13.2583 -11.9539 -11.9539 -11.9193 -11.9193 -11.7674 -11.7674 -11.7554 -11.7554 -4.0904 -4.0904 -2.8654 -2.8654 -1.7072 -1.7072 -1.4305 -1.4305 4.9261 4.9261 5.4578 5.4578 5.5845 5.5845 5.9933 5.9933 6.8106 6.8106 6.9337 6.9337 7.0394 7.0394 7.7400 7.7400 7.9756 7.9756 8.2867 8.2867 9.1443 9.1443 9.5579 9.5579 12.9354 12.9354 13.0050 13.0050 13.2738 13.2738 13.3432 13.3432 k = 0.0000 0.4024 0.2460 ( 3356 PWs) bands (ev): -32.1847 -32.1847 -32.1839 -32.1839 -13.2769 -13.2769 -13.2606 -13.2606 -11.9545 -11.9545 -11.9237 -11.9237 -11.7668 -11.7668 -11.7559 -11.7559 -4.0312 -4.0312 -2.9397 -2.9397 -1.6812 -1.6812 -1.4341 -1.4341 4.9500 4.9500 5.4149 5.4149 5.6474 5.6474 6.0439 6.0439 6.7444 6.7444 6.8917 6.8917 7.0434 7.0434 7.6647 7.6647 7.9632 7.9632 8.2362 8.2362 9.1778 9.1778 9.5514 9.5514 12.9901 12.9901 13.0510 13.0510 13.2628 13.2628 13.3817 13.3817 k = 0.0000 0.4146 0.2460 ( 3364 PWs) bands (ev): -32.1845 -32.1845 -32.1838 -32.1838 -13.2771 -13.2771 -13.2628 -13.2628 -11.9548 -11.9548 -11.9278 -11.9278 -11.7661 -11.7661 -11.7564 -11.7564 -3.9707 -3.9707 -3.0137 -3.0137 -1.6562 -1.6562 -1.4391 -1.4391 4.9736 4.9736 5.3738 5.3738 5.7118 5.7118 6.0957 6.0957 6.6771 6.6771 6.8477 6.8477 7.0515 7.0515 7.5931 7.5931 7.9538 7.9538 8.1898 8.1898 9.2111 9.2111 9.5430 9.5430 13.0437 13.0437 13.0832 13.0832 13.2500 13.2500 13.4418 13.4418 k = 0.0000 0.4268 0.2460 ( 3364 PWs) bands (ev): -32.1842 -32.1842 -32.1836 -32.1836 -13.2772 -13.2772 -13.2648 -13.2648 -11.9549 -11.9549 -11.9317 -11.9317 -11.7654 -11.7654 -11.7569 -11.7569 -3.9090 -3.9090 -3.0872 -3.0872 -1.6322 -1.6322 -1.4454 -1.4454 4.9968 4.9968 5.3348 5.3348 5.7774 5.7774 6.1487 6.1487 6.6089 6.6089 6.8016 6.8016 7.0634 7.0634 7.5256 7.5256 7.9474 7.9474 8.1476 8.1476 9.2441 9.2441 9.5323 9.5323 13.0826 13.0826 13.1182 13.1182 13.2374 13.2374 13.5182 13.5182 k = 0.0000 0.4390 0.2460 ( 3364 PWs) bands (ev): -32.1840 -32.1840 -32.1835 -32.1835 -13.2771 -13.2771 -13.2667 -13.2667 -11.9547 -11.9547 -11.9354 -11.9354 -11.7646 -11.7646 -11.7575 -11.7575 -3.8461 -3.8461 -3.1603 -3.1603 -1.6093 -1.6093 -1.4532 -1.4532 5.0200 5.0200 5.2979 5.2979 5.8441 5.8441 6.2028 6.2028 6.5399 6.5399 6.7533 6.7533 7.0793 7.0793 7.4624 7.4624 7.9443 7.9443 8.1095 8.1095 9.2765 9.2765 9.5195 9.5195 13.0979 13.0979 13.1648 13.1648 13.2314 13.2314 13.6042 13.6042 k = 0.0000 0.4512 0.2460 ( 3364 PWs) bands (ev): -32.1838 -32.1838 -32.1834 -32.1834 -13.2768 -13.2768 -13.2685 -13.2685 -11.9542 -11.9542 -11.9387 -11.9387 -11.7639 -11.7639 -11.7581 -11.7581 -3.7820 -3.7820 -3.2326 -3.2326 -1.5876 -1.5876 -1.4624 -1.4624 5.0433 5.0433 5.2631 5.2631 5.9118 5.9118 6.2580 6.2580 6.4704 6.4704 6.7029 6.7029 7.0990 7.0990 7.4040 7.4040 7.9444 7.9444 8.0755 8.0755 9.3081 9.3081 9.5043 9.5043 13.1062 13.1062 13.1833 13.1833 13.2594 13.2594 13.6943 13.6943 k = 0.0000 0.4634 0.2460 ( 3364 PWs) bands (ev): -32.1837 -32.1837 -32.1834 -32.1834 -13.2764 -13.2764 -13.2701 -13.2701 -11.9534 -11.9534 -11.9417 -11.9417 -11.7631 -11.7631 -11.7587 -11.7587 -3.7167 -3.7167 -3.3044 -3.3044 -1.5671 -1.5671 -1.4730 -1.4730 5.0669 5.0669 5.2303 5.2303 5.9802 5.9802 6.3139 6.3139 6.4006 6.4006 6.6505 6.6505 7.1225 7.1225 7.3502 7.3502 7.9479 7.9479 8.0456 8.0456 9.3386 9.3386 9.4869 9.4869 13.1132 13.1132 13.1751 13.1751 13.3172 13.3172 13.7353 13.7353 k = 0.0000 0.4756 0.2460 ( 3376 PWs) bands (ev): -32.1836 -32.1836 -32.1833 -32.1833 -13.2757 -13.2757 -13.2716 -13.2716 -11.9522 -11.9522 -11.9445 -11.9445 -11.7623 -11.7623 -11.7593 -11.7593 -3.6504 -3.6504 -3.3753 -3.3753 -1.5479 -1.5479 -1.4851 -1.4851 5.0912 5.0912 5.1994 5.1994 6.0493 6.0493 6.3291 6.3291 6.3717 6.3717 6.5965 6.5965 7.1499 7.1499 7.3012 7.3012 7.9549 7.9549 8.0197 8.0197 9.3678 9.3678 9.4671 9.4671 13.1205 13.1205 13.1627 13.1627 13.3822 13.3822 13.6632 13.6632 k = 0.0000 0.4878 0.2460 ( 3372 PWs) bands (ev): -32.1835 -32.1835 -32.1833 -32.1833 -13.2750 -13.2750 -13.2729 -13.2729 -11.9508 -11.9508 -11.9469 -11.9469 -11.7615 -11.7615 -11.7600 -11.7600 -3.5831 -3.5831 -3.4455 -3.4455 -1.5301 -1.5301 -1.4986 -1.4986 5.1163 5.1163 5.1702 5.1702 6.1190 6.1190 6.2593 6.2593 6.4281 6.4281 6.5411 6.5411 7.1813 7.1813 7.2568 7.2568 7.9655 7.9655 7.9978 7.9978 9.3954 9.3954 9.4452 9.4452 13.1289 13.1289 13.1502 13.1502 13.4500 13.4500 13.5909 13.5909 k = 0.0000 0.5000 0.2460 ( 3368 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2740 -13.2740 -13.2740 -13.2740 -11.9490 -11.9490 -11.9490 -11.9490 -11.7608 -11.7608 -11.7608 -11.7608 -3.5147 -3.5147 -3.5147 -3.5147 -1.5136 -1.5136 -1.5136 -1.5136 5.1426 5.1426 5.1426 5.1426 6.1891 6.1891 6.1891 6.1891 6.4848 6.4848 6.4848 6.4848 7.2169 7.2169 7.2169 7.2169 7.9798 7.9798 7.9798 7.9798 9.4213 9.4213 9.4213 9.4213 13.1389 13.1389 13.1389 13.1389 13.5198 13.5198 13.5198 13.5198 k = 0.0000 0.5000 0.2460 ( 3368 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2740 -13.2740 -13.2740 -13.2740 -11.9490 -11.9490 -11.9490 -11.9490 -11.7608 -11.7608 -11.7608 -11.7608 -3.5147 -3.5147 -3.5147 -3.5147 -1.5136 -1.5136 -1.5136 -1.5136 5.1426 5.1426 5.1426 5.1426 6.1891 6.1891 6.1891 6.1891 6.4848 6.4848 6.4848 6.4848 7.2169 7.2169 7.2169 7.2169 7.9798 7.9798 7.9798 7.9798 9.4213 9.4213 9.4213 9.4213 13.1389 13.1389 13.1389 13.1389 13.5198 13.5198 13.5198 13.5198 k = 0.0122 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2746 -13.2746 -13.2734 -13.2734 -11.9490 -11.9490 -11.9489 -11.9489 -11.7619 -11.7619 -11.7601 -11.7601 -3.5150 -3.5150 -3.5134 -3.5134 -1.5139 -1.5139 -1.5138 -1.5138 5.1435 5.1435 5.1443 5.1443 6.1428 6.1428 6.1468 6.1468 6.5179 6.5179 6.5314 6.5314 7.2188 7.2188 7.2239 7.2239 7.9779 7.9779 7.9812 7.9812 9.4191 9.4191 9.4215 9.4215 13.1321 13.1321 13.1427 13.1427 13.5158 13.5158 13.5253 13.5253 k = 0.0244 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1833 -32.1833 -32.1833 -32.1833 -13.2753 -13.2753 -13.2729 -13.2729 -11.9488 -11.9488 -11.9486 -11.9486 -11.7634 -11.7634 -11.7599 -11.7599 -3.5143 -3.5143 -3.5110 -3.5110 -1.5145 -1.5145 -1.5144 -1.5144 5.1469 5.1469 5.1487 5.1487 6.0476 6.0476 6.0508 6.0508 6.5951 6.5951 6.6171 6.6171 7.2302 7.2302 7.2403 7.2403 7.9758 7.9758 7.9825 7.9825 9.4151 9.4151 9.4199 9.4199 13.1229 13.1229 13.1432 13.1432 13.5143 13.5143 13.5325 13.5325 k = 0.0366 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1833 -32.1833 -32.1833 -32.1833 -13.2760 -13.2760 -13.2724 -13.2724 -11.9485 -11.9485 -11.9483 -11.9483 -11.7654 -11.7654 -11.7601 -11.7601 -3.5125 -3.5125 -3.5076 -3.5076 -1.5155 -1.5155 -1.5155 -1.5155 5.1528 5.1528 5.1556 5.1556 5.9365 5.9365 5.9371 5.9371 6.6779 6.6779 6.7068 6.7068 7.2533 7.2533 7.2678 7.2678 7.9738 7.9738 7.9843 7.9843 9.4093 9.4093 9.4165 9.4165 13.1118 13.1118 13.1406 13.1406 13.5163 13.5163 13.5419 13.5419 k = 0.0488 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1832 -32.1832 -32.1832 -32.1832 -13.2768 -13.2768 -13.2720 -13.2720 -11.9481 -11.9481 -11.9478 -11.9478 -11.7677 -11.7677 -11.7607 -11.7607 -3.5098 -3.5098 -3.5033 -3.5033 -1.5170 -1.5170 -1.5169 -1.5169 5.1608 5.1608 5.1647 5.1647 5.8177 5.8177 5.8199 5.8199 6.7521 6.7521 6.7864 6.7864 7.2909 7.2909 7.3081 7.3081 7.9729 7.9729 7.9876 7.9876 9.4019 9.4019 9.4113 9.4113 13.0995 13.0995 13.1351 13.1351 13.5230 13.5230 13.5546 13.5546 k = 0.0610 0.5000 0.2460 ( 3384 PWs) bands (ev): -32.1831 -32.1831 -32.1831 -32.1831 -13.2776 -13.2776 -13.2717 -13.2717 -11.9475 -11.9475 -11.9471 -11.9471 -11.7704 -11.7704 -11.7618 -11.7618 -3.5059 -3.5059 -3.4979 -3.4979 -1.5189 -1.5189 -1.5188 -1.5188 5.1702 5.1702 5.1757 5.1757 5.6970 5.6970 5.7022 5.7022 6.8116 6.8116 6.8491 6.8491 7.3442 7.3442 7.3612 7.3612 7.9748 7.9748 7.9941 7.9941 9.3929 9.3929 9.4045 9.4045 13.0868 13.0868 13.1274 13.1274 13.5354 13.5354 13.5710 13.5710 k = 0.0732 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1829 -32.1829 -32.1829 -32.1829 -13.2785 -13.2785 -13.2715 -13.2715 -11.9469 -11.9469 -11.9464 -11.9464 -11.7735 -11.7735 -11.7632 -11.7632 -3.5011 -3.5011 -3.4916 -3.4916 -1.5212 -1.5212 -1.5210 -1.5210 5.1799 5.1799 5.1876 5.1876 5.5777 5.5777 5.5865 5.5865 6.8555 6.8555 6.8936 6.8936 7.4102 7.4102 7.4235 7.4235 7.9820 7.9820 8.0068 8.0068 9.3828 9.3828 9.3964 9.3964 13.0745 13.0745 13.1185 13.1185 13.5536 13.5536 13.5919 13.5919 k = 0.0854 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1827 -32.1827 -32.1827 -32.1827 -13.2794 -13.2794 -13.2713 -13.2713 -11.9461 -11.9461 -11.9455 -11.9455 -11.7769 -11.7769 -11.7651 -11.7651 -3.4954 -3.4954 -3.4843 -3.4843 -1.5238 -1.5238 -1.5237 -1.5237 5.1861 5.1861 5.1972 5.1972 5.4638 5.4638 5.4771 5.4771 6.8858 6.8858 6.9227 6.9227 7.4811 7.4811 7.4880 7.4880 7.9987 7.9987 8.0295 8.0295 9.3718 9.3718 9.3873 9.3873 13.0634 13.0634 13.1094 13.1094 13.5775 13.5775 13.6172 13.6172 k = 0.0976 0.5000 0.2460 ( 3368 PWs) bands (ev): -32.1825 -32.1825 -32.1825 -32.1825 -13.2803 -13.2803 -13.2712 -13.2712 -11.9452 -11.9452 -11.9445 -11.9445 -11.7807 -11.7807 -11.7674 -11.7674 -3.4886 -3.4886 -3.4762 -3.4762 -1.5269 -1.5269 -1.5267 -1.5267 5.1779 5.1779 5.1933 5.1933 5.3670 5.3670 5.3856 5.3856 6.9055 6.9055 6.9404 6.9404 7.5461 7.5461 7.5462 7.5462 8.0304 8.0304 8.0668 8.0668 9.3606 9.3606 9.3777 9.3777 13.0542 13.0542 13.1012 13.1012 13.6068 13.6068 13.6470 13.6470 k = 0.1098 0.5000 0.2460 ( 3368 PWs) bands (ev): -32.1822 -32.1822 -32.1822 -32.1822 -13.2813 -13.2813 -13.2711 -13.2711 -11.9443 -11.9443 -11.9434 -11.9434 -11.7847 -11.7847 -11.7701 -11.7701 -3.4810 -3.4810 -3.4672 -3.4672 -1.5303 -1.5303 -1.5301 -1.5301 5.1313 5.1313 5.1442 5.1442 5.3195 5.3195 5.3363 5.3363 6.9177 6.9177 6.9505 6.9505 7.5908 7.5908 7.5964 7.5964 8.0816 8.0816 8.1219 8.1219 9.3498 9.3498 9.3684 9.3684 13.0473 13.0473 13.0948 13.0948 13.6409 13.6409 13.6809 13.6809 k = 0.1220 0.5000 0.2460 ( 3368 PWs) bands (ev): -32.1820 -32.1820 -32.1820 -32.1820 -13.2822 -13.2822 -13.2712 -13.2712 -11.9432 -11.9432 -11.9422 -11.9422 -11.7889 -11.7889 -11.7731 -11.7731 -3.4724 -3.4724 -3.4574 -3.4574 -1.5341 -1.5341 -1.5339 -1.5339 5.0448 5.0448 5.0502 5.0502 5.3209 5.3209 5.3311 5.3311 6.9244 6.9244 6.9552 6.9552 7.6196 7.6196 7.6282 7.6282 8.1526 8.1526 8.1940 8.1940 9.3406 9.3406 9.3604 9.3604 13.0433 13.0433 13.0907 13.0907 13.6792 13.6792 13.7187 13.7187 k = 0.1341 0.5000 0.2460 ( 3368 PWs) bands (ev): -32.1817 -32.1817 -32.1817 -32.1817 -13.2832 -13.2832 -13.2713 -13.2713 -11.9421 -11.9421 -11.9409 -11.9409 -11.7934 -11.7934 -11.7764 -11.7764 -3.4630 -3.4630 -3.4468 -3.4468 -1.5383 -1.5383 -1.5380 -1.5380 4.9421 4.9421 4.9427 4.9427 5.3401 5.3401 5.3460 5.3460 6.9272 6.9272 6.9562 6.9562 7.6346 7.6346 7.6438 7.6438 8.2380 8.2380 8.2781 8.2781 9.3347 9.3347 9.3553 9.3553 13.0424 13.0424 13.0893 13.0893 13.7212 13.7212 13.7598 13.7598 k = 0.1463 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1814 -32.1814 -32.1814 -32.1814 -13.2843 -13.2843 -13.2715 -13.2715 -11.9409 -11.9409 -11.9395 -11.9395 -11.7980 -11.7980 -11.7800 -11.7800 -3.4529 -3.4529 -3.4355 -3.4355 -1.5428 -1.5428 -1.5425 -1.5425 4.8327 4.8327 4.8352 4.8352 5.3660 5.3660 5.3694 5.3694 6.9270 6.9270 6.9545 6.9545 7.6394 7.6394 7.6481 7.6481 8.3301 8.3301 8.3675 8.3675 9.3343 9.3343 9.3552 9.3552 13.0448 13.0448 13.0911 13.0911 13.7663 13.7663 13.8039 13.8039 k = 0.1585 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1811 -32.1811 -32.1811 -32.1811 -13.2853 -13.2853 -13.2719 -13.2719 -11.9397 -11.9397 -11.9380 -11.9380 -11.8028 -11.8028 -11.7839 -11.7839 -3.4419 -3.4419 -3.4236 -3.4236 -1.5476 -1.5476 -1.5473 -1.5473 4.7235 4.7235 4.7279 4.7279 5.3956 5.3956 5.3972 5.3972 6.9246 6.9246 6.9506 6.9506 7.6374 7.6374 7.6452 7.6452 8.4215 8.4215 8.4553 8.4553 9.3425 9.3425 9.3630 9.3630 13.0506 13.0506 13.0961 13.0961 13.8138 13.8138 13.8502 13.8502 k = 0.1707 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1808 -32.1808 -32.1808 -32.1808 -13.2864 -13.2864 -13.2722 -13.2722 -11.9384 -11.9384 -11.9365 -11.9365 -11.8077 -11.8077 -11.7881 -11.7881 -3.4302 -3.4302 -3.4110 -3.4110 -1.5527 -1.5527 -1.5524 -1.5524 4.6159 4.6159 4.6220 4.6220 5.4276 5.4276 5.4280 5.4280 6.9203 6.9203 6.9450 6.9450 7.6312 7.6312 7.6382 7.6382 8.5054 8.5054 8.5347 8.5347 9.3631 9.3631 9.3821 9.3821 13.0598 13.0598 13.1044 13.1044 13.8632 13.8632 13.8983 13.8983 k = 0.1829 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1804 -32.1804 -32.1804 -32.1804 -13.2874 -13.2874 -13.2727 -13.2727 -11.9371 -11.9371 -11.9350 -11.9350 -11.8126 -11.8126 -11.7924 -11.7924 -3.4179 -3.4179 -3.3979 -3.3979 -1.5581 -1.5581 -1.5577 -1.5577 4.5107 4.5107 4.5180 4.5180 5.4608 5.4608 5.4615 5.4615 6.9146 6.9146 6.9381 6.9381 7.6225 7.6225 7.6288 7.6288 8.5761 8.5761 8.6001 8.6001 9.4002 9.4002 9.4165 9.4165 13.0723 13.0723 13.1160 13.1160 13.9138 13.9138 13.9476 13.9476 k = 0.1951 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1801 -32.1801 -32.1801 -32.1801 -13.2885 -13.2885 -13.2733 -13.2733 -11.9358 -11.9358 -11.9334 -11.9334 -11.8175 -11.8175 -11.7969 -11.7969 -3.4050 -3.4050 -3.3843 -3.3843 -1.5638 -1.5638 -1.5634 -1.5634 4.4081 4.4081 4.4164 4.4164 5.4952 5.4952 5.4968 5.4968 6.9076 6.9076 6.9299 6.9299 7.6126 7.6126 7.6184 7.6184 8.6295 8.6295 8.6475 8.6475 9.4562 9.4562 9.4689 9.4689 13.0880 13.0880 13.1306 13.1306 13.9649 13.9649 13.9972 13.9972 k = 0.2073 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1797 -32.1797 -32.1797 -32.1797 -13.2895 -13.2895 -13.2739 -13.2739 -11.9346 -11.9346 -11.9318 -11.9318 -11.8224 -11.8224 -11.8015 -11.8015 -3.3916 -3.3916 -3.3703 -3.3703 -1.5697 -1.5697 -1.5693 -1.5693 4.3084 4.3084 4.3174 4.3174 5.5308 5.5308 5.5332 5.5332 6.8996 6.8996 6.9208 6.9208 7.6024 7.6024 7.6078 7.6078 8.6644 8.6644 8.6764 8.6764 9.5310 9.5310 9.5399 9.5399 13.1067 13.1067 13.1481 13.1481 14.0158 14.0158 14.0466 14.0466 k = 0.2195 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1794 -32.1794 -32.1794 -32.1794 -13.2906 -13.2906 -13.2747 -13.2747 -11.9334 -11.9334 -11.9302 -11.9302 -11.8272 -11.8272 -11.8063 -11.8063 -3.3777 -3.3777 -3.3560 -3.3560 -1.5758 -1.5758 -1.5754 -1.5754 4.2117 4.2117 4.2214 4.2214 5.5672 5.5672 5.5703 5.5703 6.8907 6.8907 6.9108 6.9108 7.5925 7.5925 7.5977 7.5977 8.6822 8.6822 8.6889 8.6889 9.6219 9.6219 9.6272 9.6272 13.1281 13.1281 13.1684 13.1684 14.0657 14.0657 14.0950 14.0950 k = 0.2317 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1790 -32.1790 -32.1790 -32.1790 -13.2916 -13.2916 -13.2755 -13.2755 -11.9322 -11.9322 -11.9286 -11.9286 -11.8319 -11.8319 -11.8111 -11.8111 -3.3635 -3.3635 -3.3414 -3.3414 -1.5821 -1.5821 -1.5816 -1.5816 4.1182 4.1182 4.1284 4.1284 5.6040 5.6040 5.6077 5.6077 6.8812 6.8812 6.9002 6.9002 7.5834 7.5834 7.5886 7.5886 8.6863 8.6863 8.6885 8.6885 9.7248 9.7248 9.7272 9.7272 13.1521 13.1521 13.1910 13.1910 14.1141 14.1141 14.1417 14.1417 k = 0.2439 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1786 -32.1786 -32.1786 -32.1786 -13.2927 -13.2927 -13.2764 -13.2764 -11.9311 -11.9311 -11.9271 -11.9271 -11.8364 -11.8364 -11.8159 -11.8159 -3.3489 -3.3489 -3.3266 -3.3266 -1.5885 -1.5885 -1.5881 -1.5881 4.0281 4.0281 4.0387 4.0387 5.6410 5.6410 5.6453 5.6453 6.8710 6.8710 6.8889 6.8889 7.5755 7.5755 7.5807 7.5807 8.6787 8.6787 8.6800 8.6800 9.8359 9.8359 9.8362 9.8362 13.1782 13.1782 13.2156 13.2156 14.1602 14.1602 14.1860 14.1860 k = 0.2561 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1782 -32.1782 -32.1782 -32.1782 -13.2937 -13.2937 -13.2774 -13.2774 -11.9302 -11.9302 -11.9256 -11.9256 -11.8407 -11.8407 -11.8207 -11.8207 -3.3341 -3.3341 -3.3117 -3.3117 -1.5951 -1.5951 -1.5946 -1.5946 3.9414 3.9414 3.9522 3.9522 5.6778 5.6778 5.6826 5.6826 6.8604 6.8604 6.8772 6.8772 7.5691 7.5691 7.5744 7.5744 8.6623 8.6623 8.6664 8.6664 9.9508 9.9508 9.9520 9.9520 13.2061 13.2061 13.2420 13.2420 14.2035 14.2035 14.2273 14.2273 k = 0.2683 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1778 -32.1778 -32.1778 -32.1778 -13.2946 -13.2946 -13.2784 -13.2784 -11.9294 -11.9294 -11.9242 -11.9242 -11.8447 -11.8447 -11.8254 -11.8254 -3.3191 -3.3191 -3.2968 -3.2968 -1.6018 -1.6018 -1.6013 -1.6013 3.8582 3.8582 3.8692 3.8692 5.7142 5.7142 5.7194 5.7194 6.8495 6.8495 6.8652 6.8652 7.5644 7.5644 7.5698 7.5698 8.6415 8.6415 8.6477 8.6477 10.0685 10.0685 10.0708 10.0708 13.2354 13.2354 13.2696 13.2696 14.2434 14.2434 14.2650 14.2650 k = 0.2805 0.5000 0.2460 ( 3384 PWs) bands (ev): -32.1775 -32.1775 -32.1775 -32.1775 -13.2956 -13.2956 -13.2795 -13.2795 -11.9287 -11.9287 -11.9229 -11.9229 -11.8485 -11.8485 -11.8301 -11.8301 -3.3041 -3.3041 -3.2819 -3.2819 -1.6085 -1.6085 -1.6080 -1.6080 3.7787 3.7787 3.7898 3.7898 5.7497 5.7497 5.7554 5.7554 6.8384 6.8384 6.8531 6.8531 7.5615 7.5615 7.5670 7.5670 8.6178 8.6178 8.6256 8.6256 10.1874 10.1874 10.1903 10.1903 13.2657 13.2657 13.2979 13.2979 14.2796 14.2796 14.2989 14.2989 k = 0.2927 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1771 -32.1771 -32.1771 -32.1771 -13.2965 -13.2965 -13.2806 -13.2806 -11.9282 -11.9282 -11.9217 -11.9217 -11.8519 -11.8519 -11.8346 -11.8346 -3.2890 -3.2890 -3.2672 -3.2672 -1.6152 -1.6152 -1.6147 -1.6147 3.7029 3.7029 3.7140 3.7140 5.7843 5.7843 5.7902 5.7902 6.8273 6.8273 6.8409 6.8409 7.5606 7.5606 7.5661 7.5661 8.5923 8.5923 8.6014 8.6014 10.3058 10.3058 10.3091 10.3091 13.2964 13.2964 13.3265 13.3265 14.3122 14.3122 14.3287 14.3287 k = 0.3049 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1767 -32.1767 -32.1767 -32.1767 -13.2973 -13.2973 -13.2818 -13.2818 -11.9278 -11.9278 -11.9207 -11.9207 -11.8549 -11.8549 -11.8388 -11.8388 -3.2741 -3.2741 -3.2527 -3.2527 -1.6219 -1.6219 -1.6214 -1.6214 3.6310 3.6310 3.6420 3.6420 5.8175 5.8175 5.8237 5.8237 6.8163 6.8163 6.8288 6.8288 7.5616 7.5616 7.5671 7.5671 8.5658 8.5658 8.5759 8.5759 10.4226 10.4226 10.4262 10.4262 13.3270 13.3270 13.3547 13.3547 14.3411 14.3411 14.3544 14.3544 k = 0.3171 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1764 -32.1764 -32.1764 -32.1764 -13.2981 -13.2981 -13.2831 -13.2831 -11.9277 -11.9277 -11.9199 -11.9199 -11.8576 -11.8576 -11.8429 -11.8429 -3.2594 -3.2594 -3.2386 -3.2386 -1.6285 -1.6285 -1.6280 -1.6280 3.5630 3.5630 3.5738 3.5738 5.8493 5.8493 5.8556 5.8556 6.8054 6.8054 6.8168 6.8168 7.5646 7.5646 7.5700 7.5700 8.5391 8.5391 8.5499 8.5499 10.5367 10.5367 10.5404 10.5404 13.3568 13.3568 13.3819 13.3819 14.3670 14.3670 14.3764 14.3764 k = 0.3293 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1760 -32.1760 -32.1760 -32.1760 -13.2989 -13.2989 -13.2843 -13.2843 -11.9277 -11.9277 -11.9193 -11.9193 -11.8600 -11.8600 -11.8467 -11.8467 -3.2450 -3.2450 -3.2248 -3.2248 -1.6351 -1.6351 -1.6345 -1.6345 3.4990 3.4990 3.5096 3.5096 5.8792 5.8792 5.8856 5.8856 6.7948 6.7948 6.8053 6.8053 7.5694 7.5694 7.5746 7.5746 8.5125 8.5125 8.5239 8.5239 10.6474 10.6474 10.6510 10.6510 13.3853 13.3853 13.4076 13.4076 14.3903 14.3903 14.3955 14.3955 k = 0.3415 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1757 -32.1757 -32.1757 -32.1757 -13.2995 -13.2995 -13.2856 -13.2856 -11.9278 -11.9278 -11.9189 -11.9189 -11.8619 -11.8619 -11.8501 -11.8501 -3.2309 -3.2309 -3.2116 -3.2116 -1.6414 -1.6414 -1.6408 -1.6408 3.4391 3.4391 3.4493 3.4493 5.9073 5.9073 5.9137 5.9137 6.7846 6.7846 6.7941 6.7941 7.5759 7.5759 7.5808 7.5808 8.4865 8.4865 8.4983 8.4983 10.7536 10.7536 10.7572 10.7572 13.4117 13.4117 13.4311 13.4311 14.4122 14.4122 14.4126 14.4126 k = 0.3537 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1753 -32.1753 -32.1753 -32.1753 -13.3001 -13.3001 -13.2869 -13.2869 -11.9281 -11.9281 -11.9188 -11.9188 -11.8636 -11.8636 -11.8533 -11.8533 -3.2174 -3.2174 -3.1990 -3.1990 -1.6475 -1.6475 -1.6470 -1.6470 3.3834 3.3834 3.3932 3.3932 5.9334 5.9334 5.9396 5.9396 6.7748 6.7748 6.7834 6.7834 7.5839 7.5839 7.5884 7.5884 8.4615 8.4615 8.4734 8.4734 10.8549 10.8549 10.8583 10.8583 13.4355 13.4355 13.4518 13.4518 14.4288 14.4288 14.4336 14.4336 k = 0.3659 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1751 -32.1751 -32.1751 -32.1751 -13.3006 -13.3006 -13.2882 -13.2882 -11.9285 -11.9285 -11.9189 -11.9189 -11.8648 -11.8648 -11.8560 -11.8560 -3.2044 -3.2044 -3.1870 -3.1870 -1.6534 -1.6534 -1.6528 -1.6528 3.3319 3.3319 3.3411 3.3411 5.9573 5.9573 5.9633 5.9633 6.7657 6.7657 6.7734 6.7734 7.5932 7.5932 7.5972 7.5972 8.4376 8.4376 8.4495 8.4495 10.9504 10.9504 10.9537 10.9537 13.4562 13.4562 13.4694 13.4694 14.4455 14.4455 14.4556 14.4556 k = 0.3780 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1748 -32.1748 -32.1748 -32.1748 -13.3011 -13.3011 -13.2895 -13.2895 -11.9290 -11.9290 -11.9193 -11.9193 -11.8658 -11.8658 -11.8584 -11.8584 -3.1920 -3.1920 -3.1759 -3.1759 -1.6590 -1.6590 -1.6584 -1.6584 3.2847 3.2847 3.2933 3.2933 5.9790 5.9790 5.9847 5.9847 6.7571 6.7571 6.7640 6.7640 7.6035 7.6035 7.6070 7.6070 8.4151 8.4151 8.4270 8.4270 11.0397 11.0397 11.0427 11.0427 13.4733 13.4733 13.4836 13.4836 14.4638 14.4638 14.4792 14.4792 k = 0.3902 0.5000 0.2460 ( 3376 PWs) bands (ev): -32.1745 -32.1745 -32.1745 -32.1745 -13.3014 -13.3014 -13.2908 -13.2908 -11.9294 -11.9294 -11.9199 -11.9199 -11.8666 -11.8666 -11.8604 -11.8604 -3.1805 -3.1805 -3.1656 -3.1656 -1.6642 -1.6642 -1.6637 -1.6637 3.2418 3.2418 3.2498 3.2498 5.9985 5.9985 6.0038 6.0038 6.7493 6.7493 6.7553 6.7553 7.6144 7.6144 7.6173 7.6173 8.3943 8.3943 8.4058 8.4058 11.1221 11.1221 11.1248 11.1248 13.4868 13.4868 13.4944 13.4944 14.4846 14.4846 14.5051 14.5051 k = 0.4024 0.5000 0.2460 ( 3384 PWs) bands (ev): -32.1743 -32.1743 -32.1743 -32.1743 -13.3016 -13.3016 -13.2921 -13.2921 -11.9299 -11.9299 -11.9207 -11.9207 -11.8671 -11.8671 -11.8621 -11.8621 -3.1697 -3.1697 -3.1562 -3.1562 -1.6690 -1.6690 -1.6685 -1.6685 3.2034 3.2034 3.2107 3.2107 6.0158 6.0158 6.0207 6.0207 6.7422 6.7422 6.7474 6.7474 7.6256 7.6256 7.6280 7.6280 8.3753 8.3753 8.3863 8.3863 11.1971 11.1971 11.1996 11.1996 13.4968 13.4968 13.5020 13.5020 14.5085 14.5085 14.5337 14.5337 k = 0.4146 0.5000 0.2460 ( 3380 PWs) bands (ev): -32.1741 -32.1741 -32.1741 -32.1741 -13.3018 -13.3018 -13.2933 -13.2933 -11.9303 -11.9303 -11.9216 -11.9216 -11.8675 -11.8675 -11.8635 -11.8635 -3.1599 -3.1599 -3.1479 -3.1479 -1.6733 -1.6733 -1.6729 -1.6729 3.1694 3.1694 3.1759 3.1759 6.0308 6.0308 6.0353 6.0353 6.7358 6.7358 6.7404 6.7404 7.6367 7.6367 7.6385 7.6385 8.3582 8.3582 8.3685 8.3685 11.2643 11.2643 11.2665 11.2665 13.5035 13.5035 13.5068 13.5068 14.5358 14.5358 14.5650 14.5650 k = 0.4268 0.5000 0.2460 ( 3384 PWs) bands (ev): -32.1739 -32.1739 -32.1739 -32.1739 -13.3018 -13.3018 -13.2944 -13.2944 -11.9305 -11.9305 -11.9227 -11.9227 -11.8678 -11.8678 -11.8646 -11.8646 -3.1511 -3.1511 -3.1406 -3.1406 -1.6772 -1.6772 -1.6768 -1.6768 3.1399 3.1399 3.1456 3.1456 6.0438 6.0438 6.0477 6.0477 6.7303 6.7303 6.7342 6.7342 7.6473 7.6473 7.6486 7.6486 8.3432 8.3432 8.3526 8.3526 11.3232 11.3232 11.3252 11.3252 13.5076 13.5076 13.5093 13.5093 14.5662 14.5662 14.5986 14.5986 k = 0.4390 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1737 -32.1737 -32.1737 -32.1737 -13.3017 -13.3017 -13.2955 -13.2955 -11.9307 -11.9307 -11.9239 -11.9239 -11.8679 -11.8679 -11.8654 -11.8654 -3.1434 -3.1434 -3.1345 -3.1345 -1.6805 -1.6805 -1.6802 -1.6802 3.1150 3.1150 3.1199 3.1199 6.0547 6.0547 6.0580 6.0580 6.7257 6.7257 6.7288 6.7288 7.6570 7.6570 7.6579 7.6579 8.3305 8.3305 8.3387 8.3387 11.3737 11.3737 11.3753 11.3753 13.5095 13.5095 13.5102 13.5102 14.5992 14.5992 14.6337 14.6337 k = 0.4512 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1736 -32.1736 -32.1736 -32.1736 -13.3016 -13.3016 -13.2965 -13.2965 -11.9307 -11.9307 -11.9251 -11.9251 -11.8679 -11.8679 -11.8661 -11.8661 -3.1368 -3.1368 -3.1297 -3.1297 -1.6833 -1.6833 -1.6830 -1.6830 3.0947 3.0947 3.0986 3.0986 6.0635 6.0635 6.0662 6.0662 6.7219 6.7219 6.7244 6.7244 7.6655 7.6655 7.6660 7.6660 8.3201 8.3201 8.3270 8.3270 11.4153 11.4153 11.4166 11.4166 13.5099 13.5099 13.5100 13.5100 14.6338 14.6338 14.6691 14.6691 k = 0.4634 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1735 -32.1735 -32.1735 -32.1735 -13.3013 -13.3013 -13.2975 -13.2975 -11.9305 -11.9305 -11.9262 -11.9262 -11.8679 -11.8679 -11.8666 -11.8666 -3.1314 -3.1314 -3.1260 -3.1260 -1.6855 -1.6855 -1.6853 -1.6853 3.0790 3.0790 3.0819 3.0819 6.0704 6.0704 6.0724 6.0724 6.7190 6.7190 6.7208 6.7208 7.6725 7.6725 7.6728 7.6728 8.3121 8.3121 8.3175 8.3175 11.4479 11.4479 11.4489 11.4489 13.5093 13.5093 13.5096 13.5096 14.6687 14.6687 14.7026 14.7026 k = 0.4756 0.5000 0.2460 ( 3372 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.3009 -13.3009 -13.2984 -13.2984 -11.9302 -11.9302 -11.9273 -11.9273 -11.8678 -11.8678 -11.8670 -11.8670 -3.1273 -3.1273 -3.1236 -3.1236 -1.6870 -1.6870 -1.6869 -1.6869 3.0679 3.0679 3.0698 3.0698 6.0754 6.0754 6.0767 6.0767 6.7170 6.7170 6.7182 6.7182 7.6776 7.6776 7.6778 7.6778 8.3067 8.3067 8.3104 8.3104 11.4714 11.4714 11.4720 11.4720 13.5086 13.5086 13.5089 13.5089 14.7019 14.7019 14.7307 14.7307 k = 0.4878 0.5000 0.2460 ( 3364 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.3004 -13.3004 -13.2991 -13.2991 -11.9297 -11.9297 -11.9282 -11.9282 -11.8677 -11.8677 -11.8673 -11.8673 -3.1244 -3.1244 -3.1226 -3.1226 -1.6880 -1.6880 -1.6879 -1.6879 3.0614 3.0614 3.0624 3.0624 6.0785 6.0785 6.0792 6.0792 6.7159 6.7159 6.7165 6.7165 7.6808 7.6808 7.6809 7.6809 8.3038 8.3038 8.3056 8.3056 11.4855 11.4855 11.4859 11.4859 13.5080 13.5080 13.5082 13.5082 14.7299 14.7299 14.7476 14.7476 k = 0.5000 0.5000 0.2460 ( 3360 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2998 -13.2998 -13.2998 -13.2998 -11.9290 -11.9290 -11.9290 -11.9290 -11.8675 -11.8675 -11.8675 -11.8675 -3.1228 -3.1228 -3.1228 -3.1228 -1.6883 -1.6883 -1.6883 -1.6883 3.0596 3.0596 3.0596 3.0596 6.0797 6.0797 6.0797 6.0797 6.7158 6.7158 6.7158 6.7158 7.6819 7.6819 7.6819 7.6819 8.3034 8.3034 8.3034 8.3034 11.4904 11.4904 11.4904 11.4904 13.5079 13.5079 13.5079 13.5079 14.7472 14.7472 14.7472 14.7472 k = 0.5000 0.5000 0.2460 ( 3360 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2998 -13.2998 -13.2998 -13.2998 -11.9290 -11.9290 -11.9290 -11.9290 -11.8675 -11.8675 -11.8675 -11.8675 -3.1228 -3.1228 -3.1228 -3.1228 -1.6883 -1.6883 -1.6883 -1.6883 3.0596 3.0596 3.0596 3.0596 6.0797 6.0797 6.0797 6.0797 6.7158 6.7158 6.7158 6.7158 7.6819 7.6819 7.6819 7.6819 8.3034 8.3034 8.3034 8.3034 11.4904 11.4904 11.4904 11.4904 13.5079 13.5079 13.5079 13.5079 14.7472 14.7472 14.7472 14.7472 k = 0.4914 0.4914 0.2460 ( 3364 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.3004 -13.3004 -13.2991 -13.2991 -11.9297 -11.9297 -11.9282 -11.9282 -11.8677 -11.8677 -11.8673 -11.8673 -3.1254 -3.1254 -3.1216 -3.1216 -1.6882 -1.6882 -1.6877 -1.6877 3.0597 3.0597 3.0640 3.0640 6.0777 6.0777 6.0799 6.0799 6.7157 6.7157 6.7168 6.7168 7.6795 7.6795 7.6821 7.6821 8.3036 8.3036 8.3058 8.3058 11.4819 11.4819 11.4895 11.4895 13.5064 13.5064 13.5099 13.5099 14.7267 14.7267 14.7516 14.7516 k = 0.4828 0.4828 0.2460 ( 3370 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.3009 -13.3009 -13.2984 -13.2984 -11.9302 -11.9302 -11.9272 -11.9272 -11.8678 -11.8678 -11.8670 -11.8670 -3.1322 -3.1322 -3.1187 -3.1187 -1.6880 -1.6880 -1.6860 -1.6860 3.0605 3.0605 3.0772 3.0772 6.0718 6.0718 6.0804 6.0804 6.7158 6.7158 6.7194 6.7194 7.6726 7.6726 7.6828 7.6828 8.3057 8.3057 8.3113 8.3113 11.4567 11.4567 11.4869 11.4869 13.5017 13.5017 13.5156 13.5156 14.6879 14.6879 14.7529 14.7529 k = 0.4741 0.4741 0.2460 ( 3366 PWs) bands (ev): -32.1735 -32.1735 -32.1735 -32.1735 -13.3013 -13.3013 -13.2975 -13.2975 -11.9306 -11.9306 -11.9261 -11.9261 -11.8679 -11.8679 -11.8667 -11.8667 -3.1434 -3.1434 -3.1139 -3.1139 -1.6877 -1.6877 -1.6831 -1.6831 3.0617 3.0617 3.0991 3.0991 6.0620 6.0620 6.0811 6.0811 6.7161 6.7161 6.7239 6.7239 7.6612 7.6612 7.6839 7.6839 8.3092 8.3092 8.3202 8.3202 11.4151 11.4151 11.4826 11.4826 13.4938 13.4938 13.5248 13.5248 14.6414 14.6414 14.7546 14.7546 k = 0.4655 0.4655 0.2460 ( 3374 PWs) bands (ev): -32.1736 -32.1736 -32.1736 -32.1736 -13.3016 -13.3016 -13.2965 -13.2965 -11.9309 -11.9309 -11.9247 -11.9247 -11.8678 -11.8678 -11.8663 -11.8663 -3.1590 -3.1590 -3.1072 -3.1072 -1.6873 -1.6873 -1.6792 -1.6792 3.0634 3.0634 3.1297 3.1297 6.0484 6.0484 6.0822 6.0822 6.7165 6.7165 6.7301 6.7301 7.6455 7.6455 7.6855 7.6855 8.3141 8.3141 8.3324 8.3324 11.3578 11.3578 11.4765 11.4765 13.4825 13.4825 13.5365 13.5365 14.5941 14.5941 14.7574 14.7574 k = 0.4569 0.4569 0.2460 ( 3374 PWs) bands (ev): -32.1738 -32.1738 -32.1737 -32.1737 -13.3018 -13.3018 -13.2954 -13.2954 -11.9310 -11.9310 -11.9232 -11.9232 -11.8677 -11.8677 -11.8659 -11.8659 -3.1788 -3.1788 -3.0985 -3.0985 -1.6868 -1.6868 -1.6742 -1.6742 3.0657 3.0657 3.1687 3.1687 6.0312 6.0312 6.0835 6.0835 6.7172 6.7172 6.7380 6.7380 7.6261 7.6261 7.6875 7.6875 8.3201 8.3201 8.3478 8.3478 11.2857 11.2857 11.4688 11.4688 13.4677 13.4677 13.5498 13.5498 14.5498 14.5498 14.7616 14.7616 k = 0.4483 0.4483 0.2460 ( 3378 PWs) bands (ev): -32.1739 -32.1739 -32.1739 -32.1739 -13.3019 -13.3019 -13.2943 -13.2943 -11.9310 -11.9310 -11.9216 -11.9216 -11.8675 -11.8675 -11.8655 -11.8655 -3.2026 -3.2026 -3.0880 -3.0880 -1.6864 -1.6864 -1.6683 -1.6683 3.0687 3.0687 3.2159 3.2159 6.0106 6.0106 6.0852 6.0852 6.7182 6.7182 6.7478 6.7478 7.6032 7.6032 7.6900 7.6900 8.3271 8.3271 8.3661 8.3661 11.1999 11.1999 11.4594 11.4594 13.4494 13.4494 13.5633 13.5633 14.5110 14.5110 14.7673 14.7673 k = 0.4397 0.4397 0.2460 ( 3386 PWs) bands (ev): -32.1742 -32.1742 -32.1741 -32.1741 -13.3019 -13.3019 -13.2930 -13.2930 -11.9309 -11.9309 -11.9197 -11.9197 -11.8672 -11.8672 -11.8650 -11.8650 -3.2301 -3.2301 -3.0755 -3.0755 -1.6860 -1.6860 -1.6615 -1.6615 3.0723 3.0723 3.2712 3.2712 5.9867 5.9867 6.0871 6.0871 6.7197 6.7197 6.7593 6.7593 7.5773 7.5773 7.6930 7.6930 8.3350 8.3350 8.3870 8.3870 11.1014 11.1014 11.4485 11.4485 13.4276 13.4276 13.5754 13.5754 14.4796 14.4796 14.7738 14.7738 k = 0.4310 0.4310 0.2460 ( 3378 PWs) bands (ev): -32.1744 -32.1744 -32.1743 -32.1743 -13.3018 -13.3018 -13.2917 -13.2917 -11.9308 -11.9308 -11.9177 -11.9177 -11.8667 -11.8667 -11.8645 -11.8645 -3.2612 -3.2612 -3.0612 -3.0612 -1.6858 -1.6858 -1.6538 -1.6538 3.0768 3.0768 3.3343 3.3343 5.9599 5.9599 6.0894 6.0894 6.7218 6.7218 6.7725 6.7725 7.5489 7.5489 7.6964 7.6964 8.3437 8.3437 8.4102 8.4102 10.9916 10.9916 11.4360 11.4360 13.4028 13.4028 13.5846 13.5846 14.4572 14.4572 14.7774 14.7774 k = 0.4224 0.4224 0.2460 ( 3382 PWs) bands (ev): -32.1746 -32.1746 -32.1745 -32.1745 -13.3015 -13.3015 -13.2902 -13.2902 -11.9305 -11.9305 -11.9155 -11.9155 -11.8662 -11.8662 -11.8639 -11.8639 -3.2955 -3.2955 -3.0449 -3.0449 -1.6858 -1.6858 -1.6454 -1.6454 3.0821 3.0821 3.4050 3.4050 5.9304 5.9304 6.0921 6.0921 6.7246 6.7246 6.7875 6.7875 7.5184 7.5184 7.7004 7.7004 8.3530 8.3530 8.4354 8.4354 10.8715 10.8715 11.4219 11.4219 13.3754 13.3754 13.5892 13.5892 14.4447 14.4447 14.7616 14.7616 k = 0.4138 0.4138 0.2460 ( 3382 PWs) bands (ev): -32.1749 -32.1749 -32.1748 -32.1748 -13.3012 -13.3012 -13.2887 -13.2887 -11.9302 -11.9302 -11.9131 -11.9131 -11.8655 -11.8655 -11.8632 -11.8632 -3.3329 -3.3329 -3.0268 -3.0268 -1.6861 -1.6861 -1.6363 -1.6363 3.0884 3.0884 3.4828 3.4828 5.8984 5.8984 6.0950 6.0950 6.7281 6.7281 6.8042 6.8042 7.4864 7.4864 7.7048 7.7048 8.3630 8.3630 8.4621 8.4621 10.7424 10.7424 11.4065 11.4065 13.3462 13.3462 13.5884 13.5884 14.4418 14.4418 14.7316 14.7316 k = 0.4052 0.4052 0.2460 ( 3378 PWs) bands (ev): -32.1752 -32.1752 -32.1750 -32.1750 -13.3008 -13.3008 -13.2871 -13.2871 -11.9299 -11.9299 -11.9105 -11.9105 -11.8647 -11.8647 -11.8625 -11.8625 -3.3729 -3.3729 -3.0068 -3.0068 -1.6868 -1.6868 -1.6267 -1.6267 3.0958 3.0958 3.5677 3.5677 5.8643 5.8643 6.0984 6.0984 6.7325 6.7325 6.8226 6.8226 7.4532 7.4532 7.7097 7.7097 8.3736 8.3736 8.4900 8.4900 10.6054 10.6054 11.3897 11.3897 13.3161 13.3161 13.5817 13.5817 14.4473 14.4473 14.6978 14.6978 k = 0.3966 0.3966 0.2460 ( 3378 PWs) bands (ev): -32.1756 -32.1756 -32.1753 -32.1753 -13.3003 -13.3003 -13.2855 -13.2855 -11.9295 -11.9295 -11.9077 -11.9077 -11.8639 -11.8639 -11.8616 -11.8616 -3.4154 -3.4154 -2.9850 -2.9850 -1.6880 -1.6880 -1.6167 -1.6167 3.1044 3.1044 3.6592 3.6592 5.8284 5.8284 6.1021 6.1021 6.7379 6.7379 6.8426 6.8426 7.4194 7.4194 7.7150 7.7150 8.3849 8.3849 8.5186 8.5186 10.4616 10.4616 11.3715 11.3715 13.2860 13.2860 13.5697 13.5697 14.4582 14.4582 14.6613 14.6613 k = 0.3879 0.3879 0.2460 ( 3386 PWs) bands (ev): -32.1759 -32.1759 -32.1757 -32.1757 -13.2997 -13.2997 -13.2837 -13.2837 -11.9291 -11.9291 -11.9047 -11.9047 -11.8630 -11.8630 -11.8606 -11.8606 -3.4601 -3.4601 -2.9613 -2.9613 -1.6899 -1.6899 -1.6062 -1.6062 3.1143 3.1143 3.7570 3.7570 5.7910 5.7910 6.1062 6.1062 6.7443 6.7443 6.8644 6.8644 7.3855 7.3855 7.7208 7.7208 8.3968 8.3968 8.5475 8.5475 10.3120 10.3120 11.3522 11.3522 13.2568 13.2568 13.5533 13.5533 14.4705 14.4705 14.6225 14.6225 k = 0.3793 0.3793 0.2460 ( 3390 PWs) bands (ev): -32.1763 -32.1763 -32.1760 -32.1760 -13.2990 -13.2990 -13.2819 -13.2819 -11.9287 -11.9287 -11.9016 -11.9016 -11.8621 -11.8621 -11.8593 -11.8593 -3.5066 -3.5066 -2.9359 -2.9359 -1.6923 -1.6923 -1.5956 -1.5956 3.1255 3.1255 3.8609 3.8609 5.7524 5.7524 6.1107 6.1107 6.7520 6.7520 6.8877 6.8877 7.3518 7.3518 7.7270 7.7270 8.4093 8.4093 8.5762 8.5762 10.1575 10.1575 11.3317 11.3317 13.2295 13.2295 13.5335 13.5335 14.4795 14.4795 14.5811 14.5811 k = 0.3707 0.3707 0.2460 ( 3382 PWs) bands (ev): -32.1767 -32.1767 -32.1764 -32.1764 -13.2982 -13.2982 -13.2800 -13.2800 -11.9283 -11.9283 -11.8983 -11.8983 -11.8612 -11.8612 -11.8577 -11.8577 -3.5549 -3.5549 -2.9086 -2.9086 -1.6956 -1.6956 -1.5848 -1.5848 3.1382 3.1382 3.9704 3.9704 5.7128 5.7128 6.1157 6.1157 6.7608 6.7608 6.9126 6.9126 7.3187 7.3187 7.7335 7.7335 8.4226 8.4226 8.6043 8.6043 9.9992 9.9992 11.3101 11.3101 13.2050 13.2050 13.5116 13.5116 14.4809 14.4809 14.5371 14.5371 k = 0.3621 0.3621 0.2460 ( 3374 PWs) bands (ev): -32.1771 -32.1771 -32.1767 -32.1767 -13.2974 -13.2974 -13.2780 -13.2780 -11.9279 -11.9279 -11.8948 -11.8948 -11.8604 -11.8604 -11.8559 -11.8559 -3.6045 -3.6045 -2.8796 -2.8796 -1.6998 -1.6998 -1.5739 -1.5739 3.1525 3.1525 4.0854 4.0854 5.6727 5.6727 6.1211 6.1211 6.7709 6.7709 6.9390 6.9390 7.2869 7.2869 7.7404 7.7404 8.4367 8.4367 8.6313 8.6313 9.8377 9.8377 11.2875 11.2875 13.1841 13.1841 13.4885 13.4885 14.4713 14.4713 14.4902 14.4902 k = 0.3534 0.3534 0.2460 ( 3370 PWs) bands (ev): -32.1776 -32.1776 -32.1771 -32.1771 -13.2964 -13.2964 -13.2760 -13.2760 -11.9275 -11.9275 -11.8912 -11.8912 -11.8595 -11.8595 -11.8539 -11.8539 -3.6552 -3.6552 -2.8489 -2.8489 -1.7049 -1.7049 -1.5631 -1.5631 3.1684 3.1684 4.2055 4.2055 5.6322 5.6322 6.1270 6.1270 6.7823 6.7823 6.9669 6.9669 7.2565 7.2565 7.7473 7.7473 8.4515 8.4515 8.6570 8.6570 9.6740 9.6740 11.2641 11.2641 13.1675 13.1675 13.4651 13.4651 14.4402 14.4402 14.4497 14.4497 k = 0.3448 0.3448 0.2460 ( 3362 PWs) bands (ev): -32.1780 -32.1780 -32.1775 -32.1775 -13.2954 -13.2954 -13.2739 -13.2739 -11.9272 -11.9272 -11.8874 -11.8874 -11.8585 -11.8585 -11.8516 -11.8516 -3.7070 -3.7070 -2.8164 -2.8164 -1.7111 -1.7111 -1.5525 -1.5525 3.1861 3.1861 4.3304 4.3304 5.5917 5.5917 6.1335 6.1335 6.7951 6.7951 6.9963 6.9963 7.2281 7.2281 7.7542 7.7542 8.4672 8.4672 8.6810 8.6810 9.5089 9.5089 11.2398 11.2398 13.1559 13.1559 13.4421 13.4421 14.3870 14.3870 14.4162 14.4162 k = 0.3362 0.3362 0.2460 ( 3362 PWs) bands (ev): -32.1785 -32.1785 -32.1780 -32.1780 -13.2943 -13.2943 -13.2717 -13.2717 -11.9269 -11.9269 -11.8834 -11.8834 -11.8575 -11.8575 -11.8490 -11.8490 -3.7594 -3.7594 -2.7823 -2.7823 -1.7184 -1.7184 -1.5422 -1.5422 3.2055 3.2055 4.4598 4.4598 5.5513 5.5513 6.1404 6.1404 6.8093 6.8093 7.0269 7.0269 7.2020 7.2020 7.7608 7.7608 8.4838 8.4838 8.7029 8.7029 9.3432 9.3432 11.2147 11.2147 13.1497 13.1497 13.4199 13.4199 14.3302 14.3302 14.3721 14.3721 k = 0.3276 0.3276 0.2460 ( 3354 PWs) bands (ev): -32.1790 -32.1790 -32.1784 -32.1784 -13.2931 -13.2931 -13.2695 -13.2695 -11.9266 -11.9266 -11.8794 -11.8794 -11.8564 -11.8564 -11.8462 -11.8462 -3.8123 -3.8123 -2.7465 -2.7465 -1.7269 -1.7269 -1.5322 -1.5322 3.2267 3.2267 4.5933 4.5933 5.5114 5.5114 6.1479 6.1479 6.8249 6.8249 7.0587 7.0587 7.1786 7.1786 7.7666 7.7666 8.5014 8.5014 8.7224 8.7224 9.1781 9.1781 11.1890 11.1890 13.1494 13.1494 13.3989 13.3989 14.2698 14.2698 14.3189 14.3189 k = 0.3190 0.3190 0.2460 ( 3356 PWs) bands (ev): -32.1795 -32.1795 -32.1789 -32.1789 -13.2919 -13.2919 -13.2673 -13.2673 -11.9264 -11.9264 -11.8753 -11.8753 -11.8553 -11.8553 -11.8432 -11.8432 -3.8656 -3.8656 -2.7091 -2.7091 -1.7366 -1.7366 -1.5227 -1.5227 3.2498 3.2498 4.7307 4.7307 5.4721 5.4721 6.1560 6.1560 6.8420 6.8420 7.0912 7.0912 7.1588 7.1588 7.7708 7.7708 8.5199 8.5199 8.7395 8.7395 9.0148 9.0148 11.1628 11.1628 13.1552 13.1552 13.3793 13.3793 14.2055 14.2055 14.2578 14.2578 k = 0.3103 0.3103 0.2460 ( 3350 PWs) bands (ev): -32.1801 -32.1801 -32.1793 -32.1793 -13.2906 -13.2906 -13.2650 -13.2650 -11.9262 -11.9262 -11.8711 -11.8711 -11.8539 -11.8539 -11.8400 -11.8400 -3.9191 -3.9191 -2.6701 -2.6701 -1.7476 -1.7476 -1.5137 -1.5137 3.2747 3.2747 4.8716 4.8716 5.4336 5.4336 6.1646 6.1646 6.8606 6.8606 7.1209 7.1209 7.1461 7.1461 7.7722 7.7722 8.5393 8.5393 8.7539 8.7539 8.8550 8.8550 11.1360 11.1360 13.1673 13.1673 13.3612 13.3612 14.1373 14.1373 14.1900 14.1900 k = 0.3017 0.3017 0.2460 ( 3360 PWs) bands (ev): -32.1806 -32.1806 -32.1798 -32.1798 -13.2892 -13.2892 -13.2626 -13.2626 -11.9261 -11.9261 -11.8670 -11.8670 -11.8524 -11.8524 -11.8366 -11.8366 -3.9726 -3.9726 -2.6297 -2.6297 -1.7599 -1.7599 -1.5053 -1.5053 3.3014 3.3014 5.0156 5.0156 5.3962 5.3962 6.1739 6.1739 6.8806 6.8806 7.1227 7.1227 7.1662 7.1662 7.7690 7.7690 8.5587 8.5587 8.7020 8.7020 8.7656 8.7656 11.1088 11.1088 13.1856 13.1856 13.3447 13.3447 14.0651 14.0651 14.1163 14.1163 k = 0.2931 0.2931 0.2460 ( 3368 PWs) bands (ev): -32.1812 -32.1812 -32.1803 -32.1803 -13.2878 -13.2878 -13.2603 -13.2603 -11.9259 -11.9259 -11.8631 -11.8631 -11.8504 -11.8504 -11.8329 -11.8329 -4.0259 -4.0259 -2.5877 -2.5877 -1.7735 -1.7735 -1.4977 -1.4977 3.3299 3.3299 5.1622 5.1622 5.3601 5.3601 6.1839 6.1839 6.9021 6.9021 7.1145 7.1145 7.2011 7.2011 7.7577 7.7577 8.5444 8.5444 8.5933 8.5933 8.7746 8.7746 11.0813 11.0813 13.2099 13.2099 13.3300 13.3300 13.9890 13.9890 14.0376 14.0376 k = 0.2845 0.2845 0.2460 ( 3364 PWs) bands (ev): -32.1818 -32.1818 -32.1808 -32.1808 -13.2863 -13.2863 -13.2579 -13.2579 -11.9258 -11.9258 -11.8595 -11.8595 -11.8479 -11.8479 -11.8291 -11.8291 -4.0789 -4.0789 -2.5444 -2.5444 -1.7884 -1.7884 -1.4908 -1.4908 3.3601 3.3601 5.3057 5.3057 5.3308 5.3308 6.1945 6.1945 6.9251 6.9251 7.1095 7.1095 7.2380 7.2380 7.7330 7.7330 8.4221 8.4221 8.6089 8.6089 8.7810 8.7810 11.0535 11.0535 13.2394 13.2394 13.3174 13.3174 13.9090 13.9090 13.9546 13.9546 k = 0.2759 0.2759 0.2460 ( 3360 PWs) bands (ev): -32.1823 -32.1823 -32.1813 -32.1813 -13.2848 -13.2848 -13.2554 -13.2554 -11.9258 -11.9258 -11.8566 -11.8566 -11.8447 -11.8447 -11.8251 -11.8251 -4.1316 -4.1316 -2.4997 -2.4997 -1.8046 -1.8046 -1.4847 -1.4847 3.3920 3.3920 5.2900 5.2900 5.4640 5.4640 6.2058 6.2058 6.9496 6.9496 7.1089 7.1089 7.2759 7.2759 7.6876 7.6876 8.3159 8.3159 8.6325 8.6325 8.7848 8.7848 11.0256 11.0256 13.2708 13.2708 13.3098 13.3098 13.8253 13.8253 13.8680 13.8680 k = 0.2672 0.2672 0.2460 ( 3362 PWs) bands (ev): -32.1829 -32.1829 -32.1819 -32.1819 -13.2833 -13.2833 -13.2529 -13.2529 -11.9258 -11.9258 -11.8542 -11.8542 -11.8409 -11.8409 -11.8209 -11.8209 -4.1836 -4.1836 -2.4537 -2.4537 -1.8220 -1.8220 -1.4794 -1.4794 3.4255 3.4255 5.2580 5.2580 5.6162 5.6162 6.2177 6.2177 6.9756 6.9756 7.1133 7.1133 7.3144 7.3144 7.6150 7.6150 8.2387 8.2387 8.6579 8.6579 8.7863 8.7863 10.9975 10.9975 13.2830 13.2830 13.3275 13.3275 13.7384 13.7384 13.7784 13.7784 k = 0.2586 0.2586 0.2460 ( 3358 PWs) bands (ev): -32.1835 -32.1835 -32.1824 -32.1824 -13.2818 -13.2818 -13.2505 -13.2505 -11.9257 -11.9257 -11.8522 -11.8522 -11.8364 -11.8364 -11.8166 -11.8166 -4.2350 -4.2350 -2.4064 -2.4064 -1.8405 -1.8405 -1.4751 -1.4751 3.4604 3.4604 5.2273 5.2273 5.7693 5.7693 6.2304 6.2304 7.0031 7.0031 7.1232 7.1232 7.3532 7.3532 7.5152 7.5152 8.1916 8.1916 8.6846 8.6846 8.7856 8.7856 10.9694 10.9694 13.2764 13.2764 13.3687 13.3687 13.6486 13.6486 13.6865 13.6865 k = 0.2500 0.2500 0.2460 ( 3358 PWs) bands (ev): -32.1841 -32.1841 -32.1829 -32.1829 -13.2802 -13.2802 -13.2480 -13.2480 -11.9257 -11.9257 -11.8504 -11.8504 -11.8316 -11.8316 -11.8122 -11.8122 -4.2857 -4.2857 -2.3581 -2.3581 -1.8602 -1.8602 -1.4716 -1.4716 3.4966 3.4966 5.1981 5.1981 5.9223 5.9223 6.2437 6.2437 7.0320 7.0320 7.1394 7.1394 7.3799 7.3799 7.4063 7.4063 8.1689 8.1689 8.7126 8.7126 8.7830 8.7830 10.9414 10.9414 13.2676 13.2676 13.4145 13.4145 13.5576 13.5576 13.5932 13.5932 k = 0.2414 0.2414 0.2460 ( 3362 PWs) bands (ev): -32.1847 -32.1847 -32.1834 -32.1834 -13.2786 -13.2786 -13.2455 -13.2455 -11.9258 -11.9258 -11.8488 -11.8488 -11.8266 -11.8266 -11.8076 -11.8076 -4.3355 -4.3355 -2.3087 -2.3087 -1.8809 -1.8809 -1.4691 -1.4691 3.5340 3.5340 5.1704 5.1704 6.0739 6.0739 6.2579 6.2579 7.0623 7.0623 7.1628 7.1628 7.2560 7.2560 7.4347 7.4347 8.1629 8.1629 8.7417 8.7417 8.7789 8.7789 10.9134 10.9134 13.2585 13.2585 13.4377 13.4377 13.4827 13.4827 13.5059 13.5059 k = 0.2328 0.2328 0.2460 ( 3362 PWs) bands (ev): -32.1853 -32.1853 -32.1839 -32.1839 -13.2770 -13.2770 -13.2430 -13.2430 -11.9258 -11.9258 -11.8473 -11.8473 -11.8215 -11.8215 -11.8030 -11.8030 -4.3843 -4.3843 -2.2583 -2.2583 -1.9025 -1.9025 -1.4674 -1.4674 3.5724 3.5724 5.1441 5.1441 6.2222 6.2222 6.2732 6.2732 7.0926 7.0926 7.1149 7.1149 7.1945 7.1945 7.4742 7.4742 8.1679 8.1679 8.7706 8.7706 8.7749 8.7749 10.8856 10.8856 13.2485 13.2485 13.3579 13.3579 13.4007 13.4007 13.5259 13.5259 k = 0.2241 0.2241 0.2460 ( 3356 PWs) bands (ev): -32.1859 -32.1859 -32.1844 -32.1844 -13.2754 -13.2754 -13.2405 -13.2405 -11.9258 -11.9258 -11.8458 -11.8458 -11.8162 -11.8162 -11.7982 -11.7982 -4.4321 -4.4321 -2.2071 -2.2071 -1.9250 -1.9250 -1.4667 -1.4667 3.6117 3.6117 5.1193 5.1193 6.2871 6.2871 6.3678 6.3678 6.9663 6.9663 7.1277 7.1277 7.2362 7.2362 7.5139 7.5139 8.1803 8.1803 8.7669 8.7669 8.8035 8.8035 10.8581 10.8581 13.2306 13.2306 13.2694 13.2694 13.3070 13.3070 13.5141 13.5141 k = 0.2155 0.2155 0.2460 ( 3360 PWs) bands (ev): -32.1865 -32.1865 -32.1849 -32.1849 -13.2738 -13.2738 -13.2380 -13.2380 -11.9258 -11.9258 -11.8443 -11.8443 -11.8109 -11.8109 -11.7934 -11.7934 -4.4787 -4.4787 -2.1552 -2.1552 -1.9481 -1.9481 -1.4668 -1.4668 3.6518 3.6518 5.0959 5.0959 6.3034 6.3034 6.5046 6.5046 6.8184 6.8184 7.1619 7.1619 7.2898 7.2898 7.5534 7.5534 8.1979 8.1979 8.7599 8.7599 8.8357 8.8357 10.8308 10.8308 13.1536 13.1536 13.2112 13.2112 13.2402 13.2402 13.4317 13.4317 k = 0.2069 0.2069 0.2460 ( 3362 PWs) bands (ev): -32.1870 -32.1870 -32.1854 -32.1854 -13.2723 -13.2723 -13.2356 -13.2356 -11.9258 -11.9258 -11.8429 -11.8429 -11.8055 -11.8055 -11.7886 -11.7886 -4.5242 -4.5242 -2.1027 -2.1027 -1.9717 -1.9717 -1.4678 -1.4678 3.6924 3.6924 5.0738 5.0738 6.3199 6.3199 6.6315 6.6315 6.6710 6.6710 7.1974 7.1974 7.3577 7.3577 7.5925 7.5925 8.2195 8.2195 8.7526 8.7526 8.8689 8.8689 10.8038 10.8038 13.0545 13.0545 13.1209 13.1209 13.2276 13.2276 13.3530 13.3530 k = 0.1983 0.1983 0.2460 ( 3366 PWs) bands (ev): -32.1876 -32.1876 -32.1860 -32.1860 -13.2707 -13.2707 -13.2331 -13.2331 -11.9258 -11.9258 -11.8414 -11.8414 -11.8002 -11.8002 -11.7837 -11.7837 -4.5683 -4.5683 -2.0504 -2.0504 -1.9951 -1.9951 -1.4696 -1.4696 3.7333 3.7333 5.0529 5.0529 6.3364 6.3364 6.5245 6.5245 6.7471 6.7471 7.2339 7.2339 7.4415 7.4415 7.6310 7.6310 8.2440 8.2440 8.7454 8.7454 8.9028 8.9028 10.7773 10.7773 12.9531 12.9531 13.0325 13.0325 13.2162 13.2162 13.2789 13.2789 k = 0.1897 0.1897 0.2460 ( 3370 PWs) bands (ev): -32.1882 -32.1882 -32.1865 -32.1865 -13.2692 -13.2692 -13.2307 -13.2307 -11.9258 -11.9258 -11.8400 -11.8400 -11.7949 -11.7949 -11.7788 -11.7788 -4.6111 -4.6111 -2.0238 -2.0238 -1.9927 -1.9927 -1.4721 -1.4721 3.7745 3.7745 5.0331 5.0331 6.3457 6.3457 6.3884 6.3884 6.8489 6.8489 7.2714 7.2714 7.5415 7.5415 7.6688 7.6688 8.2710 8.2710 8.7385 8.7385 8.9375 8.9375 10.7512 10.7512 12.8509 12.8509 12.9475 12.9475 13.1956 13.1956 13.2183 13.2183 k = 0.1810 0.1810 0.2460 ( 3376 PWs) bands (ev): -32.1887 -32.1887 -32.1870 -32.1870 -13.2677 -13.2677 -13.2284 -13.2284 -11.9258 -11.9258 -11.8386 -11.8386 -11.7896 -11.7896 -11.7739 -11.7739 -4.6525 -4.6525 -2.0467 -2.0467 -1.9410 -1.9410 -1.4753 -1.4753 3.8158 3.8158 5.0143 5.0143 6.2332 6.2332 6.3770 6.3770 6.9383 6.9383 7.3097 7.3097 7.6558 7.6558 7.7062 7.7062 8.3000 8.3000 8.7323 8.7323 8.9729 8.9729 10.7257 10.7257 12.7485 12.7485 12.8668 12.8668 13.1379 13.1379 13.1991 13.1991 k = 0.1724 0.1724 0.2460 ( 3370 PWs) bands (ev): -32.1892 -32.1892 -32.1874 -32.1874 -13.2662 -13.2662 -13.2261 -13.2261 -11.9258 -11.9258 -11.8372 -11.8372 -11.7844 -11.7844 -11.7691 -11.7691 -4.6924 -4.6924 -2.0712 -2.0712 -1.8875 -1.8875 -1.4791 -1.4791 3.8571 3.8571 4.9962 4.9962 6.0953 6.0953 6.3947 6.3947 7.0174 7.0174 7.3487 7.3487 7.7390 7.7390 7.7849 7.7849 8.3308 8.3308 8.7271 8.7271 9.0093 9.0093 10.7007 10.7007 12.6463 12.6463 12.7911 12.7911 13.0780 13.0780 13.1864 13.1864 k = 0.1638 0.1638 0.2460 ( 3372 PWs) bands (ev): -32.1898 -32.1898 -32.1879 -32.1879 -13.2648 -13.2648 -13.2238 -13.2238 -11.9258 -11.9258 -11.8358 -11.8358 -11.7793 -11.7793 -11.7643 -11.7643 -4.7308 -4.7308 -2.0958 -2.0958 -1.8340 -1.8340 -1.4835 -1.4835 3.8981 3.8981 4.9788 4.9788 5.9600 5.9600 6.4136 6.4136 7.0891 7.0891 7.3881 7.3881 7.7740 7.7740 7.9177 7.9177 8.3631 8.3631 8.7233 8.7233 9.0469 9.0469 10.6764 10.6764 12.5449 12.5449 12.7211 12.7211 13.0230 13.0230 13.1734 13.1734 k = 0.1552 0.1552 0.2460 ( 3370 PWs) bands (ev): -32.1903 -32.1903 -32.1883 -32.1883 -13.2634 -13.2634 -13.2216 -13.2216 -11.9257 -11.9257 -11.8344 -11.8344 -11.7744 -11.7744 -11.7596 -11.7596 -4.7676 -4.7676 -2.1202 -2.1202 -1.7808 -1.7808 -1.4883 -1.4883 3.9389 3.9389 4.9619 4.9619 5.8284 5.8284 6.4330 6.4330 7.1558 7.1558 7.4277 7.4277 7.8066 7.8066 8.0543 8.0543 8.3966 8.3966 8.7210 8.7210 9.0864 9.0864 10.6528 10.6528 12.4446 12.4446 12.6574 12.6574 12.9737 12.9737 13.1585 13.1585 k = 0.1466 0.1466 0.2460 ( 3386 PWs) bands (ev): -32.1908 -32.1908 -32.1888 -32.1888 -13.2621 -13.2621 -13.2195 -13.2195 -11.9257 -11.9257 -11.8331 -11.8331 -11.7695 -11.7695 -11.7550 -11.7550 -4.8027 -4.8027 -2.1443 -2.1443 -1.7281 -1.7281 -1.4934 -1.4934 3.9793 3.9793 4.9453 4.9453 5.7009 5.7009 6.4527 6.4527 7.2194 7.2194 7.4671 7.4671 7.8375 7.8375 8.1899 8.1899 8.4313 8.4313 8.7206 8.7206 9.1288 9.1288 10.6300 10.6300 12.3457 12.3457 12.6008 12.6008 12.9305 12.9305 13.1296 13.1296 k = 0.1379 0.1379 0.2460 ( 3386 PWs) bands (ev): -32.1912 -32.1912 -32.1892 -32.1892 -13.2609 -13.2609 -13.2175 -13.2175 -11.9256 -11.9256 -11.8318 -11.8318 -11.7648 -11.7648 -11.7505 -11.7505 -4.8361 -4.8361 -2.1678 -2.1678 -1.6762 -1.6762 -1.4989 -1.4989 4.0192 4.0192 4.9288 4.9288 5.5780 5.5780 6.4726 6.4726 7.2813 7.2813 7.5061 7.5061 7.8664 7.8664 8.3197 8.3197 8.4674 8.4674 8.7224 8.7224 9.1759 9.1759 10.6080 10.6080 12.2487 12.2487 12.5520 12.5520 12.8936 12.8936 13.0895 13.0895 k = 0.1293 0.1293 0.2460 ( 3390 PWs) bands (ev): -32.1917 -32.1917 -32.1896 -32.1896 -13.2597 -13.2597 -13.2155 -13.2155 -11.9255 -11.9255 -11.8306 -11.8306 -11.7602 -11.7602 -11.7461 -11.7461 -4.8677 -4.8677 -2.1907 -2.1907 -1.6253 -1.6253 -1.5045 -1.5045 4.0585 4.0585 4.9123 4.9123 5.4601 5.4601 6.4925 6.4925 7.3422 7.3422 7.5442 7.5442 7.8933 7.8933 8.4370 8.4370 8.5063 8.5063 8.7266 8.7266 9.2301 9.2301 10.5869 10.5869 12.1540 12.1540 12.5114 12.5114 12.8634 12.8634 13.0505 13.0505 k = 0.1207 0.1207 0.2460 ( 3386 PWs) bands (ev): -32.1921 -32.1921 -32.1899 -32.1899 -13.2585 -13.2585 -13.2136 -13.2136 -11.9254 -11.9254 -11.8294 -11.8294 -11.7559 -11.7559 -11.7420 -11.7420 -4.8976 -4.8976 -2.2128 -2.2128 -1.5758 -1.5758 -1.5102 -1.5102 4.0973 4.0973 4.8956 4.8956 5.3474 5.3474 6.5122 6.5122 7.4027 7.4027 7.5812 7.5812 7.9182 7.9182 8.5213 8.5213 8.5636 8.5636 8.7335 8.7335 9.2945 9.2945 10.5669 10.5669 12.0620 12.0620 12.4797 12.4797 12.8400 12.8400 13.0140 13.0140 k = 0.1121 0.1121 0.2460 ( 3384 PWs) bands (ev): -32.1925 -32.1925 -32.1903 -32.1903 -13.2574 -13.2574 -13.2119 -13.2119 -11.9254 -11.9254 -11.8282 -11.8282 -11.7518 -11.7518 -11.7380 -11.7380 -4.9255 -4.9255 -2.2340 -2.2340 -1.5287 -1.5287 -1.5150 -1.5150 4.1354 4.1354 4.8787 4.8787 5.2404 5.2404 6.5317 6.5317 7.4629 7.4629 7.6166 7.6166 7.9410 7.9410 8.5651 8.5651 8.6417 8.6417 8.7436 8.7436 9.3715 9.3715 10.5479 10.5479 11.9730 11.9730 12.4573 12.4573 12.8236 12.8236 12.9800 12.9800 k = 0.1034 0.1034 0.2460 ( 3384 PWs) bands (ev): -32.1929 -32.1929 -32.1906 -32.1906 -13.2564 -13.2564 -13.2102 -13.2102 -11.9253 -11.9253 -11.8271 -11.8271 -11.7479 -11.7479 -11.7342 -11.7342 -4.9516 -4.9516 -2.2541 -2.2541 -1.5225 -1.5225 -1.4808 -1.4808 4.1728 4.1728 4.8613 4.8613 5.1394 5.1394 6.5508 6.5508 7.5230 7.5230 7.6501 7.6501 7.9615 7.9615 8.6014 8.6014 8.7043 8.7043 8.7579 8.7579 9.4618 9.4618 10.5301 10.5301 11.8875 11.8875 12.4445 12.4445 12.8142 12.8142 12.9487 12.9487 k = 0.0948 0.0948 0.2460 ( 3392 PWs) bands (ev): -32.1933 -32.1933 -32.1909 -32.1909 -13.2555 -13.2555 -13.2086 -13.2086 -11.9252 -11.9252 -11.8261 -11.8261 -11.7442 -11.7442 -11.7306 -11.7306 -4.9758 -4.9758 -2.2731 -2.2731 -1.5279 -1.5279 -1.4369 -1.4369 4.2095 4.2095 4.8433 4.8433 5.0448 5.0448 6.5694 6.5694 7.5827 7.5827 7.6814 7.6814 7.9800 7.9800 8.6352 8.6352 8.7450 8.7450 8.7778 8.7778 9.5636 9.5636 10.5135 10.5135 11.8060 11.8060 12.4417 12.4417 12.8119 12.8119 12.9200 12.9200 k = 0.0862 0.0862 0.2460 ( 3396 PWs) bands (ev): -32.1936 -32.1936 -32.1912 -32.1912 -13.2547 -13.2547 -13.2072 -13.2072 -11.9251 -11.9251 -11.8252 -11.8252 -11.7408 -11.7408 -11.7272 -11.7272 -4.9980 -4.9980 -2.2908 -2.2908 -1.5333 -1.5333 -1.3952 -1.3952 4.2454 4.2454 4.8247 4.8247 4.9569 4.9569 6.5871 6.5871 7.6418 7.6418 7.7104 7.7104 7.9964 7.9964 8.6668 8.6668 8.7702 8.7702 8.7985 8.7985 9.6729 9.6729 10.4983 10.4983 11.7290 11.7290 12.4488 12.4488 12.8163 12.8163 12.8944 12.8944 k = 0.0776 0.0776 0.2460 ( 3400 PWs) bands (ev): -32.1939 -32.1939 -32.1915 -32.1915 -13.2539 -13.2539 -13.2059 -13.2059 -11.9250 -11.9250 -11.8243 -11.8243 -11.7376 -11.7376 -11.7242 -11.7242 -5.0182 -5.0182 -2.3071 -2.3071 -1.5384 -1.5384 -1.3563 -1.3563 4.2805 4.2805 4.8052 4.8052 4.8763 4.8763 6.6040 6.6040 7.6993 7.6993 7.7375 7.7375 8.0108 8.0108 8.6956 8.6956 8.7902 8.7902 8.8130 8.8130 9.7853 9.7853 10.4845 10.4845 11.6569 11.6569 12.4658 12.4658 12.8264 12.8264 12.8728 12.8728 k = 0.0690 0.0690 0.2460 ( 3396 PWs) bands (ev): -32.1942 -32.1942 -32.1917 -32.1917 -13.2532 -13.2532 -13.2047 -13.2047 -11.9249 -11.9249 -11.8235 -11.8235 -11.7348 -11.7348 -11.7214 -11.7214 -5.0363 -5.0363 -2.3220 -2.3220 -1.5432 -1.5432 -1.3204 -1.3204 4.3146 4.3146 4.7833 4.7833 4.8049 4.8049 6.6197 6.6197 7.7493 7.7493 7.7677 7.7677 8.0233 8.0233 8.7204 8.7204 8.8052 8.8052 8.8242 8.8242 9.8966 9.8966 10.4723 10.4723 11.5902 11.5902 12.4924 12.4924 12.8333 12.8333 12.8641 12.8641 k = 0.0603 0.0603 0.2460 ( 3392 PWs) bands (ev): -32.1944 -32.1944 -32.1919 -32.1919 -13.2526 -13.2526 -13.2036 -13.2036 -11.9248 -11.9248 -11.8228 -11.8228 -11.7323 -11.7323 -11.7189 -11.7189 -5.0524 -5.0524 -2.3353 -2.3353 -1.5476 -1.5476 -1.2878 -1.2878 4.3479 4.3479 4.7344 4.7344 4.7676 4.7676 6.6341 6.6341 7.7761 7.7761 7.8163 7.8163 8.0343 8.0343 8.7390 8.7390 8.8103 8.8103 8.8409 8.8409 10.0032 10.0032 10.4618 10.4618 11.5296 11.5296 12.5281 12.5281 12.8225 12.8225 12.8825 12.8825 k = 0.0517 0.0517 0.2460 ( 3388 PWs) bands (ev): -32.1946 -32.1946 -32.1921 -32.1921 -13.2520 -13.2520 -13.2027 -13.2027 -11.9247 -11.9247 -11.8221 -11.8221 -11.7300 -11.7300 -11.7167 -11.7167 -5.0664 -5.0664 -2.3470 -2.3470 -1.5515 -1.5515 -1.2589 -1.2589 4.3800 4.3800 4.6776 4.6776 4.7457 4.7457 6.6470 6.6470 7.7944 7.7944 7.8674 7.8674 8.0440 8.0440 8.7476 8.7476 8.8132 8.8132 8.8606 8.8606 10.1015 10.1015 10.4533 10.4533 11.4755 11.4755 12.5721 12.5721 12.8077 12.8077 12.9143 12.9143 k = 0.0431 0.0431 0.2460 ( 3388 PWs) bands (ev): -32.1948 -32.1948 -32.1922 -32.1922 -13.2516 -13.2516 -13.2019 -13.2019 -11.9246 -11.9246 -11.8216 -11.8216 -11.7281 -11.7281 -11.7148 -11.7148 -5.0783 -5.0783 -2.3570 -2.3570 -1.5549 -1.5549 -1.2340 -1.2340 4.4107 4.4107 4.6284 4.6284 4.7241 4.7241 6.6583 6.6583 7.8091 7.8091 7.9147 7.9147 8.0529 8.0529 8.7435 8.7435 8.8209 8.8209 8.8798 8.8798 10.1887 10.1887 10.4472 10.4472 11.4286 11.4286 12.6231 12.6231 12.7943 12.7943 12.9536 12.9536 k = 0.0345 0.0345 0.2460 ( 3392 PWs) bands (ev): -32.1949 -32.1949 -32.1924 -32.1924 -13.2512 -13.2512 -13.2012 -13.2012 -11.9245 -11.9245 -11.8211 -11.8211 -11.7266 -11.7266 -11.7132 -11.7132 -5.0880 -5.0880 -2.3653 -2.3653 -1.5578 -1.5578 -1.2131 -1.2131 4.4397 4.4397 4.5879 4.5879 4.7025 4.7025 6.6678 6.6678 7.8209 7.8209 7.9559 7.9559 8.0616 8.0616 8.7309 8.7309 8.8317 8.8317 8.8970 8.8970 10.2615 10.2615 10.4444 10.4444 11.3893 11.3893 12.6787 12.6787 12.7834 12.7834 12.9892 12.9892 k = 0.0259 0.0259 0.2460 ( 3388 PWs) bands (ev): -32.1951 -32.1951 -32.1924 -32.1924 -13.2509 -13.2509 -13.2007 -13.2007 -11.9245 -11.9245 -11.8208 -11.8208 -11.7253 -11.7253 -11.7120 -11.7120 -5.0956 -5.0956 -2.3718 -2.3718 -1.5600 -1.5600 -1.1967 -1.1967 4.4662 4.4662 4.5564 4.5564 4.6816 4.6816 6.6753 6.6753 7.8299 7.8299 7.9884 7.9884 8.0712 8.0712 8.7155 8.7155 8.8421 8.8421 8.9114 8.9114 10.3164 10.3164 10.4461 10.4461 11.3582 11.3582 12.7338 12.7338 12.7767 12.7767 12.9910 12.9910 k = 0.0172 0.0172 0.2460 ( 3396 PWs) bands (ev): -32.1952 -32.1952 -32.1925 -32.1925 -13.2507 -13.2507 -13.2004 -13.2004 -11.9244 -11.9244 -11.8205 -11.8205 -11.7244 -11.7244 -11.7111 -11.7111 -5.1010 -5.1010 -2.3764 -2.3764 -1.5616 -1.5616 -1.1849 -1.1849 4.4882 4.4882 4.5347 4.5347 4.6626 4.6626 6.6808 6.6808 7.8362 7.8362 8.0101 8.0101 8.0817 8.0817 8.7014 8.7014 8.8505 8.8505 8.9222 8.9222 10.3511 10.3511 10.4531 10.4531 11.3356 11.3356 12.7611 12.7611 12.7950 12.7950 12.9977 12.9977 k = 0.0086 0.0086 0.2460 ( 3400 PWs) bands (ev): -32.1952 -32.1952 -32.1926 -32.1926 -13.2505 -13.2505 -13.2001 -13.2001 -11.9244 -11.9244 -11.8204 -11.8204 -11.7239 -11.7239 -11.7106 -11.7106 -5.1043 -5.1043 -2.3792 -2.3792 -1.5626 -1.5626 -1.1777 -1.1777 4.5010 4.5010 4.5250 4.5250 4.6482 4.6482 6.6841 6.6841 7.8400 7.8400 8.0216 8.0216 8.0906 8.0906 8.6915 8.6915 8.8557 8.8557 8.9288 8.9288 10.3677 10.3677 10.4622 10.4622 11.3219 11.3219 12.7601 12.7601 12.8288 12.8288 13.0115 13.0115 k = 0.0000 0.0000 0.2460 ( 3406 PWs) bands (ev): -32.1952 -32.1952 -32.1926 -32.1926 -13.2505 -13.2505 -13.2001 -13.2001 -11.9244 -11.9244 -11.8203 -11.8203 -11.7237 -11.7237 -11.7104 -11.7104 -5.1054 -5.1054 -2.3802 -2.3802 -1.5629 -1.5629 -1.1753 -1.1753 4.5031 4.5031 4.5248 4.5248 4.6425 4.6425 6.6852 6.6852 7.8412 7.8412 8.0250 8.0250 8.0942 8.0942 8.6879 8.6879 8.8575 8.8575 8.9311 8.9311 10.3722 10.3722 10.4663 10.4663 11.3174 11.3174 12.7591 12.7591 12.8415 12.8415 13.0207 13.0207 k = 0.0000 0.5000-0.0000 ( 3362 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2735 -13.2735 -13.2735 -13.2735 -11.9475 -11.9475 -11.9475 -11.9475 -11.7631 -11.7631 -11.7631 -11.7631 -3.5198 -3.5198 -3.5198 -3.5198 -1.4954 -1.4954 -1.4954 -1.4954 4.8419 4.8419 4.8419 4.8419 6.2218 6.2218 6.2218 6.2218 7.0080 7.0080 7.0080 7.0080 7.6270 7.6270 7.6270 7.6270 7.8947 7.8947 7.8947 7.8947 8.4697 8.4697 8.4697 8.4697 13.4322 13.4322 13.4322 13.4322 14.0614 14.0614 14.0614 14.0614 k = 0.0000 0.5000 0.0117 ( 3362 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2735 -13.2735 -13.2735 -13.2735 -11.9475 -11.9475 -11.9475 -11.9475 -11.7631 -11.7631 -11.7631 -11.7631 -3.5198 -3.5198 -3.5198 -3.5198 -1.4955 -1.4955 -1.4955 -1.4955 4.8433 4.8433 4.8433 4.8433 6.2216 6.2216 6.2216 6.2216 7.0066 7.0066 7.0066 7.0066 7.6198 7.6198 7.6198 7.6198 7.8952 7.8952 7.8952 7.8952 8.4786 8.4786 8.4786 8.4786 13.4308 13.4308 13.4308 13.4308 14.0570 14.0570 14.0570 14.0570 k = 0.0000 0.5000 0.0234 ( 3356 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2736 -13.2736 -13.2736 -13.2736 -11.9475 -11.9475 -11.9475 -11.9475 -11.7631 -11.7631 -11.7631 -11.7631 -3.5197 -3.5197 -3.5197 -3.5197 -1.4958 -1.4958 -1.4958 -1.4958 4.8472 4.8472 4.8472 4.8472 6.2211 6.2211 6.2211 6.2211 7.0021 7.0021 7.0021 7.0021 7.5994 7.5994 7.5994 7.5994 7.8966 7.8966 7.8966 7.8966 8.5042 8.5042 8.5042 8.5042 13.4266 13.4266 13.4266 13.4266 14.0443 14.0443 14.0443 14.0443 k = 0.0000 0.5000 0.0351 ( 3358 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2736 -13.2736 -13.2736 -13.2736 -11.9476 -11.9476 -11.9476 -11.9476 -11.7630 -11.7630 -11.7630 -11.7630 -3.5196 -3.5196 -3.5196 -3.5196 -1.4963 -1.4963 -1.4963 -1.4963 4.8538 4.8538 4.8538 4.8538 6.2201 6.2201 6.2201 6.2201 6.9945 6.9945 6.9945 6.9945 7.5685 7.5685 7.5685 7.5685 7.8989 7.8989 7.8989 7.8989 8.5439 8.5439 8.5439 8.5439 13.4198 13.4198 13.4198 13.4198 14.0240 14.0240 14.0240 14.0240 k = 0.0000 0.5000 0.0469 ( 3354 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2736 -13.2736 -13.2736 -13.2736 -11.9476 -11.9476 -11.9476 -11.9476 -11.7629 -11.7629 -11.7629 -11.7629 -3.5194 -3.5194 -3.5194 -3.5194 -1.4969 -1.4969 -1.4969 -1.4969 4.8628 4.8628 4.8628 4.8628 6.2189 6.2189 6.2189 6.2189 6.9833 6.9833 6.9833 6.9833 7.5308 7.5308 7.5308 7.5308 7.9020 7.9020 7.9020 7.9020 8.5945 8.5945 8.5945 8.5945 13.4104 13.4104 13.4104 13.4104 13.9971 13.9971 13.9971 13.9971 k = 0.0000 0.5000 0.0586 ( 3366 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2736 -13.2736 -13.2736 -13.2736 -11.9477 -11.9477 -11.9477 -11.9477 -11.7628 -11.7628 -11.7628 -11.7628 -3.5191 -3.5191 -3.5191 -3.5191 -1.4978 -1.4978 -1.4978 -1.4978 4.8743 4.8743 4.8743 4.8743 6.2173 6.2173 6.2173 6.2173 6.9680 6.9680 6.9680 6.9680 7.4896 7.4896 7.4896 7.4896 7.9059 7.9059 7.9059 7.9059 8.6528 8.6528 8.6528 8.6528 13.3985 13.3985 13.3985 13.3985 13.9649 13.9649 13.9649 13.9649 k = 0.0000 0.5000 0.0703 ( 3360 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2736 -13.2736 -13.2736 -13.2736 -11.9478 -11.9478 -11.9478 -11.9478 -11.7627 -11.7627 -11.7627 -11.7627 -3.5189 -3.5189 -3.5189 -3.5189 -1.4988 -1.4988 -1.4988 -1.4988 4.8880 4.8880 4.8880 4.8880 6.2155 6.2155 6.2155 6.2155 6.9483 6.9483 6.9483 6.9483 7.4480 7.4480 7.4480 7.4480 7.9106 7.9106 7.9106 7.9106 8.7163 8.7163 8.7163 8.7163 13.3844 13.3844 13.3844 13.3844 13.9287 13.9287 13.9287 13.9287 k = 0.0000 0.5000 0.0820 ( 3364 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2737 -13.2737 -13.2737 -13.2737 -11.9479 -11.9479 -11.9479 -11.9479 -11.7625 -11.7625 -11.7625 -11.7625 -3.5186 -3.5186 -3.5186 -3.5186 -1.4999 -1.4999 -1.4999 -1.4999 4.9039 4.9039 4.9039 4.9039 6.2134 6.2134 6.2134 6.2134 6.9237 6.9237 6.9237 6.9237 7.4083 7.4083 7.4083 7.4083 7.9158 7.9158 7.9158 7.9158 8.7829 8.7829 8.7829 8.7829 13.3683 13.3683 13.3683 13.3683 13.8900 13.8900 13.8900 13.8900 k = 0.0000 0.5000 0.0937 ( 3364 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2737 -13.2737 -13.2737 -13.2737 -11.9480 -11.9480 -11.9480 -11.9480 -11.7624 -11.7624 -11.7624 -11.7624 -3.5182 -3.5182 -3.5182 -3.5182 -1.5012 -1.5012 -1.5012 -1.5012 4.9217 4.9217 4.9217 4.9217 6.2112 6.2112 6.2112 6.2112 6.8940 6.8940 6.8940 6.8940 7.3722 7.3722 7.3722 7.3722 7.9215 7.9215 7.9215 7.9215 8.8511 8.8511 8.8511 8.8511 13.3503 13.3503 13.3503 13.3503 13.8499 13.8499 13.8499 13.8499 k = 0.0000 0.5000 0.1054 ( 3366 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2737 -13.2737 -13.2737 -13.2737 -11.9481 -11.9481 -11.9481 -11.9481 -11.7622 -11.7622 -11.7622 -11.7622 -3.5178 -3.5178 -3.5178 -3.5178 -1.5025 -1.5025 -1.5025 -1.5025 4.9411 4.9411 4.9411 4.9411 6.2089 6.2089 6.2089 6.2089 6.8595 6.8595 6.8595 6.8595 7.3407 7.3407 7.3407 7.3407 7.9276 7.9276 7.9276 7.9276 8.9194 8.9194 8.9194 8.9194 13.3309 13.3309 13.3309 13.3309 13.8093 13.8093 13.8093 13.8093 k = 0.0000 0.5000 0.1171 ( 3370 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2738 -13.2738 -13.2738 -13.2738 -11.9482 -11.9482 -11.9482 -11.9482 -11.7620 -11.7620 -11.7620 -11.7620 -3.5175 -3.5175 -3.5175 -3.5175 -1.5038 -1.5038 -1.5038 -1.5038 4.9619 4.9619 4.9619 4.9619 6.2064 6.2064 6.2064 6.2064 6.8210 6.8210 6.8210 6.8210 7.3140 7.3140 7.3140 7.3140 7.9339 7.9339 7.9339 7.9339 8.9867 8.9867 8.9867 8.9867 13.3103 13.3103 13.3103 13.3103 13.7693 13.7693 13.7693 13.7693 k = 0.0000 0.5000 0.1288 ( 3374 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2738 -13.2738 -13.2738 -13.2738 -11.9483 -11.9483 -11.9483 -11.9483 -11.7618 -11.7618 -11.7618 -11.7618 -3.5171 -3.5171 -3.5171 -3.5171 -1.5052 -1.5052 -1.5052 -1.5052 4.9837 4.9837 4.9837 4.9837 6.2040 6.2040 6.2040 6.2040 6.7796 6.7796 6.7796 6.7796 7.2919 7.2919 7.2919 7.2919 7.9403 7.9403 7.9403 7.9403 9.0521 9.0521 9.0521 9.0521 13.2888 13.2888 13.2888 13.2888 13.7305 13.7305 13.7305 13.7305 k = 0.0000 0.5000 0.1406 ( 3370 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2738 -13.2738 -13.2738 -13.2738 -11.9484 -11.9484 -11.9484 -11.9484 -11.7617 -11.7617 -11.7617 -11.7617 -3.5167 -3.5167 -3.5167 -3.5167 -1.5065 -1.5065 -1.5065 -1.5065 5.0061 5.0061 5.0061 5.0061 6.2016 6.2016 6.2016 6.2016 6.7365 6.7365 6.7365 6.7365 7.2739 7.2739 7.2739 7.2739 7.9466 7.9466 7.9466 7.9466 9.1146 9.1146 9.1146 9.1146 13.2669 13.2669 13.2669 13.2669 13.6938 13.6938 13.6938 13.6938 k = 0.0000 0.5000 0.1523 ( 3362 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2739 -13.2739 -13.2739 -13.2739 -11.9485 -11.9485 -11.9485 -11.9485 -11.7615 -11.7615 -11.7615 -11.7615 -3.5163 -3.5163 -3.5163 -3.5163 -1.5078 -1.5078 -1.5078 -1.5078 5.0286 5.0286 5.0286 5.0286 6.1993 6.1993 6.1993 6.1993 6.6933 6.6933 6.6933 6.6933 7.2595 7.2595 7.2595 7.2595 7.9527 7.9527 7.9527 7.9527 9.1733 9.1733 9.1733 9.1733 13.2451 13.2451 13.2451 13.2451 13.6595 13.6595 13.6595 13.6595 k = 0.0000 0.5000 0.1640 ( 3358 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2739 -13.2739 -13.2739 -13.2739 -11.9486 -11.9486 -11.9486 -11.9486 -11.7614 -11.7614 -11.7614 -11.7614 -3.5160 -3.5160 -3.5160 -3.5160 -1.5091 -1.5091 -1.5091 -1.5091 5.0508 5.0508 5.0508 5.0508 6.1971 6.1971 6.1971 6.1971 6.6512 6.6512 6.6512 6.6512 7.2479 7.2479 7.2479 7.2479 7.9584 7.9584 7.9584 7.9584 9.2274 9.2274 9.2274 9.2274 13.2239 13.2239 13.2239 13.2239 13.6283 13.6283 13.6283 13.6283 k = 0.0000 0.5000 0.1757 ( 3358 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2739 -13.2739 -13.2739 -13.2739 -11.9487 -11.9487 -11.9487 -11.9487 -11.7612 -11.7612 -11.7612 -11.7612 -3.5157 -3.5157 -3.5157 -3.5157 -1.5102 -1.5102 -1.5102 -1.5102 5.0719 5.0719 5.0719 5.0719 6.1951 6.1951 6.1951 6.1951 6.6116 6.6116 6.6116 6.6116 7.2387 7.2387 7.2387 7.2387 7.9637 7.9637 7.9637 7.9637 9.2762 9.2762 9.2762 9.2762 13.2039 13.2039 13.2039 13.2039 13.6004 13.6004 13.6004 13.6004 k = 0.0000 0.5000 0.1874 ( 3374 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2739 -13.2739 -13.2739 -13.2739 -11.9488 -11.9488 -11.9488 -11.9488 -11.7611 -11.7611 -11.7611 -11.7611 -3.5154 -3.5154 -3.5154 -3.5154 -1.5112 -1.5112 -1.5112 -1.5112 5.0915 5.0915 5.0915 5.0915 6.1934 6.1934 6.1934 6.1934 6.5756 6.5756 6.5756 6.5756 7.2315 7.2315 7.2315 7.2315 7.9684 7.9684 7.9684 7.9684 9.3189 9.3189 9.3189 9.3189 13.1856 13.1856 13.1856 13.1856 13.5763 13.5763 13.5763 13.5763 k = 0.0000 0.5000 0.1991 ( 3380 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2740 -13.2740 -13.2740 -13.2740 -11.9489 -11.9489 -11.9489 -11.9489 -11.7610 -11.7610 -11.7610 -11.7610 -3.5152 -3.5152 -3.5152 -3.5152 -1.5120 -1.5120 -1.5120 -1.5120 5.1087 5.1087 5.1087 5.1087 6.1919 6.1919 6.1919 6.1919 6.5445 6.5445 6.5445 6.5445 7.2260 7.2260 7.2260 7.2260 7.9723 7.9723 7.9723 7.9723 9.3549 9.3549 9.3549 9.3549 13.1696 13.1696 13.1696 13.1696 13.5563 13.5563 13.5563 13.5563 k = 0.0000 0.5000 0.2108 ( 3384 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2740 -13.2740 -13.2740 -13.2740 -11.9489 -11.9489 -11.9489 -11.9489 -11.7609 -11.7609 -11.7609 -11.7609 -3.5150 -3.5150 -3.5150 -3.5150 -1.5127 -1.5127 -1.5127 -1.5127 5.1230 5.1230 5.1230 5.1230 6.1907 6.1907 6.1907 6.1907 6.5191 6.5191 6.5191 6.5191 7.2219 7.2219 7.2219 7.2219 7.9755 7.9755 7.9755 7.9755 9.3835 9.3835 9.3835 9.3835 13.1566 13.1566 13.1566 13.1566 13.5404 13.5404 13.5404 13.5404 k = 0.0000 0.5000 0.2226 ( 3376 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2740 -13.2740 -13.2740 -13.2740 -11.9490 -11.9490 -11.9490 -11.9490 -11.7608 -11.7608 -11.7608 -11.7608 -3.5148 -3.5148 -3.5148 -3.5148 -1.5132 -1.5132 -1.5132 -1.5132 5.1337 5.1337 5.1337 5.1337 6.1898 6.1898 6.1898 6.1898 6.5003 6.5003 6.5003 6.5003 7.2191 7.2191 7.2191 7.2191 7.9779 7.9779 7.9779 7.9779 9.4044 9.4044 9.4044 9.4044 13.1469 13.1469 13.1469 13.1469 13.5290 13.5290 13.5290 13.5290 k = 0.0000 0.5000 0.2343 ( 3372 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2740 -13.2740 -13.2740 -13.2740 -11.9490 -11.9490 -11.9490 -11.9490 -11.7608 -11.7608 -11.7608 -11.7608 -3.5148 -3.5148 -3.5148 -3.5148 -1.5135 -1.5135 -1.5135 -1.5135 5.1404 5.1404 5.1404 5.1404 6.1892 6.1892 6.1892 6.1892 6.4887 6.4887 6.4887 6.4887 7.2175 7.2175 7.2175 7.2175 7.9793 7.9793 7.9793 7.9793 9.4170 9.4170 9.4170 9.4170 13.1409 13.1409 13.1409 13.1409 13.5221 13.5221 13.5221 13.5221 k = 0.0000 0.5000 0.2460 ( 3368 PWs) bands (ev): -32.1834 -32.1834 -32.1834 -32.1834 -13.2740 -13.2740 -13.2740 -13.2740 -11.9490 -11.9490 -11.9490 -11.9490 -11.7608 -11.7608 -11.7608 -11.7608 -3.5147 -3.5147 -3.5147 -3.5147 -1.5136 -1.5136 -1.5136 -1.5136 5.1426 5.1426 5.1426 5.1426 6.1891 6.1891 6.1891 6.1891 6.4848 6.4848 6.4848 6.4848 7.2169 7.2169 7.2169 7.2169 7.9798 7.9798 7.9798 7.9798 9.4213 9.4213 9.4213 9.4213 13.1389 13.1389 13.1389 13.1389 13.5198 13.5198 13.5198 13.5198 k = 0.5000 0.5000-0.0000 ( 3340 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9304 -11.9304 -11.9304 -11.9304 -11.8659 -11.8659 -11.8659 -11.8659 -3.1235 -3.1235 -3.1235 -3.1235 -1.7028 -1.7028 -1.7028 -1.7028 3.1670 3.1670 3.1670 3.1670 6.1258 6.1258 6.1258 6.1258 6.5630 6.5630 6.5630 6.5630 7.8486 7.8486 7.8486 7.8486 7.9291 7.9291 7.9291 7.9291 11.4900 11.4900 11.4900 11.4900 14.5301 14.5301 14.5301 14.5301 14.6021 14.6021 14.6021 14.6021 k = 0.5000 0.5000 0.0117 ( 3344 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9304 -11.9304 -11.9304 -11.9304 -11.8659 -11.8659 -11.8659 -11.8659 -3.1235 -3.1235 -3.1235 -3.1235 -1.7028 -1.7028 -1.7028 -1.7028 3.1664 3.1664 3.1664 3.1664 6.1255 6.1255 6.1255 6.1255 6.5639 6.5639 6.5639 6.5639 7.8479 7.8479 7.8479 7.8479 7.9309 7.9309 7.9309 7.9309 11.4900 11.4900 11.4900 11.4900 14.5314 14.5314 14.5314 14.5314 14.5985 14.5985 14.5985 14.5985 k = 0.5000 0.5000 0.0234 ( 3344 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9304 -11.9304 -11.9304 -11.9304 -11.8659 -11.8659 -11.8659 -11.8659 -3.1235 -3.1235 -3.1235 -3.1235 -1.7025 -1.7025 -1.7025 -1.7025 3.1645 3.1645 3.1645 3.1645 6.1246 6.1246 6.1246 6.1246 6.5663 6.5663 6.5663 6.5663 7.8456 7.8456 7.8456 7.8456 7.9365 7.9365 7.9365 7.9365 11.4900 11.4900 11.4900 11.4900 14.5343 14.5343 14.5343 14.5343 14.5879 14.5879 14.5879 14.5879 k = 0.5000 0.5000 0.0351 ( 3344 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9303 -11.9303 -11.9303 -11.9303 -11.8660 -11.8660 -11.8660 -11.8660 -3.1235 -3.1235 -3.1235 -3.1235 -1.7021 -1.7021 -1.7021 -1.7021 3.1615 3.1615 3.1615 3.1615 6.1231 6.1231 6.1231 6.1231 6.5704 6.5704 6.5704 6.5704 7.8417 7.8417 7.8417 7.8417 7.9458 7.9458 7.9458 7.9458 11.4900 11.4900 11.4900 11.4900 14.5323 14.5323 14.5323 14.5323 14.5747 14.5747 14.5747 14.5747 k = 0.5000 0.5000 0.0469 ( 3332 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9303 -11.9303 -11.9303 -11.9303 -11.8660 -11.8660 -11.8660 -11.8660 -3.1235 -3.1235 -3.1235 -3.1235 -1.7016 -1.7016 -1.7016 -1.7016 3.1574 3.1574 3.1574 3.1574 6.1210 6.1210 6.1210 6.1210 6.5759 6.5759 6.5759 6.5759 7.8363 7.8363 7.8363 7.8363 7.9587 7.9587 7.9587 7.9587 11.4900 11.4900 11.4900 11.4900 14.5073 14.5073 14.5073 14.5073 14.5748 14.5748 14.5748 14.5748 k = 0.5000 0.5000 0.0586 ( 3324 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9302 -11.9302 -11.9302 -11.9302 -11.8661 -11.8661 -11.8661 -11.8661 -3.1234 -3.1234 -3.1234 -3.1234 -1.7009 -1.7009 -1.7009 -1.7009 3.1522 3.1522 3.1522 3.1522 6.1185 6.1185 6.1185 6.1185 6.5828 6.5828 6.5828 6.5828 7.8292 7.8292 7.8292 7.8292 7.9750 7.9750 7.9750 7.9750 11.4900 11.4900 11.4900 11.4900 14.4586 14.4586 14.4586 14.4586 14.5873 14.5873 14.5873 14.5873 k = 0.5000 0.5000 0.0703 ( 3340 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9301 -11.9301 -11.9301 -11.9301 -11.8662 -11.8662 -11.8662 -11.8662 -3.1234 -3.1234 -3.1234 -3.1234 -1.7001 -1.7001 -1.7001 -1.7001 3.1462 3.1462 3.1462 3.1462 6.1156 6.1156 6.1156 6.1156 6.5909 6.5909 6.5909 6.5909 7.8208 7.8208 7.8208 7.8208 7.9944 7.9944 7.9944 7.9944 11.4901 11.4901 11.4901 11.4901 14.3945 14.3945 14.3945 14.3945 14.6053 14.6053 14.6053 14.6053 k = 0.5000 0.5000 0.0820 ( 3352 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9301 -11.9301 -11.9301 -11.9301 -11.8663 -11.8663 -11.8663 -11.8663 -3.1234 -3.1234 -3.1234 -3.1234 -1.6992 -1.6992 -1.6992 -1.6992 3.1394 3.1394 3.1394 3.1394 6.1125 6.1125 6.1125 6.1125 6.6001 6.6001 6.6001 6.6001 7.8111 7.8111 7.8111 7.8111 8.0166 8.0166 8.0166 8.0166 11.4901 11.4901 11.4901 11.4901 14.3196 14.3196 14.3196 14.3196 14.6265 14.6265 14.6265 14.6265 k = 0.5000 0.5000 0.0937 ( 3352 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9300 -11.9300 -11.9300 -11.9300 -11.8664 -11.8664 -11.8664 -11.8664 -3.1233 -3.1233 -3.1233 -3.1233 -1.6982 -1.6982 -1.6982 -1.6982 3.1321 3.1321 3.1321 3.1321 6.1092 6.1092 6.1092 6.1092 6.6101 6.6101 6.6101 6.6101 7.8003 7.8003 7.8003 7.8003 8.0410 8.0410 8.0410 8.0410 11.4901 11.4901 11.4901 11.4901 14.2381 14.2381 14.2381 14.2381 14.6500 14.6500 14.6500 14.6500 k = 0.5000 0.5000 0.1054 ( 3352 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9299 -11.9299 -11.9299 -11.9299 -11.8665 -11.8665 -11.8665 -11.8665 -3.1233 -3.1233 -3.1233 -3.1233 -1.6972 -1.6972 -1.6972 -1.6972 3.1244 3.1244 3.1244 3.1244 6.1057 6.1057 6.1057 6.1057 6.6207 6.6207 6.6207 6.6207 7.7887 7.7887 7.7887 7.7887 8.0672 8.0672 8.0672 8.0672 11.4901 11.4901 11.4901 11.4901 14.1532 14.1532 14.1532 14.1532 14.6746 14.6746 14.6746 14.6747 k = 0.5000 0.5000 0.1171 ( 3344 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2999 -13.2999 -13.2999 -13.2999 -11.9298 -11.9298 -11.9298 -11.9298 -11.8666 -11.8666 -11.8666 -11.8666 -3.1232 -3.1232 -3.1232 -3.1232 -1.6961 -1.6961 -1.6961 -1.6961 3.1164 3.1164 3.1164 3.1164 6.1023 6.1023 6.1023 6.1023 6.6318 6.6318 6.6318 6.6318 7.7765 7.7765 7.7765 7.7765 8.0946 8.0946 8.0946 8.0946 11.4902 11.4902 11.4902 11.4902 14.0677 14.0677 14.0677 14.0677 14.6989 14.6989 14.6989 14.6989 k = 0.5000 0.5000 0.1288 ( 3368 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2999 -13.2999 -13.2999 -13.2999 -11.9297 -11.9297 -11.9297 -11.9297 -11.8668 -11.8668 -11.8668 -11.8668 -3.1232 -3.1232 -3.1232 -3.1232 -1.6950 -1.6950 -1.6950 -1.6950 3.1084 3.1084 3.1084 3.1084 6.0989 6.0989 6.0989 6.0989 6.6431 6.6431 6.6431 6.6431 7.7640 7.7640 7.7640 7.7640 8.1226 8.1226 8.1226 8.1226 11.4902 11.4902 11.4902 11.4902 13.9836 13.9836 13.9836 13.9836 14.7199 14.7199 14.7199 14.7199 k = 0.5000 0.5000 0.1406 ( 3376 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2999 -13.2999 -13.2999 -13.2999 -11.9296 -11.9296 -11.9296 -11.9296 -11.8669 -11.8669 -11.8669 -11.8669 -3.1231 -3.1231 -3.1231 -3.1231 -1.6940 -1.6940 -1.6940 -1.6940 3.1005 3.1005 3.1005 3.1005 6.0956 6.0956 6.0956 6.0956 6.6543 6.6543 6.6543 6.6543 7.7514 7.7514 7.7514 7.7514 8.1507 8.1507 8.1507 8.1507 11.4902 11.4902 11.4902 11.4902 13.9028 13.9028 13.9028 13.9028 14.7337 14.7337 14.7337 14.7337 k = 0.5000 0.5000 0.1523 ( 3380 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2999 -13.2999 -13.2999 -13.2999 -11.9295 -11.9295 -11.9295 -11.9295 -11.8670 -11.8670 -11.8670 -11.8670 -3.1231 -3.1231 -3.1231 -3.1231 -1.6929 -1.6929 -1.6929 -1.6929 3.0929 3.0929 3.0929 3.0929 6.0925 6.0925 6.0925 6.0925 6.6653 6.6653 6.6653 6.6653 7.7391 7.7391 7.7391 7.7391 8.1780 8.1780 8.1780 8.1780 11.4902 11.4902 11.4902 11.4902 13.8267 13.8267 13.8267 13.8267 14.7405 14.7405 14.7405 14.7405 k = 0.5000 0.5000 0.1640 ( 3380 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2998 -13.2998 -13.2998 -13.2998 -11.9294 -11.9294 -11.9294 -11.9294 -11.8671 -11.8671 -11.8671 -11.8671 -3.1230 -3.1230 -3.1230 -3.1230 -1.6919 -1.6919 -1.6919 -1.6919 3.0857 3.0857 3.0857 3.0857 6.0897 6.0897 6.0897 6.0897 6.6758 6.6758 6.6758 6.6758 7.7273 7.7273 7.7273 7.7273 8.2041 8.2041 8.2041 8.2041 11.4903 11.4903 11.4903 11.4903 13.7566 13.7566 13.7566 13.7566 14.7435 14.7435 14.7435 14.7435 k = 0.5000 0.5000 0.1757 ( 3380 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2998 -13.2998 -13.2998 -13.2998 -11.9293 -11.9293 -11.9293 -11.9293 -11.8672 -11.8672 -11.8672 -11.8672 -3.1230 -3.1230 -3.1230 -3.1230 -1.6910 -1.6910 -1.6910 -1.6910 3.0792 3.0792 3.0792 3.0792 6.0872 6.0872 6.0872 6.0872 6.6855 6.6855 6.6855 6.6855 7.7163 7.7163 7.7163 7.7163 8.2282 8.2282 8.2282 8.2282 11.4903 11.4903 11.4903 11.4903 13.6936 13.6936 13.6936 13.6936 14.7450 14.7450 14.7450 14.7450 k = 0.5000 0.5000 0.1874 ( 3388 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2998 -13.2998 -13.2998 -13.2998 -11.9292 -11.9292 -11.9292 -11.9292 -11.8673 -11.8673 -11.8673 -11.8673 -3.1229 -3.1229 -3.1229 -3.1229 -1.6902 -1.6902 -1.6902 -1.6902 3.0735 3.0735 3.0735 3.0735 6.0850 6.0850 6.0850 6.0850 6.6942 6.6942 6.6942 6.6942 7.7065 7.7065 7.7065 7.7065 8.2499 8.2499 8.2499 8.2499 11.4903 11.4903 11.4903 11.4903 13.6386 13.6386 13.6386 13.6386 14.7459 14.7459 14.7459 14.7459 k = 0.5000 0.5000 0.1991 ( 3380 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2998 -13.2998 -13.2998 -13.2998 -11.9292 -11.9292 -11.9292 -11.9292 -11.8674 -11.8674 -11.8674 -11.8674 -3.1229 -3.1229 -3.1229 -3.1229 -1.6895 -1.6895 -1.6895 -1.6895 3.0686 3.0686 3.0686 3.0686 6.0831 6.0831 6.0831 6.0831 6.7016 6.7016 6.7016 6.7016 7.6980 7.6980 7.6980 7.6980 8.2684 8.2684 8.2684 8.2684 11.4903 11.4903 11.4903 11.4903 13.5925 13.5925 13.5925 13.5925 14.7464 14.7464 14.7464 14.7464 k = 0.5000 0.5000 0.2108 ( 3372 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2998 -13.2998 -13.2998 -13.2998 -11.9291 -11.9291 -11.9291 -11.9291 -11.8675 -11.8675 -11.8675 -11.8675 -3.1229 -3.1229 -3.1229 -3.1229 -1.6890 -1.6890 -1.6890 -1.6890 3.0647 3.0647 3.0647 3.0647 6.0817 6.0817 6.0817 6.0817 6.7077 6.7077 6.7077 6.7077 7.6911 7.6911 7.6911 7.6911 8.2834 8.2834 8.2834 8.2834 11.4904 11.4904 11.4904 11.4904 13.5559 13.5559 13.5559 13.5559 14.7468 14.7468 14.7468 14.7468 k = 0.5000 0.5000 0.2226 ( 3368 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2998 -13.2998 -13.2998 -13.2998 -11.9291 -11.9291 -11.9291 -11.9291 -11.8675 -11.8675 -11.8675 -11.8675 -3.1229 -3.1229 -3.1229 -3.1229 -1.6886 -1.6886 -1.6886 -1.6886 3.0619 3.0619 3.0619 3.0619 6.0806 6.0806 6.0806 6.0806 6.7121 6.7121 6.7121 6.7121 7.6860 7.6860 7.6860 7.6860 8.2944 8.2944 8.2944 8.2944 11.4904 11.4904 11.4904 11.4904 13.5294 13.5294 13.5294 13.5294 14.7470 14.7470 14.7470 14.7470 k = 0.5000 0.5000 0.2343 ( 3368 PWs) bands (ev): -32.1734 -32.1734 -32.1734 -32.1734 -13.2998 -13.2998 -13.2998 -13.2998 -11.9290 -11.9290 -11.9290 -11.9290 -11.8675 -11.8675 -11.8675 -11.8675 -3.1228 -3.1228 -3.1228 -3.1228 -1.6883 -1.6883 -1.6883 -1.6883 3.0602 3.0602 3.0602 3.0602 6.0800 6.0800 6.0800 6.0800 6.7149 6.7149 6.7149 6.7149 7.6829 7.6829 7.6829 7.6829 8.3012 8.3012 8.3012 8.3012 11.4904 11.4904 11.4904 11.4904 13.5133 13.5133 13.5133 13.5133 14.7472 14.7472 14.7472 14.7472 k = 0.5000 0.5000 0.2460 ( 3360 PWs) bands (ev): -32.1733 -32.1733 -32.1733 -32.1733 -13.2998 -13.2998 -13.2998 -13.2998 -11.9290 -11.9290 -11.9290 -11.9290 -11.8675 -11.8675 -11.8675 -11.8675 -3.1228 -3.1228 -3.1228 -3.1228 -1.6883 -1.6883 -1.6883 -1.6883 3.0596 3.0596 3.0596 3.0596 6.0797 6.0797 6.0797 6.0797 6.7158 6.7158 6.7158 6.7158 7.6819 7.6819 7.6819 7.6819 8.3034 8.3034 8.3034 8.3034 11.4904 11.4904 11.4904 11.4904 13.5079 13.5079 13.5079 13.5079 14.7472 14.7472 14.7472 14.7472 Writing output data file YS2.save init_run : 0.23s CPU 0.39s WALL ( 1 calls) electrons : 185.32s CPU 188.26s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 185.31s CPU 188.25s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.00s WALL ( 1 calls) newd : 0.08s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.05s WALL ( 352 calls) cegterg : 170.23s CPU 172.64s WALL ( 636 calls) Called by sum_band: Called by *egterg: h_psi : 80.82s CPU 82.49s WALL ( 9386 calls) s_psi : 9.30s CPU 9.21s WALL ( 9386 calls) g_psi : 0.25s CPU 0.21s WALL ( 8398 calls) cdiaghg : 73.63s CPU 74.60s WALL ( 8750 calls) cegterg:over : 6.66s CPU 6.75s WALL ( 8398 calls) cegterg:upda : 5.82s CPU 5.76s WALL ( 8398 calls) cegterg:last : 2.94s CPU 2.95s WALL ( 1344 calls) cdiaghg:chol : 4.13s CPU 4.19s WALL ( 8750 calls) cdiaghg:inve : 2.93s CPU 2.89s WALL ( 8750 calls) cdiaghg:para : 4.64s CPU 4.72s WALL ( 17500 calls) Called by h_psi: h_psi:vloc : 61.09s CPU 62.43s WALL ( 9386 calls) h_psi:vnl : 19.49s CPU 19.81s WALL ( 9386 calls) add_vuspsi : 10.98s CPU 11.12s WALL ( 9386 calls) General routines calbec : 8.49s CPU 8.67s WALL ( 9386 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 57.12s CPU 58.22s WALL ( 998300 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.21s CPU 0.22s WALL ( 704 calls) Parallel routines fft_scatter : 24.43s CPU 25.05s WALL ( 998323 calls) PWSCF : 3m21.29s CPU 3m42.44s WALL This run was terminated on: 21:14:48 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=