Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:10:54 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: ./FeNi.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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 12 9 3 266 177 31 Max 13 10 4 272 190 37 Sum 437 341 109 9709 6569 1245 bravais-lattice index = 14 lattice parameter (alat) = 4.7867 a.u. unit-cell volume = 155.0931 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 number of electrons = 18.00 number of Kohn-Sham states= 26 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 4.786676 celldm(2)= 1.000000 celldm(3)= 1.414133 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.414133 ) 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 0.707147 ) PseudoPot. # 1 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 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 Fe 8.00 55.84500 Fe( 1.00) Ni 10.00 58.69340 Ni( 1.00) 16 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 569 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017575 k( 2) = ( 0.0000000 0.0079365 -0.0000000), wk = 0.0017575 k( 3) = ( 0.0000000 0.0158730 -0.0000000), wk = 0.0017575 k( 4) = ( 0.0000000 0.0238095 -0.0000000), wk = 0.0017575 k( 5) = ( 0.0000000 0.0317460 -0.0000000), wk = 0.0017575 k( 6) = ( 0.0000000 0.0396825 -0.0000000), wk = 0.0017575 k( 7) = ( 0.0000000 0.0476191 -0.0000000), wk = 0.0017575 k( 8) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0017575 k( 9) = ( 0.0000000 0.0634921 -0.0000000), wk = 0.0017575 k( 10) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0017575 k( 11) = ( 0.0000000 0.0793651 -0.0000000), wk = 0.0017575 k( 12) = ( 0.0000000 0.0873016 -0.0000000), wk = 0.0017575 k( 13) = ( 0.0000000 0.0952381 -0.0000000), wk = 0.0017575 k( 14) = ( 0.0000000 0.1031746 -0.0000000), wk = 0.0017575 k( 15) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0017575 k( 16) = ( 0.0000000 0.1190476 -0.0000000), wk = 0.0017575 k( 17) = ( 0.0000000 0.1269841 -0.0000000), wk = 0.0017575 k( 18) = ( 0.0000000 0.1349206 -0.0000000), wk = 0.0017575 k( 19) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0017575 k( 20) = ( 0.0000000 0.1507937 -0.0000000), wk = 0.0017575 k( 21) = ( 0.0000000 0.1587302 -0.0000000), wk = 0.0017575 k( 22) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0017575 k( 23) = ( 0.0000000 0.1746032 -0.0000000), wk = 0.0017575 k( 24) = ( 0.0000000 0.1825397 -0.0000000), wk = 0.0017575 k( 25) = ( 0.0000000 0.1904762 -0.0000000), wk = 0.0017575 k( 26) = ( 0.0000000 0.1984127 -0.0000000), wk = 0.0017575 k( 27) = ( 0.0000000 0.2063492 -0.0000000), wk = 0.0017575 k( 28) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0017575 k( 29) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0017575 k( 30) = ( 0.0000000 0.2301587 -0.0000000), wk = 0.0017575 k( 31) = ( 0.0000000 0.2380952 -0.0000000), wk = 0.0017575 k( 32) = ( 0.0000000 0.2460317 -0.0000000), wk = 0.0017575 k( 33) = ( 0.0000000 0.2539683 -0.0000000), wk = 0.0017575 k( 34) = ( 0.0000000 0.2619048 -0.0000000), wk = 0.0017575 k( 35) = ( 0.0000000 0.2698413 -0.0000000), wk = 0.0017575 k( 36) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0017575 k( 37) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0017575 k( 38) = ( 0.0000000 0.2936508 -0.0000000), wk = 0.0017575 k( 39) = ( 0.0000000 0.3015873 -0.0000000), wk = 0.0017575 k( 40) = ( 0.0000000 0.3095238 -0.0000000), wk = 0.0017575 k( 41) = ( 0.0000000 0.3174603 -0.0000000), wk = 0.0017575 k( 42) = ( 0.0000000 0.3253968 -0.0000000), wk = 0.0017575 k( 43) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0017575 k( 44) = ( 0.0000000 0.3412698 -0.0000000), wk = 0.0017575 k( 45) = ( 0.0000000 0.3492063 -0.0000000), wk = 0.0017575 k( 46) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0017575 k( 47) = ( 0.0000000 0.3650794 -0.0000000), wk = 0.0017575 k( 48) = ( 0.0000000 0.3730159 -0.0000000), wk = 0.0017575 k( 49) = ( 0.0000000 0.3809524 -0.0000000), wk = 0.0017575 k( 50) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0017575 k( 51) = ( 0.0000000 0.3968254 -0.0000000), wk = 0.0017575 k( 52) = ( 0.0000000 0.4047619 -0.0000000), wk = 0.0017575 k( 53) = ( 0.0000000 0.4126984 -0.0000000), wk = 0.0017575 k( 54) = ( 0.0000000 0.4206349 -0.0000000), wk = 0.0017575 k( 55) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0017575 k( 56) = ( 0.0000000 0.4365079 -0.0000000), wk = 0.0017575 k( 57) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0017575 k( 58) = ( 0.0000000 0.4523810 -0.0000000), wk = 0.0017575 k( 59) = ( 0.0000000 0.4603175 -0.0000000), wk = 0.0017575 k( 60) = ( 0.0000000 0.4682540 -0.0000000), wk = 0.0017575 k( 61) = ( 0.0000000 0.4761905 -0.0000000), wk = 0.0017575 k( 62) = ( 0.0000000 0.4841270 -0.0000000), wk = 0.0017575 k( 63) = ( 0.0000000 0.4920635 -0.0000000), wk = 0.0017575 k( 64) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017575 k( 65) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017575 k( 66) = ( 0.0079365 0.5000000 -0.0000000), wk = 0.0017575 k( 67) = ( 0.0158730 0.5000000 -0.0000000), wk = 0.0017575 k( 68) = ( 0.0238095 0.5000000 -0.0000000), wk = 0.0017575 k( 69) = ( 0.0317460 0.5000000 -0.0000000), wk = 0.0017575 k( 70) = ( 0.0396825 0.5000000 -0.0000000), wk = 0.0017575 k( 71) = ( 0.0476191 0.5000000 -0.0000000), wk = 0.0017575 k( 72) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0017575 k( 73) = ( 0.0634921 0.5000000 -0.0000000), wk = 0.0017575 k( 74) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0017575 k( 75) = ( 0.0793651 0.5000000 -0.0000000), wk = 0.0017575 k( 76) = ( 0.0873016 0.5000000 -0.0000000), wk = 0.0017575 k( 77) = ( 0.0952381 0.5000000 -0.0000000), wk = 0.0017575 k( 78) = ( 0.1031746 0.5000000 -0.0000000), wk = 0.0017575 k( 79) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0017575 k( 80) = ( 0.1190476 0.5000000 -0.0000000), wk = 0.0017575 k( 81) = ( 0.1269841 0.5000000 -0.0000000), wk = 0.0017575 k( 82) = ( 0.1349206 0.5000000 -0.0000000), wk = 0.0017575 k( 83) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0017575 k( 84) = ( 0.1507937 0.5000000 -0.0000000), wk = 0.0017575 k( 85) = ( 0.1587302 0.5000000 -0.0000000), wk = 0.0017575 k( 86) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0017575 k( 87) = ( 0.1746032 0.5000000 -0.0000000), wk = 0.0017575 k( 88) = ( 0.1825397 0.5000000 -0.0000000), wk = 0.0017575 k( 89) = ( 0.1904762 0.5000000 -0.0000000), wk = 0.0017575 k( 90) = ( 0.1984127 0.5000000 -0.0000000), wk = 0.0017575 k( 91) = ( 0.2063492 0.5000000 -0.0000000), wk = 0.0017575 k( 92) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0017575 k( 93) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0017575 k( 94) = ( 0.2301587 0.5000000 -0.0000000), wk = 0.0017575 k( 95) = ( 0.2380952 0.5000000 -0.0000000), wk = 0.0017575 k( 96) = ( 0.2460317 0.5000000 -0.0000000), wk = 0.0017575 k( 97) = ( 0.2539683 0.5000000 -0.0000000), wk = 0.0017575 k( 98) = ( 0.2619048 0.5000000 -0.0000000), wk = 0.0017575 k( 99) = ( 0.2698413 0.5000000 -0.0000000), wk = 0.0017575 k( 100) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0017575 k( 101) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0017575 k( 102) = ( 0.2936508 0.5000000 -0.0000000), wk = 0.0017575 k( 103) = ( 0.3015873 0.5000000 -0.0000000), wk = 0.0017575 k( 104) = ( 0.3095238 0.5000000 -0.0000000), wk = 0.0017575 k( 105) = ( 0.3174603 0.5000000 -0.0000000), wk = 0.0017575 k( 106) = ( 0.3253968 0.5000000 -0.0000000), wk = 0.0017575 k( 107) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0017575 k( 108) = ( 0.3412698 0.5000000 -0.0000000), wk = 0.0017575 k( 109) = ( 0.3492063 0.5000000 -0.0000000), wk = 0.0017575 k( 110) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0017575 k( 111) = ( 0.3650794 0.5000000 -0.0000000), wk = 0.0017575 k( 112) = ( 0.3730159 0.5000000 -0.0000000), wk = 0.0017575 k( 113) = ( 0.3809524 0.5000000 -0.0000000), wk = 0.0017575 k( 114) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0017575 k( 115) = ( 0.3968254 0.5000000 -0.0000000), wk = 0.0017575 k( 116) = ( 0.4047619 0.5000000 -0.0000000), wk = 0.0017575 k( 117) = ( 0.4126984 0.5000000 -0.0000000), wk = 0.0017575 k( 118) = ( 0.4206349 0.5000000 -0.0000000), wk = 0.0017575 k( 119) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0017575 k( 120) = ( 0.4365079 0.5000000 -0.0000000), wk = 0.0017575 k( 121) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0017575 k( 122) = ( 0.4523810 0.5000000 -0.0000000), wk = 0.0017575 k( 123) = ( 0.4603175 0.5000000 -0.0000000), wk = 0.0017575 k( 124) = ( 0.4682540 0.5000000 -0.0000000), wk = 0.0017575 k( 125) = ( 0.4761905 0.5000000 -0.0000000), wk = 0.0017575 k( 126) = ( 0.4841270 0.5000000 -0.0000000), wk = 0.0017575 k( 127) = ( 0.4920635 0.5000000 -0.0000000), wk = 0.0017575 k( 128) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0017575 k( 129) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0017575 k( 130) = ( 0.4943182 0.4943182 -0.0000000), wk = 0.0017575 k( 131) = ( 0.4886364 0.4886364 -0.0000000), wk = 0.0017575 k( 132) = ( 0.4829545 0.4829545 -0.0000000), wk = 0.0017575 k( 133) = ( 0.4772727 0.4772727 -0.0000000), wk = 0.0017575 k( 134) = ( 0.4715909 0.4715909 -0.0000000), wk = 0.0017575 k( 135) = ( 0.4659091 0.4659091 -0.0000000), wk = 0.0017575 k( 136) = ( 0.4602273 0.4602273 -0.0000000), wk = 0.0017575 k( 137) = ( 0.4545455 0.4545454 -0.0000000), wk = 0.0017575 k( 138) = ( 0.4488636 0.4488636 -0.0000000), wk = 0.0017575 k( 139) = ( 0.4431818 0.4431818 -0.0000000), wk = 0.0017575 k( 140) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0017575 k( 141) = ( 0.4318182 0.4318182 -0.0000000), wk = 0.0017575 k( 142) = ( 0.4261364 0.4261364 -0.0000000), wk = 0.0017575 k( 143) = ( 0.4204545 0.4204545 -0.0000000), wk = 0.0017575 k( 144) = ( 0.4147727 0.4147727 -0.0000000), wk = 0.0017575 k( 145) = ( 0.4090909 0.4090909 -0.0000000), wk = 0.0017575 k( 146) = ( 0.4034091 0.4034091 -0.0000000), wk = 0.0017575 k( 147) = ( 0.3977273 0.3977273 -0.0000000), wk = 0.0017575 k( 148) = ( 0.3920455 0.3920454 -0.0000000), wk = 0.0017575 k( 149) = ( 0.3863636 0.3863636 -0.0000000), wk = 0.0017575 k( 150) = ( 0.3806818 0.3806818 -0.0000000), wk = 0.0017575 k( 151) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0017575 k( 152) = ( 0.3693182 0.3693182 -0.0000000), wk = 0.0017575 k( 153) = ( 0.3636364 0.3636364 -0.0000000), wk = 0.0017575 k( 154) = ( 0.3579545 0.3579545 -0.0000000), wk = 0.0017575 k( 155) = ( 0.3522727 0.3522727 -0.0000000), wk = 0.0017575 k( 156) = ( 0.3465909 0.3465909 -0.0000000), wk = 0.0017575 k( 157) = ( 0.3409091 0.3409091 -0.0000000), wk = 0.0017575 k( 158) = ( 0.3352273 0.3352273 -0.0000000), wk = 0.0017575 k( 159) = ( 0.3295455 0.3295454 -0.0000000), wk = 0.0017575 k( 160) = ( 0.3238636 0.3238636 -0.0000000), wk = 0.0017575 k( 161) = ( 0.3181818 0.3181818 -0.0000000), wk = 0.0017575 k( 162) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0017575 k( 163) = ( 0.3068182 0.3068182 -0.0000000), wk = 0.0017575 k( 164) = ( 0.3011364 0.3011364 -0.0000000), wk = 0.0017575 k( 165) = ( 0.2954545 0.2954545 -0.0000000), wk = 0.0017575 k( 166) = ( 0.2897727 0.2897727 -0.0000000), wk = 0.0017575 k( 167) = ( 0.2840909 0.2840909 -0.0000000), wk = 0.0017575 k( 168) = ( 0.2784091 0.2784091 -0.0000000), wk = 0.0017575 k( 169) = ( 0.2727273 0.2727273 -0.0000000), wk = 0.0017575 k( 170) = ( 0.2670455 0.2670455 -0.0000000), wk = 0.0017575 k( 171) = ( 0.2613636 0.2613636 -0.0000000), wk = 0.0017575 k( 172) = ( 0.2556818 0.2556818 -0.0000000), wk = 0.0017575 k( 173) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0017575 k( 174) = ( 0.2443182 0.2443182 -0.0000000), wk = 0.0017575 k( 175) = ( 0.2386364 0.2386364 -0.0000000), wk = 0.0017575 k( 176) = ( 0.2329546 0.2329545 -0.0000000), wk = 0.0017575 k( 177) = ( 0.2272727 0.2272727 -0.0000000), wk = 0.0017575 k( 178) = ( 0.2215909 0.2215909 -0.0000000), wk = 0.0017575 k( 179) = ( 0.2159091 0.2159091 -0.0000000), wk = 0.0017575 k( 180) = ( 0.2102273 0.2102273 -0.0000000), wk = 0.0017575 k( 181) = ( 0.2045454 0.2045454 -0.0000000), wk = 0.0017575 k( 182) = ( 0.1988636 0.1988636 -0.0000000), wk = 0.0017575 k( 183) = ( 0.1931818 0.1931818 -0.0000000), wk = 0.0017575 k( 184) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0017575 k( 185) = ( 0.1818182 0.1818182 -0.0000000), wk = 0.0017575 k( 186) = ( 0.1761364 0.1761364 -0.0000000), wk = 0.0017575 k( 187) = ( 0.1704546 0.1704545 -0.0000000), wk = 0.0017575 k( 188) = ( 0.1647727 0.1647727 -0.0000000), wk = 0.0017575 k( 189) = ( 0.1590909 0.1590909 -0.0000000), wk = 0.0017575 k( 190) = ( 0.1534091 0.1534091 -0.0000000), wk = 0.0017575 k( 191) = ( 0.1477273 0.1477273 -0.0000000), wk = 0.0017575 k( 192) = ( 0.1420454 0.1420454 -0.0000000), wk = 0.0017575 k( 193) = ( 0.1363636 0.1363636 -0.0000000), wk = 0.0017575 k( 194) = ( 0.1306818 0.1306818 -0.0000000), wk = 0.0017575 k( 195) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0017575 k( 196) = ( 0.1193182 0.1193182 -0.0000000), wk = 0.0017575 k( 197) = ( 0.1136364 0.1136364 -0.0000000), wk = 0.0017575 k( 198) = ( 0.1079545 0.1079545 -0.0000000), wk = 0.0017575 k( 199) = ( 0.1022727 0.1022727 -0.0000000), wk = 0.0017575 k( 200) = ( 0.0965909 0.0965909 -0.0000000), wk = 0.0017575 k( 201) = ( 0.0909091 0.0909091 -0.0000000), wk = 0.0017575 k( 202) = ( 0.0852273 0.0852273 -0.0000000), wk = 0.0017575 k( 203) = ( 0.0795455 0.0795454 -0.0000000), wk = 0.0017575 k( 204) = ( 0.0738636 0.0738636 -0.0000000), wk = 0.0017575 k( 205) = ( 0.0681818 0.0681818 -0.0000000), wk = 0.0017575 k( 206) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0017575 k( 207) = ( 0.0568182 0.0568182 -0.0000000), wk = 0.0017575 k( 208) = ( 0.0511364 0.0511364 -0.0000000), wk = 0.0017575 k( 209) = ( 0.0454546 0.0454545 -0.0000000), wk = 0.0017575 k( 210) = ( 0.0397727 0.0397727 -0.0000000), wk = 0.0017575 k( 211) = ( 0.0340909 0.0340909 -0.0000000), wk = 0.0017575 k( 212) = ( 0.0284091 0.0284091 -0.0000000), wk = 0.0017575 k( 213) = ( 0.0227273 0.0227273 -0.0000000), wk = 0.0017575 k( 214) = ( 0.0170455 0.0170455 -0.0000000), wk = 0.0017575 k( 215) = ( 0.0113636 0.0113636 -0.0000000), wk = 0.0017575 k( 216) = ( 0.0056818 0.0056818 -0.0000000), wk = 0.0017575 k( 217) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017575 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017575 k( 219) = ( 0.0000000 0.0000000 0.0080358), wk = 0.0017575 k( 220) = ( 0.0000000 0.0000000 0.0160715), wk = 0.0017575 k( 221) = ( 0.0000000 0.0000000 0.0241073), wk = 0.0017575 k( 222) = ( 0.0000000 0.0000000 0.0321430), wk = 0.0017575 k( 223) = ( 0.0000000 0.0000000 0.0401788), wk = 0.0017575 k( 224) = ( 0.0000000 0.0000000 0.0482146), wk = 0.0017575 k( 225) = ( 0.0000000 0.0000000 0.0562503), wk = 0.0017575 k( 226) = ( 0.0000000 0.0000000 0.0642861), wk = 0.0017575 k( 227) = ( 0.0000000 0.0000000 0.0723218), wk = 0.0017575 k( 228) = ( 0.0000000 0.0000000 0.0803576), wk = 0.0017575 k( 229) = ( 0.0000000 0.0000000 0.0883934), wk = 0.0017575 k( 230) = ( 0.0000000 0.0000000 0.0964291), wk = 0.0017575 k( 231) = ( 0.0000000 0.0000000 0.1044649), wk = 0.0017575 k( 232) = ( 0.0000000 0.0000000 0.1125006), wk = 0.0017575 k( 233) = ( 0.0000000 0.0000000 0.1205364), wk = 0.0017575 k( 234) = ( 0.0000000 0.0000000 0.1285722), wk = 0.0017575 k( 235) = ( 0.0000000 0.0000000 0.1366079), wk = 0.0017575 k( 236) = ( 0.0000000 0.0000000 0.1446437), wk = 0.0017575 k( 237) = ( 0.0000000 0.0000000 0.1526794), wk = 0.0017575 k( 238) = ( 0.0000000 0.0000000 0.1607152), wk = 0.0017575 k( 239) = ( 0.0000000 0.0000000 0.1687509), wk = 0.0017575 k( 240) = ( 0.0000000 0.0000000 0.1767867), wk = 0.0017575 k( 241) = ( 0.0000000 0.0000000 0.1848225), wk = 0.0017575 k( 242) = ( 0.0000000 0.0000000 0.1928582), wk = 0.0017575 k( 243) = ( 0.0000000 0.0000000 0.2008940), wk = 0.0017575 k( 244) = ( 0.0000000 0.0000000 0.2089298), wk = 0.0017575 k( 245) = ( 0.0000000 0.0000000 0.2169655), wk = 0.0017575 k( 246) = ( 0.0000000 0.0000000 0.2250013), wk = 0.0017575 k( 247) = ( 0.0000000 0.0000000 0.2330370), wk = 0.0017575 k( 248) = ( 0.0000000 0.0000000 0.2410728), wk = 0.0017575 k( 249) = ( 0.0000000 0.0000000 0.2491085), wk = 0.0017575 k( 250) = ( 0.0000000 0.0000000 0.2571443), wk = 0.0017575 k( 251) = ( 0.0000000 0.0000000 0.2651801), wk = 0.0017575 k( 252) = ( 0.0000000 0.0000000 0.2732158), wk = 0.0017575 k( 253) = ( 0.0000000 0.0000000 0.2812516), wk = 0.0017575 k( 254) = ( 0.0000000 0.0000000 0.2892873), wk = 0.0017575 k( 255) = ( 0.0000000 0.0000000 0.2973231), wk = 0.0017575 k( 256) = ( 0.0000000 0.0000000 0.3053589), wk = 0.0017575 k( 257) = ( 0.0000000 0.0000000 0.3133946), wk = 0.0017575 k( 258) = ( 0.0000000 0.0000000 0.3214304), wk = 0.0017575 k( 259) = ( 0.0000000 0.0000000 0.3294661), wk = 0.0017575 k( 260) = ( 0.0000000 0.0000000 0.3375019), wk = 0.0017575 k( 261) = ( 0.0000000 0.0000000 0.3455377), wk = 0.0017575 k( 262) = ( 0.0000000 0.0000000 0.3535734), wk = 0.0017575 k( 263) = ( 0.0000000 0.0000000 0.3535734), wk = 0.0017575 k( 264) = ( 0.0000000 0.0079365 0.3535734), wk = 0.0017575 k( 265) = ( 0.0000000 0.0158730 0.3535734), wk = 0.0017575 k( 266) = ( 0.0000000 0.0238095 0.3535734), wk = 0.0017575 k( 267) = ( 0.0000000 0.0317460 0.3535734), wk = 0.0017575 k( 268) = ( 0.0000000 0.0396825 0.3535734), wk = 0.0017575 k( 269) = ( 0.0000000 0.0476191 0.3535734), wk = 0.0017575 k( 270) = ( 0.0000000 0.0555556 0.3535734), wk = 0.0017575 k( 271) = ( 0.0000000 0.0634921 0.3535734), wk = 0.0017575 k( 272) = ( 0.0000000 0.0714286 0.3535734), wk = 0.0017575 k( 273) = ( 0.0000000 0.0793651 0.3535734), wk = 0.0017575 k( 274) = ( 0.0000000 0.0873016 0.3535734), wk = 0.0017575 k( 275) = ( 0.0000000 0.0952381 0.3535734), wk = 0.0017575 k( 276) = ( 0.0000000 0.1031746 0.3535734), wk = 0.0017575 k( 277) = ( 0.0000000 0.1111111 0.3535734), wk = 0.0017575 k( 278) = ( 0.0000000 0.1190476 0.3535734), wk = 0.0017575 k( 279) = ( 0.0000000 0.1269841 0.3535734), wk = 0.0017575 k( 280) = ( 0.0000000 0.1349206 0.3535734), wk = 0.0017575 k( 281) = ( 0.0000000 0.1428571 0.3535734), wk = 0.0017575 k( 282) = ( 0.0000000 0.1507937 0.3535734), wk = 0.0017575 k( 283) = ( 0.0000000 0.1587302 0.3535734), wk = 0.0017575 k( 284) = ( 0.0000000 0.1666667 0.3535734), wk = 0.0017575 k( 285) = ( 0.0000000 0.1746032 0.3535734), wk = 0.0017575 k( 286) = ( 0.0000000 0.1825397 0.3535734), wk = 0.0017575 k( 287) = ( 0.0000000 0.1904762 0.3535734), wk = 0.0017575 k( 288) = ( 0.0000000 0.1984127 0.3535734), wk = 0.0017575 k( 289) = ( 0.0000000 0.2063492 0.3535734), wk = 0.0017575 k( 290) = ( 0.0000000 0.2142857 0.3535734), wk = 0.0017575 k( 291) = ( 0.0000000 0.2222222 0.3535734), wk = 0.0017575 k( 292) = ( 0.0000000 0.2301587 0.3535734), wk = 0.0017575 k( 293) = ( 0.0000000 0.2380952 0.3535734), wk = 0.0017575 k( 294) = ( 0.0000000 0.2460317 0.3535734), wk = 0.0017575 k( 295) = ( 0.0000000 0.2539683 0.3535734), wk = 0.0017575 k( 296) = ( 0.0000000 0.2619048 0.3535734), wk = 0.0017575 k( 297) = ( 0.0000000 0.2698413 0.3535734), wk = 0.0017575 k( 298) = ( 0.0000000 0.2777778 0.3535734), wk = 0.0017575 k( 299) = ( 0.0000000 0.2857143 0.3535734), wk = 0.0017575 k( 300) = ( 0.0000000 0.2936508 0.3535734), wk = 0.0017575 k( 301) = ( 0.0000000 0.3015873 0.3535734), wk = 0.0017575 k( 302) = ( 0.0000000 0.3095238 0.3535734), wk = 0.0017575 k( 303) = ( 0.0000000 0.3174603 0.3535734), wk = 0.0017575 k( 304) = ( 0.0000000 0.3253968 0.3535734), wk = 0.0017575 k( 305) = ( 0.0000000 0.3333333 0.3535734), wk = 0.0017575 k( 306) = ( 0.0000000 0.3412698 0.3535734), wk = 0.0017575 k( 307) = ( 0.0000000 0.3492063 0.3535734), wk = 0.0017575 k( 308) = ( 0.0000000 0.3571429 0.3535734), wk = 0.0017575 k( 309) = ( 0.0000000 0.3650794 0.3535734), wk = 0.0017575 k( 310) = ( 0.0000000 0.3730159 0.3535734), wk = 0.0017575 k( 311) = ( 0.0000000 0.3809524 0.3535734), wk = 0.0017575 k( 312) = ( 0.0000000 0.3888889 0.3535734), wk = 0.0017575 k( 313) = ( 0.0000000 0.3968254 0.3535734), wk = 0.0017575 k( 314) = ( 0.0000000 0.4047619 0.3535734), wk = 0.0017575 k( 315) = ( 0.0000000 0.4126984 0.3535734), wk = 0.0017575 k( 316) = ( 0.0000000 0.4206349 0.3535734), wk = 0.0017575 k( 317) = ( 0.0000000 0.4285714 0.3535734), wk = 0.0017575 k( 318) = ( 0.0000000 0.4365079 0.3535734), wk = 0.0017575 k( 319) = ( 0.0000000 0.4444444 0.3535734), wk = 0.0017575 k( 320) = ( 0.0000000 0.4523810 0.3535734), wk = 0.0017575 k( 321) = ( 0.0000000 0.4603175 0.3535734), wk = 0.0017575 k( 322) = ( 0.0000000 0.4682540 0.3535734), wk = 0.0017575 k( 323) = ( 0.0000000 0.4761905 0.3535734), wk = 0.0017575 k( 324) = ( 0.0000000 0.4841270 0.3535734), wk = 0.0017575 k( 325) = ( 0.0000000 0.4920635 0.3535734), wk = 0.0017575 k( 326) = ( 0.0000000 0.5000000 0.3535734), wk = 0.0017575 k( 327) = ( 0.0000000 0.5000000 0.3535734), wk = 0.0017575 k( 328) = ( 0.0079365 0.5000000 0.3535734), wk = 0.0017575 k( 329) = ( 0.0158730 0.5000000 0.3535734), wk = 0.0017575 k( 330) = ( 0.0238095 0.5000000 0.3535734), wk = 0.0017575 k( 331) = ( 0.0317460 0.5000000 0.3535734), wk = 0.0017575 k( 332) = ( 0.0396825 0.5000000 0.3535734), wk = 0.0017575 k( 333) = ( 0.0476191 0.5000000 0.3535734), wk = 0.0017575 k( 334) = ( 0.0555556 0.5000000 0.3535734), wk = 0.0017575 k( 335) = ( 0.0634921 0.5000000 0.3535734), wk = 0.0017575 k( 336) = ( 0.0714286 0.5000000 0.3535734), wk = 0.0017575 k( 337) = ( 0.0793651 0.5000000 0.3535734), wk = 0.0017575 k( 338) = ( 0.0873016 0.5000000 0.3535734), wk = 0.0017575 k( 339) = ( 0.0952381 0.5000000 0.3535734), wk = 0.0017575 k( 340) = ( 0.1031746 0.5000000 0.3535734), wk = 0.0017575 k( 341) = ( 0.1111111 0.5000000 0.3535734), wk = 0.0017575 k( 342) = ( 0.1190476 0.5000000 0.3535734), wk = 0.0017575 k( 343) = ( 0.1269841 0.5000000 0.3535734), wk = 0.0017575 k( 344) = ( 0.1349206 0.5000000 0.3535734), wk = 0.0017575 k( 345) = ( 0.1428571 0.5000000 0.3535734), wk = 0.0017575 k( 346) = ( 0.1507937 0.5000000 0.3535734), wk = 0.0017575 k( 347) = ( 0.1587302 0.5000000 0.3535734), wk = 0.0017575 k( 348) = ( 0.1666667 0.5000000 0.3535734), wk = 0.0017575 k( 349) = ( 0.1746032 0.5000000 0.3535734), wk = 0.0017575 k( 350) = ( 0.1825397 0.5000000 0.3535734), wk = 0.0017575 k( 351) = ( 0.1904762 0.5000000 0.3535734), wk = 0.0017575 k( 352) = ( 0.1984127 0.5000000 0.3535734), wk = 0.0017575 k( 353) = ( 0.2063492 0.5000000 0.3535734), wk = 0.0017575 k( 354) = ( 0.2142857 0.5000000 0.3535734), wk = 0.0017575 k( 355) = ( 0.2222222 0.5000000 0.3535734), wk = 0.0017575 k( 356) = ( 0.2301587 0.5000000 0.3535734), wk = 0.0017575 k( 357) = ( 0.2380952 0.5000000 0.3535734), wk = 0.0017575 k( 358) = ( 0.2460317 0.5000000 0.3535734), wk = 0.0017575 k( 359) = ( 0.2539683 0.5000000 0.3535734), wk = 0.0017575 k( 360) = ( 0.2619048 0.5000000 0.3535734), wk = 0.0017575 k( 361) = ( 0.2698413 0.5000000 0.3535734), wk = 0.0017575 k( 362) = ( 0.2777778 0.5000000 0.3535734), wk = 0.0017575 k( 363) = ( 0.2857143 0.5000000 0.3535734), wk = 0.0017575 k( 364) = ( 0.2936508 0.5000000 0.3535734), wk = 0.0017575 k( 365) = ( 0.3015873 0.5000000 0.3535734), wk = 0.0017575 k( 366) = ( 0.3095238 0.5000000 0.3535734), wk = 0.0017575 k( 367) = ( 0.3174603 0.5000000 0.3535734), wk = 0.0017575 k( 368) = ( 0.3253968 0.5000000 0.3535734), wk = 0.0017575 k( 369) = ( 0.3333333 0.5000000 0.3535734), wk = 0.0017575 k( 370) = ( 0.3412698 0.5000000 0.3535734), wk = 0.0017575 k( 371) = ( 0.3492063 0.5000000 0.3535734), wk = 0.0017575 k( 372) = ( 0.3571429 0.5000000 0.3535734), wk = 0.0017575 k( 373) = ( 0.3650794 0.5000000 0.3535734), wk = 0.0017575 k( 374) = ( 0.3730159 0.5000000 0.3535734), wk = 0.0017575 k( 375) = ( 0.3809524 0.5000000 0.3535734), wk = 0.0017575 k( 376) = ( 0.3888889 0.5000000 0.3535734), wk = 0.0017575 k( 377) = ( 0.3968254 0.5000000 0.3535734), wk = 0.0017575 k( 378) = ( 0.4047619 0.5000000 0.3535734), wk = 0.0017575 k( 379) = ( 0.4126984 0.5000000 0.3535734), wk = 0.0017575 k( 380) = ( 0.4206349 0.5000000 0.3535734), wk = 0.0017575 k( 381) = ( 0.4285714 0.5000000 0.3535734), wk = 0.0017575 k( 382) = ( 0.4365079 0.5000000 0.3535734), wk = 0.0017575 k( 383) = ( 0.4444444 0.5000000 0.3535734), wk = 0.0017575 k( 384) = ( 0.4523810 0.5000000 0.3535734), wk = 0.0017575 k( 385) = ( 0.4603175 0.5000000 0.3535734), wk = 0.0017575 k( 386) = ( 0.4682540 0.5000000 0.3535734), wk = 0.0017575 k( 387) = ( 0.4761905 0.5000000 0.3535734), wk = 0.0017575 k( 388) = ( 0.4841270 0.5000000 0.3535734), wk = 0.0017575 k( 389) = ( 0.4920635 0.5000000 0.3535734), wk = 0.0017575 k( 390) = ( 0.5000000 0.5000000 0.3535734), wk = 0.0017575 k( 391) = ( 0.5000000 0.5000000 0.3535734), wk = 0.0017575 k( 392) = ( 0.4943182 0.4943182 0.3535734), wk = 0.0017575 k( 393) = ( 0.4886364 0.4886364 0.3535734), wk = 0.0017575 k( 394) = ( 0.4829545 0.4829545 0.3535734), wk = 0.0017575 k( 395) = ( 0.4772727 0.4772727 0.3535734), wk = 0.0017575 k( 396) = ( 0.4715909 0.4715909 0.3535734), wk = 0.0017575 k( 397) = ( 0.4659091 0.4659091 0.3535734), wk = 0.0017575 k( 398) = ( 0.4602273 0.4602273 0.3535734), wk = 0.0017575 k( 399) = ( 0.4545455 0.4545454 0.3535734), wk = 0.0017575 k( 400) = ( 0.4488636 0.4488636 0.3535734), wk = 0.0017575 k( 401) = ( 0.4431818 0.4431818 0.3535734), wk = 0.0017575 k( 402) = ( 0.4375000 0.4375000 0.3535734), wk = 0.0017575 k( 403) = ( 0.4318182 0.4318182 0.3535734), wk = 0.0017575 k( 404) = ( 0.4261364 0.4261364 0.3535734), wk = 0.0017575 k( 405) = ( 0.4204545 0.4204545 0.3535734), wk = 0.0017575 k( 406) = ( 0.4147727 0.4147727 0.3535734), wk = 0.0017575 k( 407) = ( 0.4090909 0.4090909 0.3535734), wk = 0.0017575 k( 408) = ( 0.4034091 0.4034091 0.3535734), wk = 0.0017575 k( 409) = ( 0.3977273 0.3977273 0.3535734), wk = 0.0017575 k( 410) = ( 0.3920455 0.3920454 0.3535734), wk = 0.0017575 k( 411) = ( 0.3863636 0.3863636 0.3535734), wk = 0.0017575 k( 412) = ( 0.3806818 0.3806818 0.3535734), wk = 0.0017575 k( 413) = ( 0.3750000 0.3750000 0.3535734), wk = 0.0017575 k( 414) = ( 0.3693182 0.3693182 0.3535734), wk = 0.0017575 k( 415) = ( 0.3636364 0.3636364 0.3535734), wk = 0.0017575 k( 416) = ( 0.3579545 0.3579545 0.3535734), wk = 0.0017575 k( 417) = ( 0.3522727 0.3522727 0.3535734), wk = 0.0017575 k( 418) = ( 0.3465909 0.3465909 0.3535734), wk = 0.0017575 k( 419) = ( 0.3409091 0.3409091 0.3535734), wk = 0.0017575 k( 420) = ( 0.3352273 0.3352273 0.3535734), wk = 0.0017575 k( 421) = ( 0.3295455 0.3295454 0.3535734), wk = 0.0017575 k( 422) = ( 0.3238636 0.3238636 0.3535734), wk = 0.0017575 k( 423) = ( 0.3181818 0.3181818 0.3535734), wk = 0.0017575 k( 424) = ( 0.3125000 0.3125000 0.3535734), wk = 0.0017575 k( 425) = ( 0.3068182 0.3068182 0.3535734), wk = 0.0017575 k( 426) = ( 0.3011364 0.3011364 0.3535734), wk = 0.0017575 k( 427) = ( 0.2954545 0.2954545 0.3535734), wk = 0.0017575 k( 428) = ( 0.2897727 0.2897727 0.3535734), wk = 0.0017575 k( 429) = ( 0.2840909 0.2840909 0.3535734), wk = 0.0017575 k( 430) = ( 0.2784091 0.2784091 0.3535734), wk = 0.0017575 k( 431) = ( 0.2727273 0.2727273 0.3535734), wk = 0.0017575 k( 432) = ( 0.2670455 0.2670455 0.3535734), wk = 0.0017575 k( 433) = ( 0.2613636 0.2613636 0.3535734), wk = 0.0017575 k( 434) = ( 0.2556818 0.2556818 0.3535734), wk = 0.0017575 k( 435) = ( 0.2500000 0.2500000 0.3535734), wk = 0.0017575 k( 436) = ( 0.2443182 0.2443182 0.3535734), wk = 0.0017575 k( 437) = ( 0.2386364 0.2386364 0.3535734), wk = 0.0017575 k( 438) = ( 0.2329546 0.2329545 0.3535734), wk = 0.0017575 k( 439) = ( 0.2272727 0.2272727 0.3535734), wk = 0.0017575 k( 440) = ( 0.2215909 0.2215909 0.3535734), wk = 0.0017575 k( 441) = ( 0.2159091 0.2159091 0.3535734), wk = 0.0017575 k( 442) = ( 0.2102273 0.2102273 0.3535734), wk = 0.0017575 k( 443) = ( 0.2045454 0.2045454 0.3535734), wk = 0.0017575 k( 444) = ( 0.1988636 0.1988636 0.3535734), wk = 0.0017575 k( 445) = ( 0.1931818 0.1931818 0.3535734), wk = 0.0017575 k( 446) = ( 0.1875000 0.1875000 0.3535734), wk = 0.0017575 k( 447) = ( 0.1818182 0.1818182 0.3535734), wk = 0.0017575 k( 448) = ( 0.1761364 0.1761364 0.3535734), wk = 0.0017575 k( 449) = ( 0.1704546 0.1704545 0.3535734), wk = 0.0017575 k( 450) = ( 0.1647727 0.1647727 0.3535734), wk = 0.0017575 k( 451) = ( 0.1590909 0.1590909 0.3535734), wk = 0.0017575 k( 452) = ( 0.1534091 0.1534091 0.3535734), wk = 0.0017575 k( 453) = ( 0.1477273 0.1477273 0.3535734), wk = 0.0017575 k( 454) = ( 0.1420454 0.1420454 0.3535734), wk = 0.0017575 k( 455) = ( 0.1363636 0.1363636 0.3535734), wk = 0.0017575 k( 456) = ( 0.1306818 0.1306818 0.3535734), wk = 0.0017575 k( 457) = ( 0.1250000 0.1250000 0.3535734), wk = 0.0017575 k( 458) = ( 0.1193182 0.1193182 0.3535734), wk = 0.0017575 k( 459) = ( 0.1136364 0.1136364 0.3535734), wk = 0.0017575 k( 460) = ( 0.1079545 0.1079545 0.3535734), wk = 0.0017575 k( 461) = ( 0.1022727 0.1022727 0.3535734), wk = 0.0017575 k( 462) = ( 0.0965909 0.0965909 0.3535734), wk = 0.0017575 k( 463) = ( 0.0909091 0.0909091 0.3535734), wk = 0.0017575 k( 464) = ( 0.0852273 0.0852273 0.3535734), wk = 0.0017575 k( 465) = ( 0.0795455 0.0795454 0.3535734), wk = 0.0017575 k( 466) = ( 0.0738636 0.0738636 0.3535734), wk = 0.0017575 k( 467) = ( 0.0681818 0.0681818 0.3535734), wk = 0.0017575 k( 468) = ( 0.0625000 0.0625000 0.3535734), wk = 0.0017575 k( 469) = ( 0.0568182 0.0568182 0.3535734), wk = 0.0017575 k( 470) = ( 0.0511364 0.0511364 0.3535734), wk = 0.0017575 k( 471) = ( 0.0454546 0.0454545 0.3535734), wk = 0.0017575 k( 472) = ( 0.0397727 0.0397727 0.3535734), wk = 0.0017575 k( 473) = ( 0.0340909 0.0340909 0.3535734), wk = 0.0017575 k( 474) = ( 0.0284091 0.0284091 0.3535734), wk = 0.0017575 k( 475) = ( 0.0227273 0.0227273 0.3535734), wk = 0.0017575 k( 476) = ( 0.0170455 0.0170455 0.3535734), wk = 0.0017575 k( 477) = ( 0.0113636 0.0113636 0.3535734), wk = 0.0017575 k( 478) = ( 0.0056818 0.0056818 0.3535734), wk = 0.0017575 k( 479) = ( 0.0000000 0.0000000 0.3535734), wk = 0.0017575 k( 480) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017575 k( 481) = ( 0.0000000 0.5000000 0.0080358), wk = 0.0017575 k( 482) = ( 0.0000000 0.5000000 0.0160715), wk = 0.0017575 k( 483) = ( 0.0000000 0.5000000 0.0241073), wk = 0.0017575 k( 484) = ( 0.0000000 0.5000000 0.0321430), wk = 0.0017575 k( 485) = ( 0.0000000 0.5000000 0.0401788), wk = 0.0017575 k( 486) = ( 0.0000000 0.5000000 0.0482146), wk = 0.0017575 k( 487) = ( 0.0000000 0.5000000 0.0562503), wk = 0.0017575 k( 488) = ( 0.0000000 0.5000000 0.0642861), wk = 0.0017575 k( 489) = ( 0.0000000 0.5000000 0.0723218), wk = 0.0017575 k( 490) = ( 0.0000000 0.5000000 0.0803576), wk = 0.0017575 k( 491) = ( 0.0000000 0.5000000 0.0883934), wk = 0.0017575 k( 492) = ( 0.0000000 0.5000000 0.0964291), wk = 0.0017575 k( 493) = ( 0.0000000 0.5000000 0.1044649), wk = 0.0017575 k( 494) = ( 0.0000000 0.5000000 0.1125006), wk = 0.0017575 k( 495) = ( 0.0000000 0.5000000 0.1205364), wk = 0.0017575 k( 496) = ( 0.0000000 0.5000000 0.1285722), wk = 0.0017575 k( 497) = ( 0.0000000 0.5000000 0.1366079), wk = 0.0017575 k( 498) = ( 0.0000000 0.5000000 0.1446437), wk = 0.0017575 k( 499) = ( 0.0000000 0.5000000 0.1526794), wk = 0.0017575 k( 500) = ( 0.0000000 0.5000000 0.1607152), wk = 0.0017575 k( 501) = ( 0.0000000 0.5000000 0.1687509), wk = 0.0017575 k( 502) = ( 0.0000000 0.5000000 0.1767867), wk = 0.0017575 k( 503) = ( 0.0000000 0.5000000 0.1848225), wk = 0.0017575 k( 504) = ( 0.0000000 0.5000000 0.1928582), wk = 0.0017575 k( 505) = ( 0.0000000 0.5000000 0.2008940), wk = 0.0017575 k( 506) = ( 0.0000000 0.5000000 0.2089298), wk = 0.0017575 k( 507) = ( 0.0000000 0.5000000 0.2169655), wk = 0.0017575 k( 508) = ( 0.0000000 0.5000000 0.2250013), wk = 0.0017575 k( 509) = ( 0.0000000 0.5000000 0.2330370), wk = 0.0017575 k( 510) = ( 0.0000000 0.5000000 0.2410728), wk = 0.0017575 k( 511) = ( 0.0000000 0.5000000 0.2491085), wk = 0.0017575 k( 512) = ( 0.0000000 0.5000000 0.2571443), wk = 0.0017575 k( 513) = ( 0.0000000 0.5000000 0.2651801), wk = 0.0017575 k( 514) = ( 0.0000000 0.5000000 0.2732158), wk = 0.0017575 k( 515) = ( 0.0000000 0.5000000 0.2812516), wk = 0.0017575 k( 516) = ( 0.0000000 0.5000000 0.2892873), wk = 0.0017575 k( 517) = ( 0.0000000 0.5000000 0.2973231), wk = 0.0017575 k( 518) = ( 0.0000000 0.5000000 0.3053589), wk = 0.0017575 k( 519) = ( 0.0000000 0.5000000 0.3133946), wk = 0.0017575 k( 520) = ( 0.0000000 0.5000000 0.3214304), wk = 0.0017575 k( 521) = ( 0.0000000 0.5000000 0.3294661), wk = 0.0017575 k( 522) = ( 0.0000000 0.5000000 0.3375019), wk = 0.0017575 k( 523) = ( 0.0000000 0.5000000 0.3455377), wk = 0.0017575 k( 524) = ( 0.0000000 0.5000000 0.3535734), wk = 0.0017575 k( 525) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0017575 k( 526) = ( 0.5000000 0.5000000 0.0080358), wk = 0.0017575 k( 527) = ( 0.5000000 0.5000000 0.0160715), wk = 0.0017575 k( 528) = ( 0.5000000 0.5000000 0.0241073), wk = 0.0017575 k( 529) = ( 0.5000000 0.5000000 0.0321430), wk = 0.0017575 k( 530) = ( 0.5000000 0.5000000 0.0401788), wk = 0.0017575 k( 531) = ( 0.5000000 0.5000000 0.0482146), wk = 0.0017575 k( 532) = ( 0.5000000 0.5000000 0.0562503), wk = 0.0017575 k( 533) = ( 0.5000000 0.5000000 0.0642861), wk = 0.0017575 k( 534) = ( 0.5000000 0.5000000 0.0723218), wk = 0.0017575 k( 535) = ( 0.5000000 0.5000000 0.0803576), wk = 0.0017575 k( 536) = ( 0.5000000 0.5000000 0.0883934), wk = 0.0017575 k( 537) = ( 0.5000000 0.5000000 0.0964291), wk = 0.0017575 k( 538) = ( 0.5000000 0.5000000 0.1044649), wk = 0.0017575 k( 539) = ( 0.5000000 0.5000000 0.1125006), wk = 0.0017575 k( 540) = ( 0.5000000 0.5000000 0.1205364), wk = 0.0017575 k( 541) = ( 0.5000000 0.5000000 0.1285722), wk = 0.0017575 k( 542) = ( 0.5000000 0.5000000 0.1366079), wk = 0.0017575 k( 543) = ( 0.5000000 0.5000000 0.1446437), wk = 0.0017575 k( 544) = ( 0.5000000 0.5000000 0.1526794), wk = 0.0017575 k( 545) = ( 0.5000000 0.5000000 0.1607152), wk = 0.0017575 k( 546) = ( 0.5000000 0.5000000 0.1687509), wk = 0.0017575 k( 547) = ( 0.5000000 0.5000000 0.1767867), wk = 0.0017575 k( 548) = ( 0.5000000 0.5000000 0.1848225), wk = 0.0017575 k( 549) = ( 0.5000000 0.5000000 0.1928582), wk = 0.0017575 k( 550) = ( 0.5000000 0.5000000 0.2008940), wk = 0.0017575 k( 551) = ( 0.5000000 0.5000000 0.2089298), wk = 0.0017575 k( 552) = ( 0.5000000 0.5000000 0.2169655), wk = 0.0017575 k( 553) = ( 0.5000000 0.5000000 0.2250013), wk = 0.0017575 k( 554) = ( 0.5000000 0.5000000 0.2330370), wk = 0.0017575 k( 555) = ( 0.5000000 0.5000000 0.2410728), wk = 0.0017575 k( 556) = ( 0.5000000 0.5000000 0.2491085), wk = 0.0017575 k( 557) = ( 0.5000000 0.5000000 0.2571443), wk = 0.0017575 k( 558) = ( 0.5000000 0.5000000 0.2651801), wk = 0.0017575 k( 559) = ( 0.5000000 0.5000000 0.2732158), wk = 0.0017575 k( 560) = ( 0.5000000 0.5000000 0.2812516), wk = 0.0017575 k( 561) = ( 0.5000000 0.5000000 0.2892873), wk = 0.0017575 k( 562) = ( 0.5000000 0.5000000 0.2973231), wk = 0.0017575 k( 563) = ( 0.5000000 0.5000000 0.3053589), wk = 0.0017575 k( 564) = ( 0.5000000 0.5000000 0.3133946), wk = 0.0017575 k( 565) = ( 0.5000000 0.5000000 0.3214304), wk = 0.0017575 k( 566) = ( 0.5000000 0.5000000 0.3294661), wk = 0.0017575 k( 567) = ( 0.5000000 0.5000000 0.3375019), wk = 0.0017575 k( 568) = ( 0.5000000 0.5000000 0.3455377), wk = 0.0017575 k( 569) = ( 0.5000000 0.5000000 0.3535734), wk = 0.0017575 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017575 k( 2) = ( 0.0000000 0.0079365 -0.0000000), wk = 0.0017575 k( 3) = ( 0.0000000 0.0158730 -0.0000000), wk = 0.0017575 k( 4) = ( 0.0000000 0.0238095 -0.0000000), wk = 0.0017575 k( 5) = ( 0.0000000 0.0317460 -0.0000000), wk = 0.0017575 k( 6) = ( 0.0000000 0.0396825 -0.0000000), wk = 0.0017575 k( 7) = ( 0.0000000 0.0476191 -0.0000000), wk = 0.0017575 k( 8) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0017575 k( 9) = ( 0.0000000 0.0634921 -0.0000000), wk = 0.0017575 k( 10) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0017575 k( 11) = ( 0.0000000 0.0793651 -0.0000000), wk = 0.0017575 k( 12) = ( 0.0000000 0.0873016 -0.0000000), wk = 0.0017575 k( 13) = ( 0.0000000 0.0952381 -0.0000000), wk = 0.0017575 k( 14) = ( 0.0000000 0.1031746 -0.0000000), wk = 0.0017575 k( 15) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0017575 k( 16) = ( 0.0000000 0.1190476 0.0000000), wk = 0.0017575 k( 17) = ( 0.0000000 0.1269841 -0.0000000), wk = 0.0017575 k( 18) = ( 0.0000000 0.1349206 -0.0000000), wk = 0.0017575 k( 19) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0017575 k( 20) = ( 0.0000000 0.1507937 0.0000000), wk = 0.0017575 k( 21) = ( 0.0000000 0.1587302 -0.0000000), wk = 0.0017575 k( 22) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0017575 k( 23) = ( 0.0000000 0.1746032 -0.0000000), wk = 0.0017575 k( 24) = ( 0.0000000 0.1825397 -0.0000000), wk = 0.0017575 k( 25) = ( 0.0000000 0.1904762 -0.0000000), wk = 0.0017575 k( 26) = ( 0.0000000 0.1984127 0.0000000), wk = 0.0017575 k( 27) = ( 0.0000000 0.2063492 -0.0000000), wk = 0.0017575 k( 28) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0017575 k( 29) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0017575 k( 30) = ( 0.0000000 0.2301587 0.0000000), wk = 0.0017575 k( 31) = ( 0.0000000 0.2380952 0.0000000), wk = 0.0017575 k( 32) = ( 0.0000000 0.2460317 -0.0000000), wk = 0.0017575 k( 33) = ( 0.0000000 0.2539683 -0.0000000), wk = 0.0017575 k( 34) = ( 0.0000000 0.2619048 -0.0000000), wk = 0.0017575 k( 35) = ( 0.0000000 0.2698413 -0.0000000), wk = 0.0017575 k( 36) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0017575 k( 37) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0017575 k( 38) = ( 0.0000000 0.2936508 -0.0000000), wk = 0.0017575 k( 39) = ( 0.0000000 0.3015873 0.0000000), wk = 0.0017575 k( 40) = ( 0.0000000 0.3095238 0.0000000), wk = 0.0017575 k( 41) = ( 0.0000000 0.3174603 -0.0000000), wk = 0.0017575 k( 42) = ( 0.0000000 0.3253968 -0.0000000), wk = 0.0017575 k( 43) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0017575 k( 44) = ( 0.0000000 0.3412698 -0.0000000), wk = 0.0017575 k( 45) = ( 0.0000000 0.3492063 0.0000000), wk = 0.0017575 k( 46) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0017575 k( 47) = ( 0.0000000 0.3650794 -0.0000000), wk = 0.0017575 k( 48) = ( 0.0000000 0.3730159 -0.0000000), wk = 0.0017575 k( 49) = ( 0.0000000 0.3809524 -0.0000000), wk = 0.0017575 k( 50) = ( 0.0000000 0.3888889 0.0000000), wk = 0.0017575 k( 51) = ( 0.0000000 0.3968254 0.0000000), wk = 0.0017575 k( 52) = ( 0.0000000 0.4047619 -0.0000000), wk = 0.0017575 k( 53) = ( 0.0000000 0.4126984 0.0000000), wk = 0.0017575 k( 54) = ( 0.0000000 0.4206349 -0.0000000), wk = 0.0017575 k( 55) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0017575 k( 56) = ( 0.0000000 0.4365079 -0.0000000), wk = 0.0017575 k( 57) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0017575 k( 58) = ( 0.0000000 0.4523810 -0.0000000), wk = 0.0017575 k( 59) = ( 0.0000000 0.4603175 0.0000000), wk = 0.0017575 k( 60) = ( 0.0000000 0.4682540 -0.0000000), wk = 0.0017575 k( 61) = ( 0.0000000 0.4761905 0.0000000), wk = 0.0017575 k( 62) = ( 0.0000000 0.4841270 -0.0000000), wk = 0.0017575 k( 63) = ( 0.0000000 0.4920635 -0.0000000), wk = 0.0017575 k( 64) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017575 k( 65) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017575 k( 66) = ( 0.0079365 0.5000000 -0.0000000), wk = 0.0017575 k( 67) = ( 0.0158730 0.5000000 -0.0000000), wk = 0.0017575 k( 68) = ( 0.0238095 0.5000000 0.0000000), wk = 0.0017575 k( 69) = ( 0.0317460 0.5000000 -0.0000000), wk = 0.0017575 k( 70) = ( 0.0396825 0.5000000 0.0000000), wk = 0.0017575 k( 71) = ( 0.0476191 0.5000000 -0.0000000), wk = 0.0017575 k( 72) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0017575 k( 73) = ( 0.0634921 0.5000000 -0.0000000), wk = 0.0017575 k( 74) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0017575 k( 75) = ( 0.0793651 0.5000000 -0.0000000), wk = 0.0017575 k( 76) = ( 0.0873016 0.5000000 0.0000000), wk = 0.0017575 k( 77) = ( 0.0952381 0.5000000 -0.0000000), wk = 0.0017575 k( 78) = ( 0.1031746 0.5000000 0.0000000), wk = 0.0017575 k( 79) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0017575 k( 80) = ( 0.1190476 0.5000000 0.0000000), wk = 0.0017575 k( 81) = ( 0.1269841 0.5000000 -0.0000000), wk = 0.0017575 k( 82) = ( 0.1349206 0.5000000 -0.0000000), wk = 0.0017575 k( 83) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0017575 k( 84) = ( 0.1507937 0.5000000 -0.0000000), wk = 0.0017575 k( 85) = ( 0.1587302 0.5000000 -0.0000000), wk = 0.0017575 k( 86) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0017575 k( 87) = ( 0.1746032 0.5000000 0.0000000), wk = 0.0017575 k( 88) = ( 0.1825397 0.5000000 -0.0000000), wk = 0.0017575 k( 89) = ( 0.1904762 0.5000000 -0.0000000), wk = 0.0017575 k( 90) = ( 0.1984127 0.5000000 0.0000000), wk = 0.0017575 k( 91) = ( 0.2063492 0.5000000 0.0000000), wk = 0.0017575 k( 92) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0017575 k( 93) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0017575 k( 94) = ( 0.2301587 0.5000000 -0.0000000), wk = 0.0017575 k( 95) = ( 0.2380952 0.5000000 -0.0000000), wk = 0.0017575 k( 96) = ( 0.2460317 0.5000000 0.0000000), wk = 0.0017575 k( 97) = ( 0.2539683 0.5000000 0.0000000), wk = 0.0017575 k( 98) = ( 0.2619048 0.5000000 0.0000000), wk = 0.0017575 k( 99) = ( 0.2698413 0.5000000 0.0000000), wk = 0.0017575 k( 100) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0017575 k( 101) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0017575 k( 102) = ( 0.2936508 0.5000000 -0.0000000), wk = 0.0017575 k( 103) = ( 0.3015873 0.5000000 -0.0000000), wk = 0.0017575 k( 104) = ( 0.3095238 0.5000000 -0.0000000), wk = 0.0017575 k( 105) = ( 0.3174603 0.5000000 -0.0000000), wk = 0.0017575 k( 106) = ( 0.3253968 0.5000000 -0.0000000), wk = 0.0017575 k( 107) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0017575 k( 108) = ( 0.3412698 0.5000000 -0.0000000), wk = 0.0017575 k( 109) = ( 0.3492063 0.5000000 -0.0000000), wk = 0.0017575 k( 110) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0017575 k( 111) = ( 0.3650794 0.5000000 -0.0000000), wk = 0.0017575 k( 112) = ( 0.3730159 0.5000000 -0.0000000), wk = 0.0017575 k( 113) = ( 0.3809524 0.5000000 0.0000000), wk = 0.0017575 k( 114) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0017575 k( 115) = ( 0.3968254 0.5000000 -0.0000000), wk = 0.0017575 k( 116) = ( 0.4047619 0.5000000 0.0000000), wk = 0.0017575 k( 117) = ( 0.4126984 0.5000000 0.0000000), wk = 0.0017575 k( 118) = ( 0.4206349 0.5000000 -0.0000000), wk = 0.0017575 k( 119) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0017575 k( 120) = ( 0.4365079 0.5000000 -0.0000000), wk = 0.0017575 k( 121) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0017575 k( 122) = ( 0.4523810 0.5000000 0.0000000), wk = 0.0017575 k( 123) = ( 0.4603175 0.5000000 -0.0000000), wk = 0.0017575 k( 124) = ( 0.4682540 0.5000000 -0.0000000), wk = 0.0017575 k( 125) = ( 0.4761905 0.5000000 -0.0000000), wk = 0.0017575 k( 126) = ( 0.4841270 0.5000000 -0.0000000), wk = 0.0017575 k( 127) = ( 0.4920635 0.5000000 -0.0000000), wk = 0.0017575 k( 128) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0017575 k( 129) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0017575 k( 130) = ( 0.4943182 0.4943182 -0.0000000), wk = 0.0017575 k( 131) = ( 0.4886364 0.4886364 -0.0000000), wk = 0.0017575 k( 132) = ( 0.4829545 0.4829545 -0.0000000), wk = 0.0017575 k( 133) = ( 0.4772727 0.4772727 0.0000000), wk = 0.0017575 k( 134) = ( 0.4715909 0.4715909 0.0000000), wk = 0.0017575 k( 135) = ( 0.4659091 0.4659091 -0.0000000), wk = 0.0017575 k( 136) = ( 0.4602273 0.4602273 -0.0000000), wk = 0.0017575 k( 137) = ( 0.4545455 0.4545455 -0.0000000), wk = 0.0017575 k( 138) = ( 0.4488636 0.4488636 0.0000000), wk = 0.0017575 k( 139) = ( 0.4431818 0.4431818 -0.0000000), wk = 0.0017575 k( 140) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0017575 k( 141) = ( 0.4318182 0.4318182 0.0000000), wk = 0.0017575 k( 142) = ( 0.4261364 0.4261364 -0.0000000), wk = 0.0017575 k( 143) = ( 0.4204545 0.4204545 0.0000000), wk = 0.0017575 k( 144) = ( 0.4147727 0.4147727 -0.0000000), wk = 0.0017575 k( 145) = ( 0.4090909 0.4090909 -0.0000000), wk = 0.0017575 k( 146) = ( 0.4034091 0.4034091 -0.0000000), wk = 0.0017575 k( 147) = ( 0.3977273 0.3977273 -0.0000000), wk = 0.0017575 k( 148) = ( 0.3920455 0.3920455 0.0000000), wk = 0.0017575 k( 149) = ( 0.3863636 0.3863636 0.0000000), wk = 0.0017575 k( 150) = ( 0.3806818 0.3806818 0.0000000), wk = 0.0017575 k( 151) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0017575 k( 152) = ( 0.3693182 0.3693182 0.0000000), wk = 0.0017575 k( 153) = ( 0.3636364 0.3636364 -0.0000000), wk = 0.0017575 k( 154) = ( 0.3579545 0.3579545 0.0000000), wk = 0.0017575 k( 155) = ( 0.3522727 0.3522727 0.0000000), wk = 0.0017575 k( 156) = ( 0.3465909 0.3465909 0.0000000), wk = 0.0017575 k( 157) = ( 0.3409091 0.3409091 0.0000000), wk = 0.0017575 k( 158) = ( 0.3352273 0.3352273 0.0000000), wk = 0.0017575 k( 159) = ( 0.3295455 0.3295455 -0.0000000), wk = 0.0017575 k( 160) = ( 0.3238636 0.3238636 0.0000000), wk = 0.0017575 k( 161) = ( 0.3181818 0.3181818 0.0000000), wk = 0.0017575 k( 162) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0017575 k( 163) = ( 0.3068182 0.3068182 0.0000000), wk = 0.0017575 k( 164) = ( 0.3011364 0.3011364 -0.0000000), wk = 0.0017575 k( 165) = ( 0.2954545 0.2954545 0.0000000), wk = 0.0017575 k( 166) = ( 0.2897727 0.2897727 0.0000000), wk = 0.0017575 k( 167) = ( 0.2840909 0.2840909 0.0000000), wk = 0.0017575 k( 168) = ( 0.2784091 0.2784091 -0.0000000), wk = 0.0017575 k( 169) = ( 0.2727273 0.2727273 -0.0000000), wk = 0.0017575 k( 170) = ( 0.2670455 0.2670455 0.0000000), wk = 0.0017575 k( 171) = ( 0.2613636 0.2613636 0.0000000), wk = 0.0017575 k( 172) = ( 0.2556818 0.2556818 0.0000000), wk = 0.0017575 k( 173) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0017575 k( 174) = ( 0.2443182 0.2443182 -0.0000000), wk = 0.0017575 k( 175) = ( 0.2386364 0.2386364 -0.0000000), wk = 0.0017575 k( 176) = ( 0.2329546 0.2329546 -0.0000000), wk = 0.0017575 k( 177) = ( 0.2272727 0.2272727 0.0000000), wk = 0.0017575 k( 178) = ( 0.2215909 0.2215909 -0.0000000), wk = 0.0017575 k( 179) = ( 0.2159091 0.2159091 0.0000000), wk = 0.0017575 k( 180) = ( 0.2102273 0.2102273 -0.0000000), wk = 0.0017575 k( 181) = ( 0.2045454 0.2045454 0.0000000), wk = 0.0017575 k( 182) = ( 0.1988636 0.1988636 0.0000000), wk = 0.0017575 k( 183) = ( 0.1931818 0.1931818 0.0000000), wk = 0.0017575 k( 184) = ( 0.1875000 0.1875000 0.0000000), wk = 0.0017575 k( 185) = ( 0.1818182 0.1818182 -0.0000000), wk = 0.0017575 k( 186) = ( 0.1761364 0.1761364 -0.0000000), wk = 0.0017575 k( 187) = ( 0.1704546 0.1704546 -0.0000000), wk = 0.0017575 k( 188) = ( 0.1647727 0.1647727 -0.0000000), wk = 0.0017575 k( 189) = ( 0.1590909 0.1590909 0.0000000), wk = 0.0017575 k( 190) = ( 0.1534091 0.1534091 0.0000000), wk = 0.0017575 k( 191) = ( 0.1477273 0.1477273 -0.0000000), wk = 0.0017575 k( 192) = ( 0.1420454 0.1420454 0.0000000), wk = 0.0017575 k( 193) = ( 0.1363636 0.1363636 0.0000000), wk = 0.0017575 k( 194) = ( 0.1306818 0.1306818 0.0000000), wk = 0.0017575 k( 195) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0017575 k( 196) = ( 0.1193182 0.1193182 -0.0000000), wk = 0.0017575 k( 197) = ( 0.1136364 0.1136364 -0.0000000), wk = 0.0017575 k( 198) = ( 0.1079545 0.1079545 0.0000000), wk = 0.0017575 k( 199) = ( 0.1022727 0.1022727 -0.0000000), wk = 0.0017575 k( 200) = ( 0.0965909 0.0965909 0.0000000), wk = 0.0017575 k( 201) = ( 0.0909091 0.0909091 -0.0000000), wk = 0.0017575 k( 202) = ( 0.0852273 0.0852273 0.0000000), wk = 0.0017575 k( 203) = ( 0.0795455 0.0795455 -0.0000000), wk = 0.0017575 k( 204) = ( 0.0738636 0.0738636 0.0000000), wk = 0.0017575 k( 205) = ( 0.0681818 0.0681818 0.0000000), wk = 0.0017575 k( 206) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0017575 k( 207) = ( 0.0568182 0.0568182 -0.0000000), wk = 0.0017575 k( 208) = ( 0.0511364 0.0511364 0.0000000), wk = 0.0017575 k( 209) = ( 0.0454546 0.0454546 0.0000000), wk = 0.0017575 k( 210) = ( 0.0397727 0.0397727 -0.0000000), wk = 0.0017575 k( 211) = ( 0.0340909 0.0340909 0.0000000), wk = 0.0017575 k( 212) = ( 0.0284091 0.0284091 -0.0000000), wk = 0.0017575 k( 213) = ( 0.0227273 0.0227273 -0.0000000), wk = 0.0017575 k( 214) = ( 0.0170455 0.0170455 -0.0000000), wk = 0.0017575 k( 215) = ( 0.0113636 0.0113636 -0.0000000), wk = 0.0017575 k( 216) = ( 0.0056818 0.0056818 -0.0000000), wk = 0.0017575 k( 217) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017575 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017575 k( 219) = ( 0.0000000 0.0000000 0.0113636), wk = 0.0017575 k( 220) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0017575 k( 221) = ( 0.0000000 0.0000000 0.0340909), wk = 0.0017575 k( 222) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0017575 k( 223) = ( 0.0000000 0.0000000 0.0568182), wk = 0.0017575 k( 224) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0017575 k( 225) = ( 0.0000000 0.0000000 0.0795455), wk = 0.0017575 k( 226) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0017575 k( 227) = ( 0.0000000 0.0000000 0.1022727), wk = 0.0017575 k( 228) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0017575 k( 229) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0017575 k( 230) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0017575 k( 231) = ( 0.0000000 0.0000000 0.1477273), wk = 0.0017575 k( 232) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0017575 k( 233) = ( 0.0000000 0.0000000 0.1704546), wk = 0.0017575 k( 234) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0017575 k( 235) = ( 0.0000000 0.0000000 0.1931818), wk = 0.0017575 k( 236) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0017575 k( 237) = ( 0.0000000 0.0000000 0.2159091), wk = 0.0017575 k( 238) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0017575 k( 239) = ( 0.0000000 0.0000000 0.2386364), wk = 0.0017575 k( 240) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0017575 k( 241) = ( 0.0000000 0.0000000 0.2613636), wk = 0.0017575 k( 242) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0017575 k( 243) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0017575 k( 244) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0017575 k( 245) = ( 0.0000000 0.0000000 0.3068182), wk = 0.0017575 k( 246) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0017575 k( 247) = ( 0.0000000 0.0000000 0.3295455), wk = 0.0017575 k( 248) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0017575 k( 249) = ( 0.0000000 0.0000000 0.3522727), wk = 0.0017575 k( 250) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0017575 k( 251) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0017575 k( 252) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0017575 k( 253) = ( 0.0000000 0.0000000 0.3977273), wk = 0.0017575 k( 254) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0017575 k( 255) = ( 0.0000000 0.0000000 0.4204545), wk = 0.0017575 k( 256) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0017575 k( 257) = ( 0.0000000 0.0000000 0.4431818), wk = 0.0017575 k( 258) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0017575 k( 259) = ( 0.0000000 0.0000000 0.4659091), wk = 0.0017575 k( 260) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0017575 k( 261) = ( 0.0000000 0.0000000 0.4886364), wk = 0.0017575 k( 262) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017575 k( 263) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017575 k( 264) = ( 0.0000000 0.0079365 0.5000000), wk = 0.0017575 k( 265) = ( 0.0000000 0.0158730 0.5000000), wk = 0.0017575 k( 266) = ( 0.0000000 0.0238095 0.5000000), wk = 0.0017575 k( 267) = ( 0.0000000 0.0317460 0.5000000), wk = 0.0017575 k( 268) = ( 0.0000000 0.0396825 0.5000000), wk = 0.0017575 k( 269) = ( 0.0000000 0.0476191 0.5000000), wk = 0.0017575 k( 270) = ( 0.0000000 0.0555556 0.5000000), wk = 0.0017575 k( 271) = ( 0.0000000 0.0634921 0.5000000), wk = 0.0017575 k( 272) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0017575 k( 273) = ( 0.0000000 0.0793651 0.5000000), wk = 0.0017575 k( 274) = ( 0.0000000 0.0873016 0.5000000), wk = 0.0017575 k( 275) = ( 0.0000000 0.0952381 0.5000000), wk = 0.0017575 k( 276) = ( 0.0000000 0.1031746 0.5000000), wk = 0.0017575 k( 277) = ( 0.0000000 0.1111111 0.5000000), wk = 0.0017575 k( 278) = ( 0.0000000 0.1190476 0.5000000), wk = 0.0017575 k( 279) = ( 0.0000000 0.1269841 0.5000000), wk = 0.0017575 k( 280) = ( 0.0000000 0.1349206 0.5000000), wk = 0.0017575 k( 281) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0017575 k( 282) = ( 0.0000000 0.1507937 0.5000000), wk = 0.0017575 k( 283) = ( 0.0000000 0.1587302 0.5000000), wk = 0.0017575 k( 284) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0017575 k( 285) = ( 0.0000000 0.1746032 0.5000000), wk = 0.0017575 k( 286) = ( 0.0000000 0.1825397 0.5000000), wk = 0.0017575 k( 287) = ( 0.0000000 0.1904762 0.5000000), wk = 0.0017575 k( 288) = ( 0.0000000 0.1984127 0.5000000), wk = 0.0017575 k( 289) = ( 0.0000000 0.2063492 0.5000000), wk = 0.0017575 k( 290) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0017575 k( 291) = ( 0.0000000 0.2222222 0.5000000), wk = 0.0017575 k( 292) = ( 0.0000000 0.2301587 0.5000000), wk = 0.0017575 k( 293) = ( 0.0000000 0.2380952 0.5000000), wk = 0.0017575 k( 294) = ( 0.0000000 0.2460317 0.5000000), wk = 0.0017575 k( 295) = ( 0.0000000 0.2539683 0.5000000), wk = 0.0017575 k( 296) = ( 0.0000000 0.2619048 0.5000000), wk = 0.0017575 k( 297) = ( 0.0000000 0.2698413 0.5000000), wk = 0.0017575 k( 298) = ( 0.0000000 0.2777778 0.5000000), wk = 0.0017575 k( 299) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0017575 k( 300) = ( 0.0000000 0.2936508 0.5000000), wk = 0.0017575 k( 301) = ( 0.0000000 0.3015873 0.5000000), wk = 0.0017575 k( 302) = ( 0.0000000 0.3095238 0.5000000), wk = 0.0017575 k( 303) = ( 0.0000000 0.3174603 0.5000000), wk = 0.0017575 k( 304) = ( 0.0000000 0.3253968 0.5000000), wk = 0.0017575 k( 305) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0017575 k( 306) = ( 0.0000000 0.3412698 0.5000000), wk = 0.0017575 k( 307) = ( 0.0000000 0.3492063 0.5000000), wk = 0.0017575 k( 308) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0017575 k( 309) = ( 0.0000000 0.3650794 0.5000000), wk = 0.0017575 k( 310) = ( 0.0000000 0.3730159 0.5000000), wk = 0.0017575 k( 311) = ( 0.0000000 0.3809524 0.5000000), wk = 0.0017575 k( 312) = ( 0.0000000 0.3888889 0.5000000), wk = 0.0017575 k( 313) = ( 0.0000000 0.3968254 0.5000000), wk = 0.0017575 k( 314) = ( 0.0000000 0.4047619 0.5000000), wk = 0.0017575 k( 315) = ( 0.0000000 0.4126984 0.5000000), wk = 0.0017575 k( 316) = ( 0.0000000 0.4206349 0.5000000), wk = 0.0017575 k( 317) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0017575 k( 318) = ( 0.0000000 0.4365079 0.5000000), wk = 0.0017575 k( 319) = ( 0.0000000 0.4444444 0.5000000), wk = 0.0017575 k( 320) = ( 0.0000000 0.4523810 0.5000000), wk = 0.0017575 k( 321) = ( 0.0000000 0.4603175 0.5000000), wk = 0.0017575 k( 322) = ( 0.0000000 0.4682540 0.5000000), wk = 0.0017575 k( 323) = ( 0.0000000 0.4761905 0.5000000), wk = 0.0017575 k( 324) = ( 0.0000000 0.4841270 0.5000000), wk = 0.0017575 k( 325) = ( 0.0000000 0.4920635 0.5000000), wk = 0.0017575 k( 326) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0017575 k( 327) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0017575 k( 328) = ( 0.0079365 0.5000000 0.5000000), wk = 0.0017575 k( 329) = ( 0.0158730 0.5000000 0.5000000), wk = 0.0017575 k( 330) = ( 0.0238095 0.5000000 0.5000000), wk = 0.0017575 k( 331) = ( 0.0317460 0.5000000 0.5000000), wk = 0.0017575 k( 332) = ( 0.0396825 0.5000000 0.5000000), wk = 0.0017575 k( 333) = ( 0.0476191 0.5000000 0.5000000), wk = 0.0017575 k( 334) = ( 0.0555556 0.5000000 0.5000000), wk = 0.0017575 k( 335) = ( 0.0634921 0.5000000 0.5000000), wk = 0.0017575 k( 336) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0017575 k( 337) = ( 0.0793651 0.5000000 0.5000000), wk = 0.0017575 k( 338) = ( 0.0873016 0.5000000 0.5000000), wk = 0.0017575 k( 339) = ( 0.0952381 0.5000000 0.5000000), wk = 0.0017575 k( 340) = ( 0.1031746 0.5000000 0.5000000), wk = 0.0017575 k( 341) = ( 0.1111111 0.5000000 0.5000000), wk = 0.0017575 k( 342) = ( 0.1190476 0.5000000 0.5000000), wk = 0.0017575 k( 343) = ( 0.1269841 0.5000000 0.5000000), wk = 0.0017575 k( 344) = ( 0.1349206 0.5000000 0.5000000), wk = 0.0017575 k( 345) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0017575 k( 346) = ( 0.1507937 0.5000000 0.5000000), wk = 0.0017575 k( 347) = ( 0.1587302 0.5000000 0.5000000), wk = 0.0017575 k( 348) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0017575 k( 349) = ( 0.1746032 0.5000000 0.5000000), wk = 0.0017575 k( 350) = ( 0.1825397 0.5000000 0.5000000), wk = 0.0017575 k( 351) = ( 0.1904762 0.5000000 0.5000000), wk = 0.0017575 k( 352) = ( 0.1984127 0.5000000 0.5000000), wk = 0.0017575 k( 353) = ( 0.2063492 0.5000000 0.5000000), wk = 0.0017575 k( 354) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0017575 k( 355) = ( 0.2222222 0.5000000 0.5000000), wk = 0.0017575 k( 356) = ( 0.2301587 0.5000000 0.5000000), wk = 0.0017575 k( 357) = ( 0.2380952 0.5000000 0.5000000), wk = 0.0017575 k( 358) = ( 0.2460317 0.5000000 0.5000000), wk = 0.0017575 k( 359) = ( 0.2539683 0.5000000 0.5000000), wk = 0.0017575 k( 360) = ( 0.2619048 0.5000000 0.5000000), wk = 0.0017575 k( 361) = ( 0.2698413 0.5000000 0.5000000), wk = 0.0017575 k( 362) = ( 0.2777778 0.5000000 0.5000000), wk = 0.0017575 k( 363) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0017575 k( 364) = ( 0.2936508 0.5000000 0.5000000), wk = 0.0017575 k( 365) = ( 0.3015873 0.5000000 0.5000000), wk = 0.0017575 k( 366) = ( 0.3095238 0.5000000 0.5000000), wk = 0.0017575 k( 367) = ( 0.3174603 0.5000000 0.5000000), wk = 0.0017575 k( 368) = ( 0.3253968 0.5000000 0.5000000), wk = 0.0017575 k( 369) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0017575 k( 370) = ( 0.3412698 0.5000000 0.5000000), wk = 0.0017575 k( 371) = ( 0.3492063 0.5000000 0.5000000), wk = 0.0017575 k( 372) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0017575 k( 373) = ( 0.3650794 0.5000000 0.5000000), wk = 0.0017575 k( 374) = ( 0.3730159 0.5000000 0.5000000), wk = 0.0017575 k( 375) = ( 0.3809524 0.5000000 0.5000000), wk = 0.0017575 k( 376) = ( 0.3888889 0.5000000 0.5000000), wk = 0.0017575 k( 377) = ( 0.3968254 0.5000000 0.5000000), wk = 0.0017575 k( 378) = ( 0.4047619 0.5000000 0.5000000), wk = 0.0017575 k( 379) = ( 0.4126984 0.5000000 0.5000000), wk = 0.0017575 k( 380) = ( 0.4206349 0.5000000 0.5000000), wk = 0.0017575 k( 381) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0017575 k( 382) = ( 0.4365079 0.5000000 0.5000000), wk = 0.0017575 k( 383) = ( 0.4444444 0.5000000 0.5000000), wk = 0.0017575 k( 384) = ( 0.4523810 0.5000000 0.5000000), wk = 0.0017575 k( 385) = ( 0.4603175 0.5000000 0.5000000), wk = 0.0017575 k( 386) = ( 0.4682540 0.5000000 0.5000000), wk = 0.0017575 k( 387) = ( 0.4761905 0.5000000 0.5000000), wk = 0.0017575 k( 388) = ( 0.4841270 0.5000000 0.5000000), wk = 0.0017575 k( 389) = ( 0.4920635 0.5000000 0.5000000), wk = 0.0017575 k( 390) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0017575 k( 391) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0017575 k( 392) = ( 0.4943182 0.4943182 0.5000000), wk = 0.0017575 k( 393) = ( 0.4886364 0.4886364 0.5000000), wk = 0.0017575 k( 394) = ( 0.4829545 0.4829545 0.5000000), wk = 0.0017575 k( 395) = ( 0.4772727 0.4772727 0.5000000), wk = 0.0017575 k( 396) = ( 0.4715909 0.4715909 0.5000000), wk = 0.0017575 k( 397) = ( 0.4659091 0.4659091 0.5000000), wk = 0.0017575 k( 398) = ( 0.4602273 0.4602273 0.5000000), wk = 0.0017575 k( 399) = ( 0.4545455 0.4545455 0.5000000), wk = 0.0017575 k( 400) = ( 0.4488636 0.4488636 0.5000000), wk = 0.0017575 k( 401) = ( 0.4431818 0.4431818 0.5000000), wk = 0.0017575 k( 402) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0017575 k( 403) = ( 0.4318182 0.4318182 0.5000000), wk = 0.0017575 k( 404) = ( 0.4261364 0.4261364 0.5000000), wk = 0.0017575 k( 405) = ( 0.4204545 0.4204545 0.5000000), wk = 0.0017575 k( 406) = ( 0.4147727 0.4147727 0.5000000), wk = 0.0017575 k( 407) = ( 0.4090909 0.4090909 0.5000000), wk = 0.0017575 k( 408) = ( 0.4034091 0.4034091 0.5000000), wk = 0.0017575 k( 409) = ( 0.3977273 0.3977273 0.5000000), wk = 0.0017575 k( 410) = ( 0.3920455 0.3920455 0.5000000), wk = 0.0017575 k( 411) = ( 0.3863636 0.3863636 0.5000000), wk = 0.0017575 k( 412) = ( 0.3806818 0.3806818 0.5000000), wk = 0.0017575 k( 413) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0017575 k( 414) = ( 0.3693182 0.3693182 0.5000000), wk = 0.0017575 k( 415) = ( 0.3636364 0.3636364 0.5000000), wk = 0.0017575 k( 416) = ( 0.3579545 0.3579545 0.5000000), wk = 0.0017575 k( 417) = ( 0.3522727 0.3522727 0.5000000), wk = 0.0017575 k( 418) = ( 0.3465909 0.3465909 0.5000000), wk = 0.0017575 k( 419) = ( 0.3409091 0.3409091 0.5000000), wk = 0.0017575 k( 420) = ( 0.3352273 0.3352273 0.5000000), wk = 0.0017575 k( 421) = ( 0.3295455 0.3295455 0.5000000), wk = 0.0017575 k( 422) = ( 0.3238636 0.3238636 0.5000000), wk = 0.0017575 k( 423) = ( 0.3181818 0.3181818 0.5000000), wk = 0.0017575 k( 424) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0017575 k( 425) = ( 0.3068182 0.3068182 0.5000000), wk = 0.0017575 k( 426) = ( 0.3011364 0.3011364 0.5000000), wk = 0.0017575 k( 427) = ( 0.2954545 0.2954545 0.5000000), wk = 0.0017575 k( 428) = ( 0.2897727 0.2897727 0.5000000), wk = 0.0017575 k( 429) = ( 0.2840909 0.2840909 0.5000000), wk = 0.0017575 k( 430) = ( 0.2784091 0.2784091 0.5000000), wk = 0.0017575 k( 431) = ( 0.2727273 0.2727273 0.5000000), wk = 0.0017575 k( 432) = ( 0.2670455 0.2670455 0.5000000), wk = 0.0017575 k( 433) = ( 0.2613636 0.2613636 0.5000000), wk = 0.0017575 k( 434) = ( 0.2556818 0.2556818 0.5000000), wk = 0.0017575 k( 435) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0017575 k( 436) = ( 0.2443182 0.2443182 0.5000000), wk = 0.0017575 k( 437) = ( 0.2386364 0.2386364 0.5000000), wk = 0.0017575 k( 438) = ( 0.2329546 0.2329546 0.5000000), wk = 0.0017575 k( 439) = ( 0.2272727 0.2272727 0.5000000), wk = 0.0017575 k( 440) = ( 0.2215909 0.2215909 0.5000000), wk = 0.0017575 k( 441) = ( 0.2159091 0.2159091 0.5000000), wk = 0.0017575 k( 442) = ( 0.2102273 0.2102273 0.5000000), wk = 0.0017575 k( 443) = ( 0.2045454 0.2045454 0.5000000), wk = 0.0017575 k( 444) = ( 0.1988636 0.1988636 0.5000000), wk = 0.0017575 k( 445) = ( 0.1931818 0.1931818 0.5000000), wk = 0.0017575 k( 446) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0017575 k( 447) = ( 0.1818182 0.1818182 0.5000000), wk = 0.0017575 k( 448) = ( 0.1761364 0.1761364 0.5000000), wk = 0.0017575 k( 449) = ( 0.1704546 0.1704546 0.5000000), wk = 0.0017575 k( 450) = ( 0.1647727 0.1647727 0.5000000), wk = 0.0017575 k( 451) = ( 0.1590909 0.1590909 0.5000000), wk = 0.0017575 k( 452) = ( 0.1534091 0.1534091 0.5000000), wk = 0.0017575 k( 453) = ( 0.1477273 0.1477273 0.5000000), wk = 0.0017575 k( 454) = ( 0.1420454 0.1420454 0.5000000), wk = 0.0017575 k( 455) = ( 0.1363636 0.1363636 0.5000000), wk = 0.0017575 k( 456) = ( 0.1306818 0.1306818 0.5000000), wk = 0.0017575 k( 457) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0017575 k( 458) = ( 0.1193182 0.1193182 0.5000000), wk = 0.0017575 k( 459) = ( 0.1136364 0.1136364 0.5000000), wk = 0.0017575 k( 460) = ( 0.1079545 0.1079545 0.5000000), wk = 0.0017575 k( 461) = ( 0.1022727 0.1022727 0.5000000), wk = 0.0017575 k( 462) = ( 0.0965909 0.0965909 0.5000000), wk = 0.0017575 k( 463) = ( 0.0909091 0.0909091 0.5000000), wk = 0.0017575 k( 464) = ( 0.0852273 0.0852273 0.5000000), wk = 0.0017575 k( 465) = ( 0.0795455 0.0795455 0.5000000), wk = 0.0017575 k( 466) = ( 0.0738636 0.0738636 0.5000000), wk = 0.0017575 k( 467) = ( 0.0681818 0.0681818 0.5000000), wk = 0.0017575 k( 468) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0017575 k( 469) = ( 0.0568182 0.0568182 0.5000000), wk = 0.0017575 k( 470) = ( 0.0511364 0.0511364 0.5000000), wk = 0.0017575 k( 471) = ( 0.0454546 0.0454546 0.5000000), wk = 0.0017575 k( 472) = ( 0.0397727 0.0397727 0.5000000), wk = 0.0017575 k( 473) = ( 0.0340909 0.0340909 0.5000000), wk = 0.0017575 k( 474) = ( 0.0284091 0.0284091 0.5000000), wk = 0.0017575 k( 475) = ( 0.0227273 0.0227273 0.5000000), wk = 0.0017575 k( 476) = ( 0.0170455 0.0170455 0.5000000), wk = 0.0017575 k( 477) = ( 0.0113636 0.0113636 0.5000000), wk = 0.0017575 k( 478) = ( 0.0056818 0.0056818 0.5000000), wk = 0.0017575 k( 479) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017575 k( 480) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017575 k( 481) = ( 0.0000000 0.5000000 0.0113636), wk = 0.0017575 k( 482) = ( 0.0000000 0.5000000 0.0227273), wk = 0.0017575 k( 483) = ( 0.0000000 0.5000000 0.0340909), wk = 0.0017575 k( 484) = ( 0.0000000 0.5000000 0.0454546), wk = 0.0017575 k( 485) = ( 0.0000000 0.5000000 0.0568182), wk = 0.0017575 k( 486) = ( 0.0000000 0.5000000 0.0681818), wk = 0.0017575 k( 487) = ( 0.0000000 0.5000000 0.0795455), wk = 0.0017575 k( 488) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0017575 k( 489) = ( 0.0000000 0.5000000 0.1022727), wk = 0.0017575 k( 490) = ( 0.0000000 0.5000000 0.1136364), wk = 0.0017575 k( 491) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0017575 k( 492) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0017575 k( 493) = ( 0.0000000 0.5000000 0.1477273), wk = 0.0017575 k( 494) = ( 0.0000000 0.5000000 0.1590909), wk = 0.0017575 k( 495) = ( 0.0000000 0.5000000 0.1704546), wk = 0.0017575 k( 496) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0017575 k( 497) = ( 0.0000000 0.5000000 0.1931818), wk = 0.0017575 k( 498) = ( 0.0000000 0.5000000 0.2045454), wk = 0.0017575 k( 499) = ( 0.0000000 0.5000000 0.2159091), wk = 0.0017575 k( 500) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0017575 k( 501) = ( 0.0000000 0.5000000 0.2386364), wk = 0.0017575 k( 502) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0017575 k( 503) = ( 0.0000000 0.5000000 0.2613636), wk = 0.0017575 k( 504) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0017575 k( 505) = ( 0.0000000 0.5000000 0.2840909), wk = 0.0017575 k( 506) = ( 0.0000000 0.5000000 0.2954546), wk = 0.0017575 k( 507) = ( 0.0000000 0.5000000 0.3068182), wk = 0.0017575 k( 508) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0017575 k( 509) = ( 0.0000000 0.5000000 0.3295455), wk = 0.0017575 k( 510) = ( 0.0000000 0.5000000 0.3409091), wk = 0.0017575 k( 511) = ( 0.0000000 0.5000000 0.3522727), wk = 0.0017575 k( 512) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0017575 k( 513) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0017575 k( 514) = ( 0.0000000 0.5000000 0.3863636), wk = 0.0017575 k( 515) = ( 0.0000000 0.5000000 0.3977273), wk = 0.0017575 k( 516) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0017575 k( 517) = ( 0.0000000 0.5000000 0.4204545), wk = 0.0017575 k( 518) = ( 0.0000000 0.5000000 0.4318182), wk = 0.0017575 k( 519) = ( 0.0000000 0.5000000 0.4431818), wk = 0.0017575 k( 520) = ( 0.0000000 0.5000000 0.4545455), wk = 0.0017575 k( 521) = ( 0.0000000 0.5000000 0.4659091), wk = 0.0017575 k( 522) = ( 0.0000000 0.5000000 0.4772727), wk = 0.0017575 k( 523) = ( 0.0000000 0.5000000 0.4886364), wk = 0.0017575 k( 524) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0017575 k( 525) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0017575 k( 526) = ( 0.5000000 0.5000000 0.0113636), wk = 0.0017575 k( 527) = ( 0.5000000 0.5000000 0.0227273), wk = 0.0017575 k( 528) = ( 0.5000000 0.5000000 0.0340909), wk = 0.0017575 k( 529) = ( 0.5000000 0.5000000 0.0454546), wk = 0.0017575 k( 530) = ( 0.5000000 0.5000000 0.0568182), wk = 0.0017575 k( 531) = ( 0.5000000 0.5000000 0.0681818), wk = 0.0017575 k( 532) = ( 0.5000000 0.5000000 0.0795455), wk = 0.0017575 k( 533) = ( 0.5000000 0.5000000 0.0909091), wk = 0.0017575 k( 534) = ( 0.5000000 0.5000000 0.1022727), wk = 0.0017575 k( 535) = ( 0.5000000 0.5000000 0.1136364), wk = 0.0017575 k( 536) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0017575 k( 537) = ( 0.5000000 0.5000000 0.1363636), wk = 0.0017575 k( 538) = ( 0.5000000 0.5000000 0.1477273), wk = 0.0017575 k( 539) = ( 0.5000000 0.5000000 0.1590909), wk = 0.0017575 k( 540) = ( 0.5000000 0.5000000 0.1704546), wk = 0.0017575 k( 541) = ( 0.5000000 0.5000000 0.1818182), wk = 0.0017575 k( 542) = ( 0.5000000 0.5000000 0.1931818), wk = 0.0017575 k( 543) = ( 0.5000000 0.5000000 0.2045454), wk = 0.0017575 k( 544) = ( 0.5000000 0.5000000 0.2159091), wk = 0.0017575 k( 545) = ( 0.5000000 0.5000000 0.2272727), wk = 0.0017575 k( 546) = ( 0.5000000 0.5000000 0.2386364), wk = 0.0017575 k( 547) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0017575 k( 548) = ( 0.5000000 0.5000000 0.2613636), wk = 0.0017575 k( 549) = ( 0.5000000 0.5000000 0.2727273), wk = 0.0017575 k( 550) = ( 0.5000000 0.5000000 0.2840909), wk = 0.0017575 k( 551) = ( 0.5000000 0.5000000 0.2954545), wk = 0.0017575 k( 552) = ( 0.5000000 0.5000000 0.3068182), wk = 0.0017575 k( 553) = ( 0.5000000 0.5000000 0.3181818), wk = 0.0017575 k( 554) = ( 0.5000000 0.5000000 0.3295455), wk = 0.0017575 k( 555) = ( 0.5000000 0.5000000 0.3409091), wk = 0.0017575 k( 556) = ( 0.5000000 0.5000000 0.3522727), wk = 0.0017575 k( 557) = ( 0.5000000 0.5000000 0.3636364), wk = 0.0017575 k( 558) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0017575 k( 559) = ( 0.5000000 0.5000000 0.3863636), wk = 0.0017575 k( 560) = ( 0.5000000 0.5000000 0.3977273), wk = 0.0017575 k( 561) = ( 0.5000000 0.5000000 0.4090909), wk = 0.0017575 k( 562) = ( 0.5000000 0.5000000 0.4204545), wk = 0.0017575 k( 563) = ( 0.5000000 0.5000000 0.4318182), wk = 0.0017575 k( 564) = ( 0.5000000 0.5000000 0.4431818), wk = 0.0017575 k( 565) = ( 0.5000000 0.5000000 0.4545455), wk = 0.0017575 k( 566) = ( 0.5000000 0.5000000 0.4659091), wk = 0.0017575 k( 567) = ( 0.5000000 0.5000000 0.4772727), wk = 0.0017575 k( 568) = ( 0.5000000 0.5000000 0.4886364), wk = 0.0017575 k( 569) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0017575 Dense grid: 9709 G-vectors FFT dimensions: ( 24, 24, 36) Smooth grid: 6569 G-vectors FFT dimensions: ( 24, 24, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.02 Mb ( 50, 26) NL pseudopotentials 0.03 Mb ( 25, 68) Each V/rho on FFT grid 0.01 Mb ( 576) Each G-vector array 0.00 Mb ( 268) G-vector shells 0.00 Mb ( 140) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.08 Mb ( 50, 104) Each subspace H/S matrix 0.01 Mb ( 26, 26) Each matrix 0.05 Mb ( 68, 2, 26) The potential is recalculated from file : ./FeNi.save/charge-density.dat Starting wfc are 36 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.7 secs Computing kpt #: 2 total cpu time spent up to now is 3.0 secs Computing kpt #: 3 total cpu time spent up to now is 3.0 secs Computing kpt #: 4 total cpu time spent up to now is 3.1 secs Computing kpt #: 5 total cpu time spent up to now is 3.2 secs Computing kpt #: 6 total cpu time spent up to now is 3.2 secs Computing kpt #: 7 total cpu time spent up to now is 3.3 secs Computing kpt #: 8 total cpu time spent up to now is 3.4 secs Computing kpt #: 9 total cpu time spent up to now is 3.5 secs Computing kpt #: 10 total cpu time spent up to now is 3.5 secs Computing kpt #: 11 total cpu time spent up to now is 3.6 secs Computing kpt #: 12 total cpu time spent up to now is 3.7 secs Computing kpt #: 13 total cpu time spent up to now is 3.8 secs Computing kpt #: 14 total cpu time spent up to now is 3.8 secs Computing kpt #: 15 total cpu time spent up to now is 3.9 secs Computing kpt #: 16 total cpu time spent up to now is 4.0 secs Computing kpt #: 17 total cpu time spent up to now is 4.1 secs Computing kpt #: 18 total cpu time spent up to now is 4.2 secs Computing kpt #: 19 total cpu time spent up to now is 4.2 secs Computing kpt #: 20 total cpu time spent up to now is 4.3 secs Computing kpt #: 21 total cpu time spent up to now is 4.4 secs Computing kpt #: 22 total cpu time spent up to now is 4.5 secs Computing kpt #: 23 total cpu time spent up to now is 4.6 secs Computing kpt #: 24 total cpu time spent up to now is 4.9 secs Computing kpt #: 25 total cpu time spent up to now is 5.0 secs Computing kpt #: 26 total cpu time spent up to now is 5.1 secs Computing kpt #: 27 total cpu time spent up to now is 5.2 secs Computing kpt #: 28 total cpu time spent up to now is 5.3 secs Computing kpt #: 29 total cpu time spent up to now is 5.3 secs Computing kpt #: 30 total cpu time spent up to now is 5.4 secs Computing kpt #: 31 total cpu time spent up to now is 5.5 secs Computing kpt #: 32 total cpu time spent up to now is 5.6 secs Computing kpt #: 33 total cpu time spent up to now is 5.7 secs Computing kpt #: 34 total cpu time spent up to now is 5.7 secs Computing kpt #: 35 total cpu time spent up to now is 5.8 secs Computing kpt #: 36 total cpu time spent up to now is 5.9 secs Computing kpt #: 37 total cpu time spent up to now is 6.0 secs Computing kpt #: 38 total cpu time spent up to now is 6.0 secs Computing kpt #: 39 total cpu time spent up to now is 6.1 secs Computing kpt #: 40 total cpu time spent up to now is 6.2 secs Computing kpt #: 41 total cpu time spent up to now is 6.3 secs Computing kpt #: 42 total cpu time spent up to now is 6.3 secs Computing kpt #: 43 total cpu time spent up to now is 6.4 secs Computing kpt #: 44 total cpu time spent up to now is 6.5 secs Computing kpt #: 45 total cpu time spent up to now is 6.5 secs Computing kpt #: 46 total cpu time spent up to now is 6.6 secs Computing kpt #: 47 total cpu time spent up to now is 6.7 secs Computing kpt #: 48 total cpu time spent up to now is 6.8 secs Computing kpt #: 49 total cpu time spent up to now is 6.8 secs Computing kpt #: 50 total cpu time spent up to now is 6.9 secs Computing kpt #: 51 total cpu time spent up to now is 7.0 secs Computing kpt #: 52 total cpu time spent up to now is 7.1 secs Computing kpt #: 53 total cpu time spent up to now is 7.2 secs Computing kpt #: 54 total cpu time spent up to now is 7.2 secs Computing kpt #: 55 total cpu time spent up to now is 7.3 secs Computing kpt #: 56 total cpu time spent up to now is 7.4 secs Computing kpt #: 57 total cpu time spent up to now is 7.5 secs Computing kpt #: 58 total cpu time spent up to now is 7.6 secs Computing kpt #: 59 total cpu time spent up to now is 7.7 secs Computing kpt #: 60 total cpu time spent up to now is 7.8 secs Computing kpt #: 61 total cpu time spent up to now is 7.8 secs Computing kpt #: 62 total cpu time spent up to now is 8.0 secs Computing kpt #: 63 total cpu time spent up to now is 8.1 secs Computing kpt #: 64 total cpu time spent up to now is 8.3 secs Computing kpt #: 65 total cpu time spent up to now is 8.4 secs Computing kpt #: 66 total cpu time spent up to now is 8.6 secs Computing kpt #: 67 total cpu time spent up to now is 8.8 secs Computing kpt #: 68 total cpu time spent up to now is 9.0 secs Computing kpt #: 69 total cpu time spent up to now is 9.1 secs Computing kpt #: 70 total cpu time spent up to now is 9.4 secs Computing kpt #: 71 total cpu time spent up to now is 9.5 secs Computing kpt #: 72 total cpu time spent up to now is 9.6 secs Computing kpt #: 73 total cpu time spent up to now is 9.7 secs Computing kpt #: 74 total cpu time spent up to now is 9.8 secs Computing kpt #: 75 total cpu time spent up to now is 9.9 secs Computing kpt #: 76 total cpu time spent up to now is 10.0 secs Computing kpt #: 77 total cpu time spent up to now is 10.1 secs Computing kpt #: 78 total cpu time spent up to now is 10.2 secs Computing kpt #: 79 total cpu time spent up to now is 10.4 secs Computing kpt #: 80 total cpu time spent up to now is 10.5 secs Computing kpt #: 81 total cpu time spent up to now is 10.7 secs Computing kpt #: 82 total cpu time spent up to now is 10.9 secs Computing kpt #: 83 total cpu time spent up to now is 11.0 secs Computing kpt #: 84 total cpu time spent up to now is 11.1 secs Computing kpt #: 85 total cpu time spent up to now is 11.3 secs Computing kpt #: 86 total cpu time spent up to now is 11.4 secs Computing kpt #: 87 total cpu time spent up to now is 11.5 secs Computing kpt #: 88 total cpu time spent up to now is 11.6 secs Computing kpt #: 89 total cpu time spent up to now is 11.7 secs Computing kpt #: 90 total cpu time spent up to now is 11.8 secs Computing kpt #: 91 total cpu time spent up to now is 11.9 secs Computing kpt #: 92 total cpu time spent up to now is 12.0 secs Computing kpt #: 93 total cpu time spent up to now is 12.1 secs Computing kpt #: 94 total cpu time spent up to now is 12.2 secs Computing kpt #: 95 total cpu time spent up to now is 12.3 secs Computing kpt #: 96 total cpu time spent up to now is 12.5 secs Computing kpt #: 97 total cpu time spent up to now is 12.6 secs Computing kpt #: 98 total cpu time spent up to now is 12.7 secs Computing kpt #: 99 total cpu time spent up to now is 12.8 secs Computing kpt #: 100 total cpu time spent up to now is 13.0 secs Computing kpt #: 101 total cpu time spent up to now is 13.2 secs Computing kpt #: 102 total cpu time spent up to now is 13.3 secs Computing kpt #: 103 total cpu time spent up to now is 13.5 secs Computing kpt #: 104 total cpu time spent up to now is 13.7 secs Computing kpt #: 105 total cpu time spent up to now is 13.8 secs Computing kpt #: 106 total cpu time spent up to now is 14.0 secs Computing kpt #: 107 total cpu time spent up to now is 14.1 secs Computing kpt #: 108 total cpu time spent up to now is 14.3 secs Computing kpt #: 109 total cpu time spent up to now is 14.4 secs Computing kpt #: 110 total cpu time spent up to now is 14.5 secs Computing kpt #: 111 total cpu time spent up to now is 14.7 secs Computing kpt #: 112 total cpu time spent up to now is 15.0 secs Computing kpt #: 113 total cpu time spent up to now is 15.1 secs Computing kpt #: 114 total cpu time spent up to now is 15.2 secs Computing kpt #: 115 total cpu time spent up to now is 15.4 secs Computing kpt #: 116 total cpu time spent up to now is 15.5 secs Computing kpt #: 117 total cpu time spent up to now is 15.6 secs Computing kpt #: 118 total cpu time spent up to now is 15.7 secs Computing kpt #: 119 total cpu time spent up to now is 15.8 secs Computing kpt #: 120 total cpu time spent up to now is 15.9 secs Computing kpt #: 121 total cpu time spent up to now is 16.1 secs Computing kpt #: 122 total cpu time spent up to now is 16.2 secs Computing kpt #: 123 total cpu time spent up to now is 16.3 secs Computing kpt #: 124 total cpu time spent up to now is 16.4 secs Computing kpt #: 125 total cpu time spent up to now is 16.5 secs Computing kpt #: 126 total cpu time spent up to now is 16.6 secs Computing kpt #: 127 total cpu time spent up to now is 16.7 secs Computing kpt #: 128 total cpu time spent up to now is 16.8 secs Computing kpt #: 129 total cpu time spent up to now is 16.9 secs Computing kpt #: 130 total cpu time spent up to now is 17.0 secs Computing kpt #: 131 total cpu time spent up to now is 17.1 secs Computing kpt #: 132 total cpu time spent up to now is 17.2 secs Computing kpt #: 133 total cpu time spent up to now is 17.3 secs Computing kpt #: 134 total cpu time spent up to now is 17.4 secs Computing kpt #: 135 total cpu time spent up to now is 17.5 secs Computing kpt #: 136 total cpu time spent up to now is 17.6 secs Computing kpt #: 137 total cpu time spent up to now is 17.7 secs Computing kpt #: 138 total cpu time spent up to now is 17.7 secs Computing kpt #: 139 total cpu time spent up to now is 17.8 secs Computing kpt #: 140 total cpu time spent up to now is 17.9 secs Computing kpt #: 141 total cpu time spent up to now is 18.0 secs Computing kpt #: 142 total cpu time spent up to now is 18.1 secs Computing kpt #: 143 total cpu time spent up to now is 18.2 secs Computing kpt #: 144 total cpu time spent up to now is 18.3 secs Computing kpt #: 145 total cpu time spent up to now is 18.4 secs Computing kpt #: 146 total cpu time spent up to now is 18.4 secs Computing kpt #: 147 total cpu time spent up to now is 18.5 secs Computing kpt #: 148 total cpu time spent up to now is 18.6 secs Computing kpt #: 149 total cpu time spent up to now is 18.7 secs Computing kpt #: 150 total cpu time spent up to now is 18.8 secs Computing kpt #: 151 total cpu time spent up to now is 18.9 secs Computing kpt #: 152 total cpu time spent up to now is 18.9 secs Computing kpt #: 153 total cpu time spent up to now is 19.0 secs Computing kpt #: 154 total cpu time spent up to now is 19.1 secs Computing kpt #: 155 total cpu time spent up to now is 19.2 secs Computing kpt #: 156 total cpu time spent up to now is 19.3 secs Computing kpt #: 157 total cpu time spent up to now is 19.5 secs Computing kpt #: 158 total cpu time spent up to now is 19.6 secs Computing kpt #: 159 total cpu time spent up to now is 19.7 secs Computing kpt #: 160 total cpu time spent up to now is 19.8 secs Computing kpt #: 161 total cpu time spent up to now is 20.0 secs Computing kpt #: 162 total cpu time spent up to now is 20.1 secs Computing kpt #: 163 total cpu time spent up to now is 20.2 secs Computing kpt #: 164 total cpu time spent up to now is 20.3 secs Computing kpt #: 165 total cpu time spent up to now is 20.4 secs Computing kpt #: 166 total cpu time spent up to now is 20.5 secs Computing kpt #: 167 total cpu time spent up to now is 20.5 secs Computing kpt #: 168 total cpu time spent up to now is 20.6 secs Computing kpt #: 169 total cpu time spent up to now is 20.7 secs Computing kpt #: 170 total cpu time spent up to now is 20.8 secs Computing kpt #: 171 total cpu time spent up to now is 20.9 secs Computing kpt #: 172 total cpu time spent up to now is 20.9 secs Computing kpt #: 173 total cpu time spent up to now is 21.0 secs Computing kpt #: 174 total cpu time spent up to now is 21.1 secs Computing kpt #: 175 total cpu time spent up to now is 21.2 secs Computing kpt #: 176 total cpu time spent up to now is 21.2 secs Computing kpt #: 177 total cpu time spent up to now is 21.3 secs Computing kpt #: 178 total cpu time spent up to now is 21.4 secs Computing kpt #: 179 total cpu time spent up to now is 21.5 secs Computing kpt #: 180 total cpu time spent up to now is 21.5 secs Computing kpt #: 181 total cpu time spent up to now is 21.6 secs Computing kpt #: 182 total cpu time spent up to now is 21.7 secs Computing kpt #: 183 total cpu time spent up to now is 21.8 secs Computing kpt #: 184 total cpu time spent up to now is 21.9 secs Computing kpt #: 185 total cpu time spent up to now is 22.0 secs Computing kpt #: 186 total cpu time spent up to now is 22.1 secs Computing kpt #: 187 total cpu time spent up to now is 22.3 secs Computing kpt #: 188 total cpu time spent up to now is 22.3 secs Computing kpt #: 189 total cpu time spent up to now is 22.4 secs Computing kpt #: 190 total cpu time spent up to now is 22.5 secs Computing kpt #: 191 total cpu time spent up to now is 22.6 secs Computing kpt #: 192 total cpu time spent up to now is 22.7 secs Computing kpt #: 193 total cpu time spent up to now is 22.8 secs Computing kpt #: 194 total cpu time spent up to now is 22.8 secs Computing kpt #: 195 total cpu time spent up to now is 22.9 secs Computing kpt #: 196 total cpu time spent up to now is 23.0 secs Computing kpt #: 197 total cpu time spent up to now is 23.1 secs Computing kpt #: 198 total cpu time spent up to now is 23.1 secs Computing kpt #: 199 total cpu time spent up to now is 23.2 secs Computing kpt #: 200 total cpu time spent up to now is 23.3 secs Computing kpt #: 201 total cpu time spent up to now is 23.4 secs Computing kpt #: 202 total cpu time spent up to now is 23.4 secs Computing kpt #: 203 total cpu time spent up to now is 23.5 secs Computing kpt #: 204 total cpu time spent up to now is 23.6 secs Computing kpt #: 205 total cpu time spent up to now is 23.7 secs Computing kpt #: 206 total cpu time spent up to now is 23.7 secs Computing kpt #: 207 total cpu time spent up to now is 23.8 secs Computing kpt #: 208 total cpu time spent up to now is 23.9 secs Computing kpt #: 209 total cpu time spent up to now is 24.0 secs Computing kpt #: 210 total cpu time spent up to now is 24.1 secs Computing kpt #: 211 total cpu time spent up to now is 24.1 secs Computing kpt #: 212 total cpu time spent up to now is 24.2 secs Computing kpt #: 213 total cpu time spent up to now is 24.3 secs Computing kpt #: 214 total cpu time spent up to now is 24.3 secs Computing kpt #: 215 total cpu time spent up to now is 24.4 secs Computing kpt #: 216 total cpu time spent up to now is 24.5 secs Computing kpt #: 217 total cpu time spent up to now is 24.5 secs Computing kpt #: 218 total cpu time spent up to now is 24.6 secs Computing kpt #: 219 total cpu time spent up to now is 24.7 secs Computing kpt #: 220 total cpu time spent up to now is 24.7 secs Computing kpt #: 221 total cpu time spent up to now is 24.8 secs Computing kpt #: 222 total cpu time spent up to now is 24.9 secs Computing kpt #: 223 total cpu time spent up to now is 25.0 secs Computing kpt #: 224 total cpu time spent up to now is 25.0 secs Computing kpt #: 225 total cpu time spent up to now is 25.1 secs Computing kpt #: 226 total cpu time spent up to now is 25.2 secs Computing kpt #: 227 total cpu time spent up to now is 25.2 secs Computing kpt #: 228 total cpu time spent up to now is 25.3 secs Computing kpt #: 229 total cpu time spent up to now is 25.4 secs Computing kpt #: 230 total cpu time spent up to now is 25.4 secs Computing kpt #: 231 total cpu time spent up to now is 25.5 secs Computing kpt #: 232 total cpu time spent up to now is 25.6 secs Computing kpt #: 233 total cpu time spent up to now is 25.7 secs Computing kpt #: 234 total cpu time spent up to now is 25.7 secs Computing kpt #: 235 total cpu time spent up to now is 25.8 secs Computing kpt #: 236 total cpu time spent up to now is 25.9 secs Computing kpt #: 237 total cpu time spent up to now is 26.0 secs Computing kpt #: 238 total cpu time spent up to now is 26.0 secs Computing kpt #: 239 total cpu time spent up to now is 26.1 secs Computing kpt #: 240 total cpu time spent up to now is 26.2 secs Computing kpt #: 241 total cpu time spent up to now is 26.3 secs Computing kpt #: 242 total cpu time spent up to now is 26.3 secs Computing kpt #: 243 total cpu time spent up to now is 26.4 secs Computing kpt #: 244 total cpu time spent up to now is 26.5 secs Computing kpt #: 245 total cpu time spent up to now is 26.6 secs Computing kpt #: 246 total cpu time spent up to now is 26.7 secs Computing kpt #: 247 total cpu time spent up to now is 26.8 secs Computing kpt #: 248 total cpu time spent up to now is 26.8 secs Computing kpt #: 249 total cpu time spent up to now is 26.9 secs Computing kpt #: 250 total cpu time spent up to now is 27.1 secs Computing kpt #: 251 total cpu time spent up to now is 27.2 secs Computing kpt #: 252 total cpu time spent up to now is 27.4 secs Computing kpt #: 253 total cpu time spent up to now is 27.5 secs Computing kpt #: 254 total cpu time spent up to now is 27.7 secs Computing kpt #: 255 total cpu time spent up to now is 27.9 secs Computing kpt #: 256 total cpu time spent up to now is 28.0 secs Computing kpt #: 257 total cpu time spent up to now is 28.2 secs Computing kpt #: 258 total cpu time spent up to now is 28.4 secs Computing kpt #: 259 total cpu time spent up to now is 28.5 secs Computing kpt #: 260 total cpu time spent up to now is 28.7 secs Computing kpt #: 261 total cpu time spent up to now is 28.8 secs Computing kpt #: 262 total cpu time spent up to now is 29.0 secs Computing kpt #: 263 total cpu time spent up to now is 29.1 secs Computing kpt #: 264 total cpu time spent up to now is 29.3 secs Computing kpt #: 265 total cpu time spent up to now is 29.5 secs Computing kpt #: 266 total cpu time spent up to now is 29.6 secs Computing kpt #: 267 total cpu time spent up to now is 29.7 secs Computing kpt #: 268 total cpu time spent up to now is 29.9 secs Computing kpt #: 269 total cpu time spent up to now is 30.1 secs Computing kpt #: 270 total cpu time spent up to now is 30.2 secs Computing kpt #: 271 total cpu time spent up to now is 30.3 secs Computing kpt #: 272 total cpu time spent up to now is 30.5 secs Computing kpt #: 273 total cpu time spent up to now is 30.5 secs Computing kpt #: 274 total cpu time spent up to now is 30.6 secs Computing kpt #: 275 total cpu time spent up to now is 30.7 secs Computing kpt #: 276 total cpu time spent up to now is 30.8 secs Computing kpt #: 277 total cpu time spent up to now is 30.9 secs Computing kpt #: 278 total cpu time spent up to now is 31.0 secs Computing kpt #: 279 total cpu time spent up to now is 31.1 secs Computing kpt #: 280 total cpu time spent up to now is 31.2 secs Computing kpt #: 281 total cpu time spent up to now is 31.3 secs Computing kpt #: 282 total cpu time spent up to now is 31.3 secs Computing kpt #: 283 total cpu time spent up to now is 31.4 secs Computing kpt #: 284 total cpu time spent up to now is 31.5 secs Computing kpt #: 285 total cpu time spent up to now is 31.6 secs Computing kpt #: 286 total cpu time spent up to now is 31.7 secs Computing kpt #: 287 total cpu time spent up to now is 31.7 secs Computing kpt #: 288 total cpu time spent up to now is 31.8 secs Computing kpt #: 289 total cpu time spent up to now is 31.9 secs Computing kpt #: 290 total cpu time spent up to now is 32.0 secs Computing kpt #: 291 total cpu time spent up to now is 32.1 secs Computing kpt #: 292 total cpu time spent up to now is 32.2 secs Computing kpt #: 293 total cpu time spent up to now is 32.2 secs Computing kpt #: 294 total cpu time spent up to now is 32.3 secs Computing kpt #: 295 total cpu time spent up to now is 32.4 secs Computing kpt #: 296 total cpu time spent up to now is 32.5 secs Computing kpt #: 297 total cpu time spent up to now is 32.6 secs Computing kpt #: 298 total cpu time spent up to now is 32.7 secs Computing kpt #: 299 total cpu time spent up to now is 32.7 secs Computing kpt #: 300 total cpu time spent up to now is 32.8 secs Computing kpt #: 301 total cpu time spent up to now is 32.9 secs Computing kpt #: 302 total cpu time spent up to now is 33.0 secs Computing kpt #: 303 total cpu time spent up to now is 33.1 secs Computing kpt #: 304 total cpu time spent up to now is 33.2 secs Computing kpt #: 305 total cpu time spent up to now is 33.2 secs Computing kpt #: 306 total cpu time spent up to now is 33.3 secs Computing kpt #: 307 total cpu time spent up to now is 33.4 secs Computing kpt #: 308 total cpu time spent up to now is 33.5 secs Computing kpt #: 309 total cpu time spent up to now is 33.6 secs Computing kpt #: 310 total cpu time spent up to now is 33.7 secs Computing kpt #: 311 total cpu time spent up to now is 33.7 secs Computing kpt #: 312 total cpu time spent up to now is 33.8 secs Computing kpt #: 313 total cpu time spent up to now is 33.9 secs Computing kpt #: 314 total cpu time spent up to now is 34.0 secs Computing kpt #: 315 total cpu time spent up to now is 34.1 secs Computing kpt #: 316 total cpu time spent up to now is 34.2 secs Computing kpt #: 317 total cpu time spent up to now is 34.2 secs Computing kpt #: 318 total cpu time spent up to now is 34.3 secs Computing kpt #: 319 total cpu time spent up to now is 34.4 secs Computing kpt #: 320 total cpu time spent up to now is 34.5 secs Computing kpt #: 321 total cpu time spent up to now is 34.6 secs Computing kpt #: 322 total cpu time spent up to now is 34.7 secs Computing kpt #: 323 total cpu time spent up to now is 34.7 secs Computing kpt #: 324 total cpu time spent up to now is 34.8 secs Computing kpt #: 325 total cpu time spent up to now is 34.9 secs Computing kpt #: 326 total cpu time spent up to now is 35.0 secs Computing kpt #: 327 total cpu time spent up to now is 35.1 secs Computing kpt #: 328 total cpu time spent up to now is 35.2 secs Computing kpt #: 329 total cpu time spent up to now is 35.3 secs Computing kpt #: 330 total cpu time spent up to now is 35.4 secs Computing kpt #: 331 total cpu time spent up to now is 35.5 secs Computing kpt #: 332 total cpu time spent up to now is 35.5 secs Computing kpt #: 333 total cpu time spent up to now is 35.6 secs Computing kpt #: 334 total cpu time spent up to now is 35.7 secs Computing kpt #: 335 total cpu time spent up to now is 35.8 secs Computing kpt #: 336 total cpu time spent up to now is 35.9 secs Computing kpt #: 337 total cpu time spent up to now is 36.0 secs Computing kpt #: 338 total cpu time spent up to now is 36.1 secs Computing kpt #: 339 total cpu time spent up to now is 36.2 secs Computing kpt #: 340 total cpu time spent up to now is 36.2 secs Computing kpt #: 341 total cpu time spent up to now is 36.3 secs Computing kpt #: 342 total cpu time spent up to now is 36.4 secs Computing kpt #: 343 total cpu time spent up to now is 36.5 secs Computing kpt #: 344 total cpu time spent up to now is 36.6 secs Computing kpt #: 345 total cpu time spent up to now is 36.7 secs Computing kpt #: 346 total cpu time spent up to now is 36.8 secs Computing kpt #: 347 total cpu time spent up to now is 36.9 secs Computing kpt #: 348 total cpu time spent up to now is 37.0 secs Computing kpt #: 349 total cpu time spent up to now is 37.1 secs Computing kpt #: 350 total cpu time spent up to now is 37.2 secs Computing kpt #: 351 total cpu time spent up to now is 37.3 secs Computing kpt #: 352 total cpu time spent up to now is 37.4 secs Computing kpt #: 353 total cpu time spent up to now is 37.5 secs Computing kpt #: 354 total cpu time spent up to now is 37.5 secs Computing kpt #: 355 total cpu time spent up to now is 37.6 secs Computing kpt #: 356 total cpu time spent up to now is 37.7 secs Computing kpt #: 357 total cpu time spent up to now is 37.8 secs Computing kpt #: 358 total cpu time spent up to now is 37.9 secs Computing kpt #: 359 total cpu time spent up to now is 38.0 secs Computing kpt #: 360 total cpu time spent up to now is 38.1 secs Computing kpt #: 361 total cpu time spent up to now is 38.2 secs Computing kpt #: 362 total cpu time spent up to now is 38.3 secs Computing kpt #: 363 total cpu time spent up to now is 38.4 secs Computing kpt #: 364 total cpu time spent up to now is 38.5 secs Computing kpt #: 365 total cpu time spent up to now is 38.5 secs Computing kpt #: 366 total cpu time spent up to now is 38.6 secs Computing kpt #: 367 total cpu time spent up to now is 38.7 secs Computing kpt #: 368 total cpu time spent up to now is 38.8 secs Computing kpt #: 369 total cpu time spent up to now is 38.9 secs Computing kpt #: 370 total cpu time spent up to now is 39.0 secs Computing kpt #: 371 total cpu time spent up to now is 39.1 secs Computing kpt #: 372 total cpu time spent up to now is 39.2 secs Computing kpt #: 373 total cpu time spent up to now is 39.3 secs Computing kpt #: 374 total cpu time spent up to now is 39.4 secs Computing kpt #: 375 total cpu time spent up to now is 39.5 secs Computing kpt #: 376 total cpu time spent up to now is 39.6 secs Computing kpt #: 377 total cpu time spent up to now is 39.7 secs Computing kpt #: 378 total cpu time spent up to now is 39.8 secs Computing kpt #: 379 total cpu time spent up to now is 39.9 secs Computing kpt #: 380 total cpu time spent up to now is 40.0 secs Computing kpt #: 381 total cpu time spent up to now is 40.1 secs Computing kpt #: 382 total cpu time spent up to now is 40.2 secs Computing kpt #: 383 total cpu time spent up to now is 40.3 secs Computing kpt #: 384 total cpu time spent up to now is 40.4 secs Computing kpt #: 385 total cpu time spent up to now is 40.5 secs Computing kpt #: 386 total cpu time spent up to now is 40.6 secs Computing kpt #: 387 total cpu time spent up to now is 40.7 secs Computing kpt #: 388 total cpu time spent up to now is 40.8 secs Computing kpt #: 389 total cpu time spent up to now is 41.0 secs Computing kpt #: 390 total cpu time spent up to now is 41.1 secs Computing kpt #: 391 total cpu time spent up to now is 41.2 secs Computing kpt #: 392 total cpu time spent up to now is 41.3 secs Computing kpt #: 393 total cpu time spent up to now is 41.4 secs Computing kpt #: 394 total cpu time spent up to now is 41.5 secs Computing kpt #: 395 total cpu time spent up to now is 41.6 secs Computing kpt #: 396 total cpu time spent up to now is 41.7 secs Computing kpt #: 397 total cpu time spent up to now is 41.8 secs Computing kpt #: 398 total cpu time spent up to now is 41.9 secs Computing kpt #: 399 total cpu time spent up to now is 42.0 secs Computing kpt #: 400 total cpu time spent up to now is 42.1 secs Computing kpt #: 401 total cpu time spent up to now is 42.2 secs Computing kpt #: 402 total cpu time spent up to now is 42.3 secs Computing kpt #: 403 total cpu time spent up to now is 42.4 secs Computing kpt #: 404 total cpu time spent up to now is 42.5 secs Computing kpt #: 405 total cpu time spent up to now is 42.6 secs Computing kpt #: 406 total cpu time spent up to now is 42.8 secs Computing kpt #: 407 total cpu time spent up to now is 42.9 secs Computing kpt #: 408 total cpu time spent up to now is 43.0 secs Computing kpt #: 409 total cpu time spent up to now is 43.1 secs Computing kpt #: 410 total cpu time spent up to now is 43.1 secs Computing kpt #: 411 total cpu time spent up to now is 43.2 secs Computing kpt #: 412 total cpu time spent up to now is 43.3 secs Computing kpt #: 413 total cpu time spent up to now is 43.4 secs Computing kpt #: 414 total cpu time spent up to now is 43.5 secs Computing kpt #: 415 total cpu time spent up to now is 43.6 secs Computing kpt #: 416 total cpu time spent up to now is 43.7 secs Computing kpt #: 417 total cpu time spent up to now is 43.8 secs Computing kpt #: 418 total cpu time spent up to now is 43.9 secs Computing kpt #: 419 total cpu time spent up to now is 44.0 secs Computing kpt #: 420 total cpu time spent up to now is 44.1 secs Computing kpt #: 421 total cpu time spent up to now is 44.2 secs Computing kpt #: 422 total cpu time spent up to now is 44.3 secs Computing kpt #: 423 total cpu time spent up to now is 44.4 secs Computing kpt #: 424 total cpu time spent up to now is 44.5 secs Computing kpt #: 425 total cpu time spent up to now is 44.6 secs Computing kpt #: 426 total cpu time spent up to now is 44.7 secs Computing kpt #: 427 total cpu time spent up to now is 44.8 secs Computing kpt #: 428 total cpu time spent up to now is 45.0 secs Computing kpt #: 429 total cpu time spent up to now is 45.1 secs Computing kpt #: 430 total cpu time spent up to now is 45.2 secs Computing kpt #: 431 total cpu time spent up to now is 45.3 secs Computing kpt #: 432 total cpu time spent up to now is 45.4 secs Computing kpt #: 433 total cpu time spent up to now is 45.5 secs Computing kpt #: 434 total cpu time spent up to now is 45.6 secs Computing kpt #: 435 total cpu time spent up to now is 45.7 secs Computing kpt #: 436 total cpu time spent up to now is 45.9 secs Computing kpt #: 437 total cpu time spent up to now is 46.0 secs Computing kpt #: 438 total cpu time spent up to now is 46.1 secs Computing kpt #: 439 total cpu time spent up to now is 46.2 secs Computing kpt #: 440 total cpu time spent up to now is 46.4 secs Computing kpt #: 441 total cpu time spent up to now is 46.5 secs Computing kpt #: 442 total cpu time spent up to now is 46.6 secs Computing kpt #: 443 total cpu time spent up to now is 46.8 secs Computing kpt #: 444 total cpu time spent up to now is 46.9 secs Computing kpt #: 445 total cpu time spent up to now is 47.0 secs Computing kpt #: 446 total cpu time spent up to now is 47.2 secs Computing kpt #: 447 total cpu time spent up to now is 47.3 secs Computing kpt #: 448 total cpu time spent up to now is 47.5 secs Computing kpt #: 449 total cpu time spent up to now is 47.6 secs Computing kpt #: 450 total cpu time spent up to now is 47.7 secs Computing kpt #: 451 total cpu time spent up to now is 47.8 secs Computing kpt #: 452 total cpu time spent up to now is 48.0 secs Computing kpt #: 453 total cpu time spent up to now is 48.1 secs Computing kpt #: 454 total cpu time spent up to now is 48.3 secs Computing kpt #: 455 total cpu time spent up to now is 48.4 secs Computing kpt #: 456 total cpu time spent up to now is 48.5 secs Computing kpt #: 457 total cpu time spent up to now is 48.7 secs Computing kpt #: 458 total cpu time spent up to now is 48.8 secs Computing kpt #: 459 total cpu time spent up to now is 48.9 secs Computing kpt #: 460 total cpu time spent up to now is 49.1 secs Computing kpt #: 461 total cpu time spent up to now is 49.2 secs Computing kpt #: 462 total cpu time spent up to now is 49.3 secs Computing kpt #: 463 total cpu time spent up to now is 49.5 secs Computing kpt #: 464 total cpu time spent up to now is 49.6 secs Computing kpt #: 465 total cpu time spent up to now is 49.8 secs Computing kpt #: 466 total cpu time spent up to now is 50.0 secs Computing kpt #: 467 total cpu time spent up to now is 50.2 secs Computing kpt #: 468 total cpu time spent up to now is 50.4 secs Computing kpt #: 469 total cpu time spent up to now is 50.7 secs Computing kpt #: 470 total cpu time spent up to now is 50.9 secs Computing kpt #: 471 total cpu time spent up to now is 51.1 secs Computing kpt #: 472 total cpu time spent up to now is 51.3 secs Computing kpt #: 473 total cpu time spent up to now is 51.5 secs Computing kpt #: 474 total cpu time spent up to now is 51.7 secs Computing kpt #: 475 total cpu time spent up to now is 51.9 secs Computing kpt #: 476 total cpu time spent up to now is 52.0 secs Computing kpt #: 477 total cpu time spent up to now is 52.2 secs Computing kpt #: 478 total cpu time spent up to now is 52.4 secs Computing kpt #: 479 total cpu time spent up to now is 52.6 secs Computing kpt #: 480 total cpu time spent up to now is 52.7 secs Computing kpt #: 481 total cpu time spent up to now is 52.9 secs Computing kpt #: 482 total cpu time spent up to now is 53.1 secs Computing kpt #: 483 total cpu time spent up to now is 53.2 secs Computing kpt #: 484 total cpu time spent up to now is 53.3 secs Computing kpt #: 485 total cpu time spent up to now is 53.4 secs Computing kpt #: 486 total cpu time spent up to now is 53.5 secs Computing kpt #: 487 total cpu time spent up to now is 53.6 secs Computing kpt #: 488 total cpu time spent up to now is 53.7 secs Computing kpt #: 489 total cpu time spent up to now is 53.8 secs Computing kpt #: 490 total cpu time spent up to now is 53.9 secs Computing kpt #: 491 total cpu time spent up to now is 54.0 secs Computing kpt #: 492 total cpu time spent up to now is 54.1 secs Computing kpt #: 493 total cpu time spent up to now is 54.2 secs Computing kpt #: 494 total cpu time spent up to now is 54.3 secs Computing kpt #: 495 total cpu time spent up to now is 54.3 secs Computing kpt #: 496 total cpu time spent up to now is 54.4 secs Computing kpt #: 497 total cpu time spent up to now is 54.5 secs Computing kpt #: 498 total cpu time spent up to now is 54.6 secs Computing kpt #: 499 total cpu time spent up to now is 54.7 secs Computing kpt #: 500 total cpu time spent up to now is 54.8 secs Computing kpt #: 501 total cpu time spent up to now is 54.9 secs Computing kpt #: 502 total cpu time spent up to now is 55.0 secs Computing kpt #: 503 total cpu time spent up to now is 55.0 secs Computing kpt #: 504 total cpu time spent up to now is 55.1 secs Computing kpt #: 505 total cpu time spent up to now is 55.2 secs Computing kpt #: 506 total cpu time spent up to now is 55.3 secs Computing kpt #: 507 total cpu time spent up to now is 55.4 secs Computing kpt #: 508 total cpu time spent up to now is 55.5 secs Computing kpt #: 509 total cpu time spent up to now is 55.5 secs Computing kpt #: 510 total cpu time spent up to now is 55.6 secs Computing kpt #: 511 total cpu time spent up to now is 55.7 secs Computing kpt #: 512 total cpu time spent up to now is 55.8 secs Computing kpt #: 513 total cpu time spent up to now is 55.9 secs Computing kpt #: 514 total cpu time spent up to now is 56.0 secs Computing kpt #: 515 total cpu time spent up to now is 56.1 secs Computing kpt #: 516 total cpu time spent up to now is 56.1 secs Computing kpt #: 517 total cpu time spent up to now is 56.2 secs Computing kpt #: 518 total cpu time spent up to now is 56.3 secs Computing kpt #: 519 total cpu time spent up to now is 56.4 secs Computing kpt #: 520 total cpu time spent up to now is 56.5 secs Computing kpt #: 521 total cpu time spent up to now is 56.6 secs Computing kpt #: 522 total cpu time spent up to now is 56.7 secs Computing kpt #: 523 total cpu time spent up to now is 56.7 secs Computing kpt #: 524 total cpu time spent up to now is 56.8 secs Computing kpt #: 525 total cpu time spent up to now is 56.9 secs Computing kpt #: 526 total cpu time spent up to now is 57.0 secs Computing kpt #: 527 total cpu time spent up to now is 57.1 secs Computing kpt #: 528 total cpu time spent up to now is 57.2 secs Computing kpt #: 529 total cpu time spent up to now is 57.3 secs Computing kpt #: 530 total cpu time spent up to now is 57.4 secs Computing kpt #: 531 total cpu time spent up to now is 57.5 secs Computing kpt #: 532 total cpu time spent up to now is 57.6 secs Computing kpt #: 533 total cpu time spent up to now is 57.7 secs Computing kpt #: 534 total cpu time spent up to now is 57.8 secs Computing kpt #: 535 total cpu time spent up to now is 57.9 secs Computing kpt #: 536 total cpu time spent up to now is 58.0 secs Computing kpt #: 537 total cpu time spent up to now is 58.1 secs Computing kpt #: 538 total cpu time spent up to now is 58.2 secs Computing kpt #: 539 total cpu time spent up to now is 58.3 secs Computing kpt #: 540 total cpu time spent up to now is 58.5 secs Computing kpt #: 541 total cpu time spent up to now is 58.6 secs Computing kpt #: 542 total cpu time spent up to now is 58.7 secs Computing kpt #: 543 total cpu time spent up to now is 58.8 secs Computing kpt #: 544 total cpu time spent up to now is 58.9 secs Computing kpt #: 545 total cpu time spent up to now is 59.0 secs Computing kpt #: 546 total cpu time spent up to now is 59.1 secs Computing kpt #: 547 total cpu time spent up to now is 59.2 secs Computing kpt #: 548 total cpu time spent up to now is 59.3 secs Computing kpt #: 549 total cpu time spent up to now is 59.5 secs Computing kpt #: 550 total cpu time spent up to now is 59.6 secs Computing kpt #: 551 total cpu time spent up to now is 59.7 secs Computing kpt #: 552 total cpu time spent up to now is 60.3 secs Computing kpt #: 553 total cpu time spent up to now is 60.5 secs Computing kpt #: 554 total cpu time spent up to now is 60.7 secs Computing kpt #: 555 total cpu time spent up to now is 60.9 secs Computing kpt #: 556 total cpu time spent up to now is 61.1 secs Computing kpt #: 557 total cpu time spent up to now is 61.3 secs Computing kpt #: 558 total cpu time spent up to now is 61.5 secs Computing kpt #: 559 total cpu time spent up to now is 61.7 secs Computing kpt #: 560 total cpu time spent up to now is 61.8 secs Computing kpt #: 561 total cpu time spent up to now is 61.9 secs Computing kpt #: 562 total cpu time spent up to now is 62.0 secs Computing kpt #: 563 total cpu time spent up to now is 62.2 secs Computing kpt #: 564 total cpu time spent up to now is 62.3 secs Computing kpt #: 565 total cpu time spent up to now is 62.4 secs Computing kpt #: 566 total cpu time spent up to now is 62.5 secs Computing kpt #: 567 total cpu time spent up to now is 62.7 secs Computing kpt #: 568 total cpu time spent up to now is 62.8 secs Computing kpt #: 569 total cpu time spent up to now is 62.9 secs ethr = 5.56E-08, avg # of iterations = 20.1 total cpu time spent up to now is 62.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 823 PWs) bands (ev): 4.2295 4.2295 8.5477 8.5477 9.1714 9.1714 10.9607 10.9607 11.0214 11.0214 11.1739 11.1739 12.0233 12.0233 12.2758 12.2758 13.3314 13.3314 13.3544 13.3544 13.4615 13.4615 15.3419 15.3419 22.4388 22.4388 k = 0.0000 0.0079-0.0000 ( 823 PWs) bands (ev): 4.2311 4.2311 8.5486 8.5486 9.1720 9.1720 10.9605 10.9605 11.0213 11.0213 11.1743 11.1743 12.0229 12.0229 12.2758 12.2758 13.3301 13.3301 13.3514 13.3514 13.4588 13.4588 15.3494 15.3494 22.4391 22.4391 k = 0.0000 0.0159-0.0000 ( 823 PWs) bands (ev): 4.2359 4.2359 8.5513 8.5513 9.1737 9.1737 10.9602 10.9602 11.0213 11.0213 11.1756 11.1756 12.0216 12.0216 12.2759 12.2759 13.3249 13.3249 13.3432 13.3432 13.4517 13.4517 15.3715 15.3715 22.4400 22.4400 k = 0.0000 0.0238-0.0000 ( 819 PWs) bands (ev): 4.2439 4.2439 8.5559 8.5559 9.1770 9.1770 10.9594 10.9594 11.0214 11.0214 11.1776 11.1776 12.0196 12.0196 12.2762 12.2762 13.3100 13.3100 13.3341 13.3341 13.4423 13.4423 15.4076 15.4076 22.4413 22.4413 k = 0.0000 0.0317-0.0000 ( 821 PWs) bands (ev): 4.2551 4.2551 8.5621 8.5621 9.1807 9.1807 10.9582 10.9582 11.0216 11.0216 11.1806 11.1806 12.0168 12.0168 12.2765 12.2765 13.2814 13.2814 13.3272 13.3272 13.4327 13.4327 15.4565 15.4565 22.4433 22.4433 k = 0.0000 0.0397-0.0000 ( 825 PWs) bands (ev): 4.2695 4.2695 8.5700 8.5700 9.1857 9.1857 10.9562 10.9562 11.0223 11.0223 11.1843 11.1843 12.0130 12.0130 12.2769 12.2769 13.2414 13.2414 13.3201 13.3201 13.4237 13.4237 15.5169 15.5169 22.4457 22.4457 k = 0.0000 0.0476-0.0000 ( 825 PWs) bands (ev): 4.2871 4.2871 8.5797 8.5797 9.1919 9.1919 10.9533 10.9533 11.0234 11.0234 11.1890 11.1890 12.0086 12.0086 12.2775 12.2775 13.1927 13.1927 13.3122 13.3122 13.4158 13.4158 15.5874 15.5874 22.4487 22.4487 k = 0.0000 0.0556-0.0000 ( 831 PWs) bands (ev): 4.3079 4.3079 8.5909 8.5909 9.1991 9.1991 10.9494 10.9494 11.0253 11.0253 11.1945 11.1945 12.0033 12.0033 12.2783 12.2783 13.1366 13.1366 13.3029 13.3029 13.4084 13.4084 15.6668 15.6668 22.4521 22.4521 k = 0.0000 0.0635-0.0000 ( 831 PWs) bands (ev): 4.3319 4.3319 8.6041 8.6041 9.2074 9.2074 10.9442 10.9442 11.0280 11.0280 11.2009 11.2009 11.9973 11.9973 12.2792 12.2792 13.0753 13.0753 13.2924 13.2924 13.4014 13.4014 15.7539 15.7539 22.4561 22.4561 k = 0.0000 0.0714-0.0000 ( 829 PWs) bands (ev): 4.3590 4.3590 8.6188 8.6188 9.2168 9.2168 10.9377 10.9377 11.0316 11.0316 11.2083 11.2083 11.9907 11.9907 12.2805 12.2805 13.0099 13.0099 13.2805 13.2805 13.3945 13.3945 15.8478 15.8478 22.4604 22.4604 k = 0.0000 0.0794-0.0000 ( 829 PWs) bands (ev): 4.3892 4.3892 8.6352 8.6352 9.2272 9.2272 10.9299 10.9299 11.0360 11.0360 11.2164 11.2164 11.9832 11.9832 12.2819 12.2819 12.9415 12.9415 13.2672 13.2672 13.3876 13.3876 15.9474 15.9474 22.4652 22.4652 k = 0.0000 0.0873-0.0000 ( 829 PWs) bands (ev): 4.4226 4.4226 8.6532 8.6532 9.2387 9.2387 10.9209 10.9209 11.0413 11.0413 11.2252 11.2252 11.9751 11.9751 12.2837 12.2837 12.8707 12.8707 13.2525 13.2525 13.3806 13.3806 16.0523 16.0523 22.4701 22.4701 k = 0.0000 0.0952-0.0000 ( 821 PWs) bands (ev): 4.4591 4.4591 8.6735 8.6735 9.2516 9.2516 10.9107 10.9107 11.0475 11.0475 11.2346 11.2346 11.9663 11.9663 12.2859 12.2859 12.7984 12.7984 13.2365 13.2365 13.3734 13.3734 16.1617 16.1617 22.4753 22.4753 k = 0.0000 0.1032-0.0000 ( 821 PWs) bands (ev): 4.4986 4.4986 8.6946 8.6946 9.2649 9.2649 10.8993 10.8993 11.0543 11.0543 11.2448 11.2448 11.9568 11.9568 12.2884 12.2884 12.7250 12.7250 13.2191 13.2191 13.3659 13.3659 16.2752 16.2752 22.4804 22.4804 k = 0.0000 0.1111-0.0000 ( 821 PWs) bands (ev): 4.5412 4.5412 8.7171 8.7171 9.2793 9.2793 10.8868 10.8868 11.0619 11.0619 11.2554 11.2554 11.9467 11.9467 12.2915 12.2915 12.6511 12.6511 13.2005 13.2005 13.3582 13.3582 16.3923 16.3923 22.4852 22.4852 k = 0.0000 0.1190-0.0000 ( 815 PWs) bands (ev): 4.5868 4.5868 8.7410 8.7410 9.2945 9.2945 10.8736 10.8736 11.0704 11.0704 11.2668 11.2668 11.9363 11.9363 12.2953 12.2953 12.5769 12.5769 13.1808 13.1808 13.3501 13.3501 16.5128 16.5128 22.4892 22.4892 k = 0.0000 0.1270-0.0000 ( 815 PWs) bands (ev): 4.6355 4.6355 8.7662 8.7662 9.3105 9.3105 10.8591 10.8591 11.0793 11.0793 11.2782 11.2782 11.9250 11.9250 12.2997 12.2997 12.5027 12.5027 13.1599 13.1599 13.3417 13.3417 16.6363 16.6363 22.4919 22.4919 k = 0.0000 0.1349-0.0000 ( 819 PWs) bands (ev): 4.6871 4.6871 8.7928 8.7928 9.3273 9.3273 10.8436 10.8436 11.0888 11.0888 11.2895 11.2895 11.9131 11.9131 12.3045 12.3045 12.4290 12.4290 13.1380 13.1380 13.3330 13.3330 16.7627 16.7627 22.4922 22.4922 k = 0.0000 0.1429-0.0000 ( 819 PWs) bands (ev): 4.7416 4.7416 8.8206 8.8206 9.3449 9.3449 10.8275 10.8275 11.0989 11.0989 11.3013 11.3013 11.9008 11.9008 12.3099 12.3099 12.3562 12.3562 13.1152 13.1152 13.3239 13.3239 16.8917 16.8917 22.4884 22.4884 k = 0.0000 0.1508-0.0000 ( 815 PWs) bands (ev): 4.7991 4.7991 8.8496 8.8496 9.3632 9.3632 10.8106 10.8106 11.1094 11.1094 11.3130 11.3130 11.8884 11.8884 12.2813 12.2813 12.3193 12.3193 13.0916 13.0916 13.3145 13.3145 17.0232 17.0232 22.4775 22.4775 k = 0.0000 0.1587-0.0000 ( 815 PWs) bands (ev): 4.8594 4.8594 8.8797 8.8797 9.3821 9.3821 10.7931 10.7931 11.1205 11.1205 11.3246 11.3246 11.8752 11.8752 12.2103 12.2103 12.3265 12.3265 13.0671 13.0671 13.3048 13.3048 17.1570 17.1570 22.4546 22.4546 k = 0.0000 0.1667-0.0000 ( 819 PWs) bands (ev): 4.9226 4.9226 8.9108 8.9108 9.4016 9.4016 10.7745 10.7745 11.1319 11.1319 11.3359 11.3359 11.8614 11.8614 12.1396 12.1396 12.3356 12.3356 13.0419 13.0419 13.2946 13.2946 17.2930 17.2930 22.4111 22.4111 k = 0.0000 0.1746-0.0000 ( 814 PWs) bands (ev): 4.9885 4.9885 8.9430 8.9430 9.4218 9.4218 10.7559 10.7559 11.1440 11.1440 11.3468 11.3468 11.8473 11.8473 12.0699 12.0699 12.3462 12.3462 13.0161 13.0161 13.2841 13.2841 17.4311 17.4311 22.3346 22.3346 k = 0.0000 0.1825-0.0000 ( 814 PWs) bands (ev): 5.0572 5.0572 8.9761 8.9761 9.4422 9.4422 10.7366 10.7366 11.1563 11.1563 11.3572 11.3572 11.8328 11.8328 12.0014 12.0014 12.3581 12.3581 12.9898 12.9898 13.2733 13.2733 17.5712 17.5712 22.2142 22.2142 k = 0.0000 0.1905-0.0000 ( 814 PWs) bands (ev): 5.1286 5.1286 9.0101 9.0101 9.4630 9.4630 10.7168 10.7168 11.1688 11.1688 11.3670 11.3670 11.8179 11.8179 11.9343 11.9343 12.3716 12.3716 12.9630 12.9630 13.2621 13.2621 17.7133 17.7133 22.0502 22.0502 k = 0.0000 0.1984-0.0000 ( 806 PWs) bands (ev): 5.2027 5.2027 9.0448 9.0448 9.4840 9.4840 10.6970 10.6970 11.1818 11.1818 11.3762 11.3762 11.8024 11.8024 11.8692 11.8692 12.3868 12.3868 12.9359 12.9359 13.2506 13.2506 17.8572 17.8572 21.8537 21.8537 k = 0.0000 0.2063-0.0000 ( 806 PWs) bands (ev): 5.2793 5.2793 9.0803 9.0803 9.5052 9.5052 10.6764 10.6764 11.1947 11.1947 11.3844 11.3844 11.7818 11.7818 11.8099 11.8099 12.4036 12.4036 12.9084 12.9084 13.2387 13.2387 18.0030 18.0030 21.6371 21.6371 k = 0.0000 0.2143-0.0000 ( 800 PWs) bands (ev): 5.3585 5.3585 9.1166 9.1166 9.5268 9.5268 10.6556 10.6556 11.2078 11.2078 11.3919 11.3919 11.7346 11.7346 11.7789 11.7789 12.4221 12.4221 12.8809 12.8809 13.2265 13.2265 18.1506 18.1506 21.4091 21.4091 k = 0.0000 0.2222-0.0000 ( 800 PWs) bands (ev): 5.4402 5.4402 9.1534 9.1534 9.5481 9.5481 10.6346 10.6346 11.2207 11.2207 11.3984 11.3984 11.6747 11.6747 11.7615 11.7615 12.4426 12.4426 12.8531 12.8531 13.2140 13.2140 18.2998 18.2998 21.1749 21.1749 k = 0.0000 0.2302-0.0000 ( 804 PWs) bands (ev): 5.5243 5.5243 9.1907 9.1907 9.5692 9.5692 10.6129 10.6129 11.2335 11.2335 11.4041 11.4041 11.6148 11.6148 11.7454 11.7454 12.4648 12.4648 12.8251 12.8251 13.2012 13.2012 18.4508 18.4508 20.9377 20.9377 k = 0.0000 0.2381-0.0000 ( 808 PWs) bands (ev): 5.6107 5.6107 9.2284 9.2284 9.5898 9.5898 10.5915 10.5915 11.2458 11.2458 11.4091 11.4091 11.5558 11.5558 11.7296 11.7296 12.4890 12.4890 12.7971 12.7971 13.1881 13.1881 18.6033 18.6033 20.6994 20.6994 k = 0.0000 0.2460-0.0000 ( 808 PWs) bands (ev): 5.6994 5.6994 9.2665 9.2665 9.6103 9.6103 10.5701 10.5701 11.2576 11.2576 11.4137 11.4137 11.4986 11.4986 11.7139 11.7139 12.5151 12.5151 12.7693 12.7693 13.1747 13.1747 18.7574 18.7574 20.4611 20.4611 k = 0.0000 0.2540-0.0000 ( 808 PWs) bands (ev): 5.7903 5.7903 9.3050 9.3050 9.6302 9.6302 10.5486 10.5486 11.2684 11.2684 11.4179 11.4179 11.4429 11.4429 11.6983 11.6983 12.5430 12.5430 12.7417 12.7417 13.1611 13.1611 18.9131 18.9131 20.2238 20.2238 k = 0.0000 0.2619-0.0000 ( 808 PWs) bands (ev): 5.8833 5.8833 9.3437 9.3437 9.6496 9.6496 10.5273 10.5273 11.2778 11.2778 11.3887 11.3887 11.4224 11.4224 11.6828 11.6828 12.5726 12.5726 12.7146 12.7146 13.1472 13.1472 19.0703 19.0703 19.9881 19.9881 k = 0.0000 0.2698-0.0000 ( 804 PWs) bands (ev): 5.9784 5.9784 9.3825 9.3825 9.6686 9.6686 10.5060 10.5060 11.2854 11.2854 11.3364 11.3364 11.4273 11.4273 11.6676 11.6676 12.6034 12.6034 12.6887 12.6887 13.1332 13.1332 19.2287 19.2287 19.7547 19.7547 k = 0.0000 0.2778-0.0000 ( 802 PWs) bands (ev): 6.0753 6.0753 9.4214 9.4214 9.6864 9.6864 10.4849 10.4849 11.2854 11.2854 11.2909 11.2909 11.4330 11.4330 11.6525 11.6525 12.6311 12.6311 12.6679 12.6679 13.1189 13.1189 19.3859 19.3859 19.5263 19.5263 k = 0.0000 0.2857-0.0000 ( 798 PWs) bands (ev): 6.1742 6.1742 9.4600 9.4600 9.7035 9.7035 10.4642 10.4642 11.2364 11.2364 11.2938 11.2938 11.4402 11.4402 11.6377 11.6377 12.6268 12.6268 12.6813 12.6813 13.1045 13.1045 19.2908 19.2908 19.5543 19.5543 k = 0.0000 0.2937-0.0000 ( 804 PWs) bands (ev): 6.2747 6.2747 9.4983 9.4983 9.7196 9.7196 10.4433 10.4433 11.1889 11.1889 11.2937 11.2937 11.4485 11.4485 11.6229 11.6229 12.6034 12.6034 12.7154 12.7154 13.0899 13.0899 19.0661 19.0661 19.7163 19.7163 k = 0.0000 0.3016-0.0000 ( 804 PWs) bands (ev): 6.3769 6.3769 9.5359 9.5359 9.7349 9.7349 10.4230 10.4230 11.1431 11.1431 11.2910 11.2910 11.4581 11.4581 11.6089 11.6089 12.5785 12.5785 12.7536 12.7536 13.0752 13.0752 18.8436 18.8436 19.8808 19.8808 k = 0.0000 0.3095-0.0000 ( 802 PWs) bands (ev): 6.4806 6.4806 9.5725 9.5725 9.7495 9.7495 10.4031 10.4031 11.0991 11.0991 11.2859 11.2859 11.4686 11.4686 11.5956 11.5956 12.5537 12.5537 12.7939 12.7939 13.0605 13.0605 18.6242 18.6242 20.0469 20.0469 k = 0.0000 0.3175-0.0000 ( 802 PWs) bands (ev): 6.5857 6.5857 9.6072 9.6072 9.7640 9.7640 10.3835 10.3835 11.0568 11.0568 11.2783 11.2783 11.4792 11.4792 11.5833 11.5833 12.5294 12.5294 12.8360 12.8360 13.0457 13.0457 18.4084 18.4084 20.2144 20.2144 k = 0.0000 0.3254-0.0000 ( 800 PWs) bands (ev): 6.6920 6.6920 9.6390 9.6390 9.7792 9.7792 10.3647 10.3647 11.0163 11.0163 11.2687 11.2687 11.4893 11.4893 11.5728 11.5728 12.5056 12.5056 12.8796 12.8796 13.0310 13.0310 18.1964 18.1964 20.3835 20.3835 k = 0.0000 0.3333-0.0000 ( 800 PWs) bands (ev): 6.7995 6.7995 9.6663 9.6663 9.7965 9.7965 10.3461 10.3461 10.9775 10.9775 11.2573 11.2573 11.4970 11.4970 11.5657 11.5657 12.4825 12.4825 12.9245 12.9245 13.0165 13.0165 17.9884 17.9884 20.5539 20.5539 k = 0.0000 0.3413-0.0000 ( 800 PWs) bands (ev): 6.9078 6.9078 9.6871 9.6871 9.8175 9.8175 10.3281 10.3281 10.9405 10.9405 11.2442 11.2442 11.5000 11.5000 11.5640 11.5640 12.4602 12.4602 12.9698 12.9698 13.0030 13.0030 17.7846 17.7846 20.7257 20.7257 k = 0.0000 0.3492-0.0000 ( 800 PWs) bands (ev): 7.0170 7.0170 9.7003 9.7003 9.8430 9.8430 10.3108 10.3108 10.9053 10.9053 11.2297 11.2297 11.4974 11.4974 11.5686 11.5686 12.4386 12.4386 12.9848 12.9848 13.0214 13.0214 17.5852 17.5852 20.8989 20.8989 k = 0.0000 0.3571-0.0000 ( 800 PWs) bands (ev): 7.1268 7.1268 9.7063 9.7063 9.8726 9.8726 10.2941 10.2941 10.8718 10.8718 11.2140 11.2140 11.4906 11.4906 11.5779 11.5779 12.4179 12.4179 12.9714 12.9714 13.0696 13.0696 17.3904 17.3904 21.0735 21.0735 k = 0.0000 0.3651-0.0000 ( 804 PWs) bands (ev): 7.2371 7.2371 9.7059 9.7059 9.9049 9.9049 10.2781 10.2781 10.8401 10.8401 11.1970 11.1970 11.4817 11.4817 11.5894 11.5894 12.3980 12.3980 12.9574 12.9574 13.1199 13.1199 17.2005 17.2005 21.2494 21.2494 k = 0.0000 0.3730-0.0000 ( 812 PWs) bands (ev): 7.3476 7.3476 9.7001 9.7001 9.9388 9.9388 10.2625 10.2625 10.8101 10.8101 11.1791 11.1791 11.4718 11.4718 11.6022 11.6022 12.3789 12.3789 12.9435 12.9435 13.1715 13.1715 17.0157 17.0157 21.4267 21.4267 k = 0.0000 0.3810-0.0000 ( 812 PWs) bands (ev): 7.4581 7.4581 9.6894 9.6894 9.9733 9.9733 10.2482 10.2482 10.7820 10.7820 11.1604 11.1604 11.4621 11.4621 11.6157 11.6157 12.3610 12.3610 12.9300 12.9300 13.2244 13.2244 16.8363 16.8363 21.6053 21.6053 k = 0.0000 0.3889-0.0000 ( 812 PWs) bands (ev): 7.5685 7.5685 9.6741 9.6741 10.0079 10.0079 10.2351 10.2351 10.7557 10.7557 11.1411 11.1411 11.4525 11.4525 11.6292 11.6292 12.3440 12.3440 12.9168 12.9168 13.2785 13.2785 16.6624 16.6624 21.7853 21.7853 k = 0.0000 0.3968-0.0000 ( 816 PWs) bands (ev): 7.6785 7.6785 9.6541 9.6541 10.0418 10.0418 10.2231 10.2231 10.7310 10.7310 11.1211 11.1211 11.4433 11.4433 11.6425 11.6425 12.3280 12.3280 12.9041 12.9041 13.3336 13.3336 16.4943 16.4943 21.9665 21.9665 k = 0.0000 0.4048-0.0000 ( 816 PWs) bands (ev): 7.7878 7.7878 9.6300 9.6300 10.0744 10.0744 10.2130 10.2130 10.7083 10.7083 11.1007 11.1007 11.4345 11.4345 11.6554 11.6554 12.3131 12.3131 12.8919 12.8919 13.3897 13.3897 16.3325 16.3325 22.1491 22.1491 k = 0.0000 0.4127-0.0000 ( 816 PWs) bands (ev): 7.8962 7.8962 9.6014 9.6014 10.1043 10.1043 10.2057 10.2057 10.6875 10.6875 11.0801 11.0801 11.4263 11.4263 11.6678 11.6678 12.2993 12.2993 12.8803 12.8803 13.4466 13.4466 16.1773 16.1773 22.3330 22.3330 k = 0.0000 0.4206-0.0000 ( 816 PWs) bands (ev): 8.0035 8.0035 9.5684 9.5684 10.1286 10.1286 10.2040 10.2040 10.6684 10.6684 11.0594 11.0594 11.4187 11.4187 11.6796 11.6796 12.2866 12.2866 12.8694 12.8694 13.5041 13.5041 16.0291 16.0291 22.5182 22.5182 k = 0.0000 0.4286-0.0000 ( 816 PWs) bands (ev): 8.1093 8.1093 9.5309 9.5309 10.1424 10.1424 10.2124 10.2124 10.6511 10.6511 11.0388 11.0388 11.4117 11.4117 11.6906 11.6906 12.2751 12.2751 12.8592 12.8592 13.5620 13.5620 15.8885 15.8885 22.7047 22.7047 k = 0.0000 0.4365-0.0000 ( 816 PWs) bands (ev): 8.2133 8.2133 9.4890 9.4890 10.1453 10.1453 10.2311 10.2311 10.6356 10.6356 11.0187 11.0187 11.4054 11.4054 11.7007 11.7007 12.2647 12.2647 12.8499 12.8499 13.6197 13.6197 15.7559 15.7559 22.8924 22.8924 k = 0.0000 0.4444-0.0000 ( 816 PWs) bands (ev): 8.3152 8.3152 9.4427 9.4427 10.1429 10.1429 10.2543 10.2543 10.6220 10.6220 10.9993 10.9993 11.3998 11.3998 11.7099 11.7099 12.2555 12.2555 12.8414 12.8414 13.6767 13.6767 15.6324 15.6324 23.0815 23.0815 k = 0.0000 0.4524-0.0000 ( 820 PWs) bands (ev): 8.4145 8.4145 9.3919 9.3919 10.1388 10.1388 10.2778 10.2778 10.6100 10.6100 10.9810 10.9810 11.3948 11.3948 11.7180 11.7180 12.2473 12.2473 12.8339 12.8339 13.7321 13.7321 15.5187 15.5187 23.2718 23.2718 k = 0.0000 0.4603-0.0000 ( 820 PWs) bands (ev): 8.5108 8.5108 9.3374 9.3374 10.1346 10.1346 10.2999 10.2999 10.5999 10.5999 10.9642 10.9642 11.3906 11.3906 11.7251 11.7251 12.2405 12.2405 12.8275 12.8275 13.7847 13.7847 15.4166 15.4166 23.4633 23.4633 k = 0.0000 0.4683-0.0000 ( 820 PWs) bands (ev): 8.6033 8.6033 9.2792 9.2792 10.1308 10.1308 10.3193 10.3193 10.5917 10.5917 10.9494 10.9494 11.3872 11.3872 11.7310 11.7310 12.2349 12.2349 12.8221 12.8221 13.8328 13.8328 15.3277 15.3277 23.6561 23.6561 k = 0.0000 0.4762-0.0000 ( 820 PWs) bands (ev): 8.6909 8.6909 9.2186 9.2186 10.1277 10.1277 10.3354 10.3354 10.5852 10.5852 10.9371 10.9371 11.3845 11.3845 11.7356 11.7356 12.2306 12.2306 12.8179 12.8179 13.8744 13.8744 15.2543 15.2543 23.8501 23.8501 k = 0.0000 0.4841-0.0000 ( 818 PWs) bands (ev): 8.7710 8.7710 9.1580 9.1580 10.1255 10.1255 10.3476 10.3476 10.5807 10.5807 10.9280 10.9280 11.3826 11.3826 11.7389 11.7389 12.2275 12.2275 12.8148 12.8148 13.9069 13.9069 15.1990 15.1990 24.0452 24.0452 k = 0.0000 0.4921-0.0000 ( 814 PWs) bands (ev): 8.8361 8.8361 9.1045 9.1045 10.1241 10.1241 10.3551 10.3551 10.5779 10.5779 10.9223 10.9223 11.3816 11.3816 11.7410 11.7410 12.2257 12.2257 12.8131 12.8131 13.9278 13.9278 15.1645 15.1645 24.2412 24.2412 k = 0.0000 0.5000-0.0000 ( 814 PWs) bands (ev): 8.8650 8.8650 9.0796 9.0796 10.1236 10.1236 10.3576 10.3576 10.5770 10.5770 10.9203 10.9203 11.3812 11.3812 11.7417 11.7417 12.2251 12.2251 12.8125 12.8125 13.9350 13.9350 15.1527 15.1527 24.4192 24.4192 k = 0.0000 0.5000-0.0000 ( 814 PWs) bands (ev): 8.8650 8.8650 9.0796 9.0796 10.1236 10.1236 10.3576 10.3576 10.5770 10.5770 10.9203 10.9203 11.3812 11.3812 11.7417 11.7417 12.2251 12.2251 12.8125 12.8125 13.9350 13.9350 15.1527 15.1527 24.4192 24.4192 k = 0.0079 0.5000-0.0000 ( 818 PWs) bands (ev): 8.8657 8.8657 9.0802 9.0802 10.1229 10.1229 10.3571 10.3571 10.5750 10.5750 10.9174 10.9174 11.3853 11.3853 11.7436 11.7436 12.2256 12.2256 12.8127 12.8127 13.9357 13.9357 15.1529 15.1529 24.4207 24.4207 k = 0.0159 0.5000-0.0000 ( 818 PWs) bands (ev): 8.8679 8.8679 9.0821 9.0821 10.1208 10.1208 10.3558 10.3558 10.5692 10.5692 10.9094 10.9094 11.3976 11.3976 11.7496 11.7496 12.2275 12.2275 12.8138 12.8138 13.9380 13.9380 15.1536 15.1536 24.4251 24.4251 k = 0.0238 0.5000-0.0000 ( 818 PWs) bands (ev): 8.8715 8.8715 9.0851 9.0851 10.1173 10.1173 10.3537 10.3537 10.5597 10.5597 10.8970 10.8970 11.4171 11.4171 11.7595 11.7595 12.2307 12.2307 12.8156 12.8156 13.9418 13.9418 15.1547 15.1547 24.4323 24.4323 k = 0.0317 0.5000-0.0000 ( 818 PWs) bands (ev): 8.8765 8.8765 9.0893 9.0893 10.1124 10.1124 10.3509 10.3509 10.5467 10.5467 10.8815 10.8815 11.4425 11.4425 11.7730 11.7730 12.2351 12.2351 12.8182 12.8182 13.9471 13.9471 15.1563 15.1563 24.4425 24.4425 k = 0.0397 0.5000-0.0000 ( 818 PWs) bands (ev): 8.8828 8.8828 9.0945 9.0945 10.1062 10.1062 10.3475 10.3475 10.5305 10.5305 10.8641 10.8641 11.4729 11.4729 11.7899 11.7899 12.2406 12.2406 12.8215 12.8215 13.9538 13.9538 15.1583 15.1583 24.4556 24.4556 k = 0.0476 0.5000-0.0000 ( 818 PWs) bands (ev): 8.8903 8.8903 9.1005 9.1005 10.0986 10.0986 10.3436 10.3436 10.5114 10.5114 10.8460 10.8460 11.5071 11.5071 11.8099 11.8099 12.2472 12.2472 12.8254 12.8254 13.9621 13.9621 15.1607 15.1607 24.4928 24.4929 k = 0.0556 0.5000-0.0000 ( 814 PWs) bands (ev): 8.8989 8.8989 9.1074 9.1074 10.0898 10.0898 10.3394 10.3394 10.4899 10.4899 10.8281 10.8281 11.5445 11.5445 11.8329 11.8329 12.2549 12.2549 12.8303 12.8303 13.9718 13.9718 15.1636 15.1636 24.5046 24.5046 k = 0.0635 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9082 8.9082 9.1147 9.1147 10.0796 10.0796 10.3346 10.3346 10.4661 10.4661 10.8108 10.8108 11.5840 11.5840 11.8582 11.8582 12.2635 12.2635 12.8355 12.8355 13.9829 13.9829 15.1669 15.1669 24.5176 24.5179 k = 0.0714 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9184 8.9184 9.1223 9.1223 10.0682 10.0682 10.3300 10.3300 10.4408 10.4408 10.7955 10.7955 11.6257 11.6257 11.8857 11.8857 12.2730 12.2730 12.8414 12.8414 13.9955 13.9955 15.1706 15.1706 24.5330 24.5330 k = 0.0794 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9292 8.9292 9.1301 9.1301 10.0556 10.0556 10.3251 10.3251 10.4146 10.4146 10.7823 10.7823 11.6689 11.6689 11.9151 11.9151 12.2832 12.2832 12.8480 12.8480 14.0095 14.0095 15.1748 15.1748 24.5498 24.5498 k = 0.0873 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9403 8.9403 9.1377 9.1377 10.0418 10.0418 10.3190 10.3190 10.3890 10.3890 10.7719 10.7719 11.7133 11.7133 11.9461 11.9461 12.2942 12.2942 12.8551 12.8551 14.0248 14.0248 15.1794 15.1794 24.5683 24.5683 k = 0.0952 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9515 8.9515 9.1449 9.1449 10.0269 10.0269 10.3094 10.3094 10.3671 10.3671 10.7649 10.7649 11.7587 11.7587 11.9784 11.9784 12.3057 12.3057 12.8626 12.8626 14.0415 14.0415 15.1844 15.1844 24.5885 24.5886 k = 0.1032 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9625 8.9625 9.1514 9.1514 10.0109 10.0109 10.2917 10.2917 10.3536 10.3536 10.7612 10.7612 11.8050 11.8050 12.0120 12.0120 12.3177 12.3177 12.8708 12.8708 14.0595 14.0595 15.1898 15.1898 24.6104 24.6105 k = 0.1111 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9732 8.9732 9.1570 9.1570 9.9940 9.9940 10.2659 10.2659 10.3490 10.3490 10.7611 10.7611 11.8519 11.8519 12.0466 12.0466 12.3302 12.3302 12.8795 12.8795 14.0789 14.0789 15.1957 15.1957 24.6341 24.6341 k = 0.1190 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9830 8.9830 9.1613 9.1613 9.9760 9.9760 10.2357 10.2357 10.3508 10.3508 10.7657 10.7657 11.8993 11.8993 12.0820 12.0820 12.3431 12.3431 12.8887 12.8887 14.0994 14.0994 15.2019 15.2019 24.6594 24.6594 k = 0.1270 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9919 8.9919 9.1642 9.1642 9.9571 9.9571 10.2033 10.2033 10.3570 10.3570 10.7748 10.7748 11.9470 11.9470 12.1180 12.1180 12.3562 12.3562 12.8983 12.8983 14.1211 14.1211 15.2084 15.2084 24.6863 24.6863 k = 0.1349 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9995 8.9995 9.1655 9.1655 9.9374 9.9374 10.1696 10.1696 10.3670 10.3670 10.7887 10.7887 11.9950 11.9950 12.1545 12.1545 12.3695 12.3695 12.9083 12.9083 14.1439 14.1439 15.2154 15.2154 24.7149 24.7149 k = 0.1429 0.5000-0.0000 ( 818 PWs) bands (ev): 9.0056 9.0056 9.1650 9.1650 9.9169 9.9169 10.1353 10.1353 10.3809 10.3809 10.8077 10.8077 12.0431 12.0431 12.1914 12.1914 12.3830 12.3830 12.9187 12.9187 14.1678 14.1678 15.2227 15.2227 24.7450 24.7450 k = 0.1508 0.5000-0.0000 ( 818 PWs) bands (ev): 9.0100 9.0100 9.1627 9.1627 9.8957 9.8957 10.1005 10.1005 10.3985 10.3985 10.8317 10.8317 12.0913 12.0913 12.2284 12.2284 12.3966 12.3966 12.9294 12.9294 14.1927 14.1927 15.2303 15.2303 24.7768 24.7768 k = 0.1587 0.5000-0.0000 ( 814 PWs) bands (ev): 9.0126 9.0126 9.1584 9.1584 9.8739 9.8739 10.0657 10.0657 10.4200 10.4200 10.8609 10.8609 12.1395 12.1395 12.2655 12.2655 12.4106 12.4106 12.9404 12.9404 14.2187 14.2187 15.2383 15.2383 24.8101 24.8101 k = 0.1667 0.5000-0.0000 ( 814 PWs) bands (ev): 9.0131 9.0131 9.1523 9.1523 9.8515 9.8515 10.0306 10.0306 10.4456 10.4456 10.8952 10.8952 12.1874 12.1874 12.3025 12.3025 12.4245 12.4245 12.9517 12.9517 14.2455 14.2455 15.2466 15.2466 24.8449 24.8450 k = 0.1746 0.5000-0.0000 ( 814 PWs) bands (ev): 9.0116 9.0116 9.1442 9.1442 9.8285 9.8285 9.9956 9.9956 10.4752 10.4752 10.9346 10.9346 12.2351 12.2351 12.3392 12.3392 12.4387 12.4387 12.9631 12.9631 14.2732 14.2732 15.2551 15.2551 24.8813 24.8813 k = 0.1825 0.5000-0.0000 ( 818 PWs) bands (ev): 9.0080 9.0080 9.1343 9.1343 9.8049 9.8049 9.9604 9.9604 10.5090 10.5090 10.9789 10.9789 12.2823 12.2823 12.3752 12.3752 12.4534 12.4534 12.9748 12.9748 14.3017 14.3017 15.2639 15.2639 24.9191 24.9191 k = 0.1905 0.5000-0.0000 ( 818 PWs) bands (ev): 9.0024 9.0024 9.1229 9.1229 9.7811 9.7811 9.9258 9.9258 10.5467 10.5467 11.0280 11.0280 12.3291 12.3291 12.4100 12.4100 12.4693 12.4693 12.9866 12.9866 14.3310 14.3310 15.2730 15.2730 24.9583 24.9583 k = 0.1984 0.5000-0.0000 ( 818 PWs) bands (ev): 8.9948 8.9948 9.1098 9.1098 9.7570 9.7570 9.8914 9.8914 10.5885 10.5885 11.0818 11.0818 12.3750 12.3750 12.4419 12.4419 12.4880 12.4880 12.9986 12.9986 14.3609 14.3609 15.2822 15.2822 24.9990 24.9990 k = 0.2063 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9853 8.9853 9.0953 9.0953 9.7327 9.7327 9.8573 9.8573 10.6340 10.6340 11.1400 11.1400 12.4194 12.4194 12.4692 12.4692 12.5118 12.5118 13.0106 13.0106 14.3914 14.3914 15.2917 15.2917 25.0409 25.0409 k = 0.2143 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9741 8.9741 9.0798 9.0798 9.7083 9.7083 9.8236 9.8236 10.6832 10.6832 11.2025 11.2025 12.4596 12.4596 12.4940 12.4940 12.5412 12.5412 13.0227 13.0227 14.4226 14.4226 15.3013 15.3013 25.0842 25.0842 k = 0.2222 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9614 8.9614 9.0631 9.0631 9.6837 9.6837 9.7904 9.7904 10.7359 10.7359 11.2689 11.2689 12.4885 12.4885 12.5256 12.5256 12.5739 12.5739 13.0349 13.0349 14.4542 14.4542 15.3110 15.3110 25.1287 25.1287 k = 0.2302 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9474 8.9474 9.0456 9.0456 9.6590 9.6590 9.7578 9.7578 10.7918 10.7918 11.3391 11.3391 12.5064 12.5064 12.5655 12.5655 12.6078 12.6078 13.0471 13.0471 14.4863 14.4863 15.3208 15.3208 25.1743 25.1743 k = 0.2381 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9321 8.9321 9.0274 9.0274 9.6344 9.6344 9.7256 9.7256 10.8507 10.8507 11.4128 11.4128 12.5204 12.5204 12.6076 12.6076 12.6419 12.6419 13.0592 13.0592 14.5187 14.5187 15.3306 15.3306 25.2210 25.2210 k = 0.2460 0.5000-0.0000 ( 820 PWs) bands (ev): 8.9157 8.9157 9.0086 9.0086 9.6099 9.6099 9.6941 9.6941 10.9123 10.9123 11.4898 11.4898 12.5328 12.5328 12.6498 12.6498 12.6759 12.6759 13.0713 13.0713 14.5515 14.5515 15.3405 15.3405 25.2685 25.2685 k = 0.2540 0.5000-0.0000 ( 820 PWs) bands (ev): 8.8985 8.8985 8.9893 8.9893 9.5855 9.5855 9.6632 9.6632 10.9765 10.9765 11.5698 11.5698 12.5442 12.5442 12.6915 12.6915 12.7095 12.7095 13.0833 13.0833 14.5845 14.5845 15.3502 15.3502 25.3167 25.3167 k = 0.2619 0.5000-0.0000 ( 820 PWs) bands (ev): 8.8806 8.8806 8.9698 8.9698 9.5613 9.5613 9.6330 9.6330 11.0429 11.0429 11.6526 11.6526 12.5551 12.5551 12.7325 12.7325 12.7427 12.7427 13.0952 13.0952 14.6177 14.6177 15.3599 15.3599 25.3647 25.3647 k = 0.2698 0.5000-0.0000 ( 832 PWs) bands (ev): 8.8620 8.8620 8.9500 8.9500 9.5371 9.5371 9.6033 9.6033 11.1111 11.1111 11.7378 11.7378 12.5651 12.5651 12.7718 12.7718 12.7755 12.7755 13.1067 13.1067 14.6509 14.6509 15.3693 15.3693 25.4100 25.4100 k = 0.2778 0.5000-0.0000 ( 832 PWs) bands (ev): 8.8431 8.8431 8.9302 8.9302 9.5135 9.5135 9.5746 9.5746 11.1813 11.1813 11.8255 11.8255 12.5749 12.5749 12.8065 12.8065 12.8119 12.8119 13.1183 13.1183 14.6844 14.6844 15.3785 15.3785 25.4323 25.4323 k = 0.2857 0.5000-0.0000 ( 832 PWs) bands (ev): 8.8239 8.8239 8.9105 8.9105 9.4901 9.4901 9.5466 9.5466 11.2529 11.2529 11.9152 11.9152 12.5844 12.5844 12.8379 12.8379 12.8499 12.8499 13.1298 13.1298 14.7178 14.7178 15.3874 15.3874 25.3416 25.3416 k = 0.2937 0.5000-0.0000 ( 832 PWs) bands (ev): 8.8045 8.8045 8.8909 8.8909 9.4671 9.4671 9.5195 9.5195 11.3257 11.3257 12.0067 12.0067 12.5936 12.5936 12.8684 12.8684 12.8869 12.8869 13.1411 13.1411 14.7512 14.7512 15.3959 15.3959 25.1880 25.1880 k = 0.3016 0.5000-0.0000 ( 824 PWs) bands (ev): 8.7853 8.7853 8.8716 8.8716 9.4447 9.4447 9.4933 9.4933 11.3998 11.3998 12.1000 12.1000 12.6024 12.6024 12.8983 12.8983 12.9229 12.9229 13.1525 13.1525 14.7845 14.7845 15.4040 15.4040 25.0185 25.0185 k = 0.3095 0.5000-0.0000 ( 824 PWs) bands (ev): 8.7660 8.7660 8.8525 8.8525 9.4226 9.4226 9.4678 9.4678 11.4742 11.4742 12.1944 12.1944 12.6109 12.6109 12.9271 12.9271 12.9576 12.9576 13.1634 13.1634 14.8177 14.8177 15.4116 15.4116 24.8427 24.8427 k = 0.3175 0.5000-0.0000 ( 828 PWs) bands (ev): 8.7469 8.7469 8.8338 8.8338 9.4010 9.4010 9.4432 9.4432 11.5488 11.5488 12.2896 12.2896 12.6191 12.6191 12.9549 12.9549 12.9911 12.9911 13.1740 13.1740 14.8506 14.8506 15.4185 15.4185 24.6648 24.6648 k = 0.3254 0.5000-0.0000 ( 828 PWs) bands (ev): 8.7280 8.7280 8.8155 8.8155 9.3801 9.3801 9.4195 9.4195 11.6237 11.6237 12.3854 12.3854 12.6272 12.6272 12.9819 12.9819 13.0234 13.0234 13.1845 13.1845 14.8833 14.8833 15.4247 15.4247 24.4871 24.4871 k = 0.3333 0.5000-0.0000 ( 828 PWs) bands (ev): 8.7094 8.7094 8.7977 8.7977 9.3597 9.3597 9.3968 9.3968 11.6984 11.6984 12.4811 12.4811 12.6357 12.6357 13.0080 13.0080 13.0543 13.0543 13.1948 13.1948 14.9156 14.9156 15.4301 15.4301 24.3113 24.3113 k = 0.3413 0.5000-0.0000 ( 828 PWs) bands (ev): 8.6913 8.6913 8.7804 8.7804 9.3400 9.3400 9.3751 9.3751 11.7725 11.7725 12.5737 12.5737 12.6470 12.6470 13.0331 13.0331 13.0837 13.0837 13.2049 13.2049 14.9476 14.9476 15.4347 15.4347 24.1386 24.1386 k = 0.3492 0.5000-0.0000 ( 828 PWs) bands (ev): 8.6737 8.6737 8.7637 8.7637 9.3210 9.3210 9.3544 9.3544 11.8459 11.8459 12.6340 12.6340 12.6902 12.6902 13.0572 13.0572 13.1118 13.1118 13.2149 13.2149 14.9791 14.9791 15.4383 15.4383 23.9698 23.9698 k = 0.3571 0.5000-0.0000 ( 828 PWs) bands (ev): 8.6567 8.6567 8.7476 8.7476 9.3027 9.3027 9.3346 9.3346 11.9182 11.9182 12.6477 12.6477 12.7792 12.7792 13.0802 13.0802 13.1382 13.1382 13.2250 13.2250 15.0100 15.0100 15.4409 15.4409 23.8055 23.8055 k = 0.3651 0.5000-0.0000 ( 828 PWs) bands (ev): 8.6403 8.6403 8.7322 8.7322 9.2852 9.2852 9.3158 9.3158 11.9890 11.9890 12.6552 12.6552 12.8730 12.8730 13.1022 13.1022 13.1630 13.1630 13.2352 13.2352 15.0404 15.0404 15.4424 15.4424 23.6465 23.6465 k = 0.3730 0.5000-0.0000 ( 828 PWs) bands (ev): 8.6245 8.6245 8.7175 8.7175 9.2685 9.2685 9.2981 9.2981 12.0580 12.0580 12.6614 12.6614 12.9662 12.9662 13.1232 13.1232 13.1861 13.1861 13.2458 13.2458 15.0700 15.0700 15.4427 15.4427 23.4931 23.4931 k = 0.3810 0.5000-0.0000 ( 828 PWs) bands (ev): 8.6095 8.6095 8.7036 8.7036 9.2526 9.2526 9.2814 9.2814 12.1250 12.1250 12.6670 12.6670 13.0567 13.0567 13.1434 13.1434 13.2078 13.2078 13.2572 13.2572 15.0989 15.0989 15.4418 15.4418 23.3459 23.3459 k = 0.3889 0.5000-0.0000 ( 828 PWs) bands (ev): 8.5952 8.5952 8.6904 8.6904 9.2376 9.2376 9.2657 9.2657 12.1895 12.1895 12.6720 12.6720 13.1387 13.1387 13.1651 13.1651 13.2304 13.2304 13.2701 13.2701 15.1268 15.1268 15.4396 15.4396 23.2054 23.2054 k = 0.3968 0.5000-0.0000 ( 816 PWs) bands (ev): 8.5820 8.5820 8.6782 8.6782 9.2238 9.2238 9.2513 9.2513 12.2515 12.2515 12.6769 12.6769 13.1761 13.1761 13.2086 13.2086 13.2652 13.2652 13.2891 13.2891 15.1538 15.1538 15.4362 15.4362 23.0720 23.0720 k = 0.4048 0.5000-0.0000 ( 816 PWs) bands (ev): 8.5694 8.5694 8.6666 8.6666 9.2107 9.2107 9.2377 9.2377 12.3103 12.3103 12.6812 12.6812 13.1935 13.1935 13.2339 13.2339 13.2923 13.2923 13.3472 13.3472 15.1797 15.1797 15.4315 15.4315 22.9461 22.9461 k = 0.4127 0.5000-0.0000 ( 816 PWs) bands (ev): 8.5577 8.5577 8.6559 8.6559 9.1985 9.1985 9.2252 9.2252 12.3657 12.3657 12.6851 12.6851 13.2088 13.2088 13.2469 13.2469 13.3080 13.3080 13.4251 13.4251 15.2042 15.2042 15.4256 15.4256 22.8283 22.8283 k = 0.4206 0.5000-0.0000 ( 816 PWs) bands (ev): 8.5469 8.5469 8.6461 8.6461 9.1873 9.1873 9.2137 9.2137 12.4174 12.4174 12.6887 12.6887 13.2226 13.2226 13.2560 13.2560 13.3221 13.3221 13.5027 13.5027 15.2274 15.2274 15.4187 15.4187 22.7188 22.7188 k = 0.4286 0.5000-0.0000 ( 816 PWs) bands (ev): 8.5371 8.5371 8.6372 8.6372 9.1771 9.1771 9.2033 9.2033 12.4651 12.4651 12.6920 12.6920 13.2351 13.2351 13.2632 13.2632 13.3353 13.3353 13.5769 13.5769 15.2490 15.2490 15.4108 15.4108 22.6182 22.6182 k = 0.4365 0.5000-0.0000 ( 820 PWs) bands (ev): 8.5282 8.5282 8.6290 8.6290 9.1676 9.1676 9.1937 9.1937 12.5086 12.5086 12.6949 12.6949 13.2463 13.2463 13.2692 13.2692 13.3472 13.3472 13.6466 13.6466 15.2688 15.2688 15.4023 15.4023 22.5269 22.5269 k = 0.4444 0.5000-0.0000 ( 816 PWs) bands (ev): 8.5203 8.5203 8.6220 8.6220 9.1595 9.1595 9.1855 9.1855 12.5476 12.5476 12.6978 12.6978 13.2563 13.2563 13.2742 13.2742 13.3582 13.3582 13.7108 13.7108 15.2868 15.2868 15.3933 15.3933 22.4452 22.4452 k = 0.4524 0.5000-0.0000 ( 816 PWs) bands (ev): 8.5135 8.5135 8.6158 8.6158 9.1524 9.1524 9.1783 9.1783 12.5818 12.5818 12.7002 12.7002 13.2649 13.2649 13.2784 13.2784 13.3676 13.3676 13.7686 13.7686 15.3028 15.3028 15.3843 15.3843 22.3736 22.3736 k = 0.4603 0.5000-0.0000 ( 812 PWs) bands (ev): 8.5077 8.5077 8.6106 8.6106 9.1467 9.1467 9.1725 9.1725 12.6110 12.6110 12.7022 12.7022 13.2722 13.2722 13.2819 13.2819 13.3757 13.3757 13.8194 13.8194 15.3165 15.3165 15.3757 15.3757 22.3123 22.3123 k = 0.4683 0.5000-0.0000 ( 814 PWs) bands (ev): 8.5028 8.5028 8.6061 8.6061 9.1413 9.1413 9.1671 9.1671 12.6352 12.6352 12.7042 12.7042 13.2782 13.2782 13.2849 13.2849 13.3824 13.3824 13.8623 13.8623 15.3277 15.3277 15.3680 15.3680 22.2617 22.2617 k = 0.4762 0.5000-0.0000 ( 822 PWs) bands (ev): 8.4987 8.4987 8.6023 8.6023 9.1372 9.1372 9.1630 9.1630 12.6538 12.6538 12.7058 12.7058 13.2826 13.2826 13.2871 13.2871 13.3875 13.3875 13.8965 13.8965 15.3361 15.3361 15.3618 15.3618 22.2221 22.2221 k = 0.4841 0.5000-0.0000 ( 824 PWs) bands (ev): 8.4958 8.4958 8.5998 8.5998 9.1344 9.1344 9.1602 9.1602 12.6669 12.6669 12.7072 12.7072 13.2856 13.2856 13.2890 13.2890 13.3912 13.3912 13.9215 13.9215 15.3413 15.3413 15.3579 15.3579 22.1936 22.1936 k = 0.4921 0.5000-0.0000 ( 824 PWs) bands (ev): 8.4942 8.4942 8.5983 8.5983 9.1328 9.1328 9.1585 9.1585 12.6746 12.6746 12.7082 12.7082 13.2872 13.2872 13.2902 13.2902 13.3935 13.3935 13.9367 13.9367 15.3433 15.3433 15.3567 15.3567 22.1765 22.1765 k = 0.5000 0.5000-0.0000 ( 824 PWs) bands (ev): 8.4937 8.4937 8.5978 8.5978 9.1322 9.1322 9.1580 9.1580 12.6771 12.6771 12.7087 12.7087 13.2877 13.2877 13.2907 13.2907 13.3942 13.3942 13.9418 13.9418 15.3435 15.3435 15.3566 15.3566 22.1708 22.1708 k = 0.5000 0.5000-0.0000 ( 824 PWs) bands (ev): 8.4937 8.4937 8.5978 8.5978 9.1322 9.1322 9.1580 9.1580 12.6771 12.6771 12.7087 12.7087 13.2877 13.2877 13.2907 13.2907 13.3942 13.3942 13.9418 13.9418 15.3435 15.3435 15.3566 15.3566 22.1708 22.1708 k = 0.4943 0.4943-0.0000 ( 824 PWs) bands (ev): 8.4943 8.4943 8.5983 8.5983 9.1328 9.1328 9.1585 9.1585 12.6745 12.6745 12.7082 12.7082 13.2871 13.2871 13.2903 13.2903 13.3935 13.3935 13.9366 13.9366 15.3394 15.3394 15.3605 15.3605 22.1766 22.1766 k = 0.4886 0.4886-0.0000 ( 824 PWs) bands (ev): 8.4959 8.4959 8.5998 8.5998 9.1345 9.1345 9.1602 9.1602 12.6669 12.6669 12.7069 12.7069 13.2848 13.2848 13.2896 13.2896 13.3912 13.3912 13.9213 13.9213 15.3162 15.3162 15.3828 15.3828 22.1931 22.1931 k = 0.4830 0.4830-0.0000 ( 816 PWs) bands (ev): 8.4989 8.4989 8.6028 8.6028 9.1376 9.1376 9.1633 9.1633 12.6542 12.6542 12.7047 12.7047 13.2803 13.2803 13.2893 13.2893 13.3874 13.3874 13.8972 13.8972 15.2757 15.2757 15.4212 15.4212 22.2178 22.2178 k = 0.4773 0.4773-0.0000 ( 820 PWs) bands (ev): 8.5024 8.5024 8.6064 8.6064 9.1415 9.1415 9.1673 9.1673 12.6363 12.6363 12.7014 12.7014 13.2736 13.2736 13.2890 13.2890 13.3820 13.3820 13.8655 13.8655 15.2199 15.2199 15.4730 15.4730 22.2470 22.2470 k = 0.4716 0.4716-0.0000 ( 820 PWs) bands (ev): 8.5066 8.5066 8.6113 8.6113 9.1468 9.1468 9.1727 9.1727 12.6134 12.6134 12.6974 12.6974 13.2647 13.2647 13.2887 13.2887 13.3752 13.3752 13.8280 13.8280 15.1500 15.1500 15.5364 15.5364 22.2768 22.2768 k = 0.4659 0.4659-0.0000 ( 824 PWs) bands (ev): 8.5113 8.5113 8.6175 8.6175 9.1527 9.1527 9.1786 9.1786 12.5856 12.5856 12.6925 12.6925 13.2542 13.2542 13.2881 13.2881 13.3671 13.3671 13.7864 13.7864 15.0673 15.0673 15.6097 15.6097 22.3042 22.3042 k = 0.4602 0.4602-0.0000 ( 824 PWs) bands (ev): 8.5163 8.5163 8.6253 8.6253 9.1600 9.1600 9.1860 9.1860 12.5533 12.5533 12.6866 12.6866 13.2418 13.2418 13.2873 13.2873 13.3577 13.3577 13.7418 13.7418 14.9733 14.9733 15.6914 15.6914 22.3281 22.3281 k = 0.4545 0.4545-0.0000 ( 824 PWs) bands (ev): 8.5214 8.5214 8.6348 8.6348 9.1684 9.1684 9.1945 9.1945 12.5163 12.5163 12.6797 12.6797 13.2276 13.2276 13.2861 13.2861 13.3472 13.3472 13.6956 13.6956 14.8695 14.8695 15.7803 15.7803 22.3483 22.3483 k = 0.4489 0.4489-0.0000 ( 822 PWs) bands (ev): 8.5262 8.5262 8.6464 8.6464 9.1780 9.1780 9.2042 9.2042 12.4751 12.4751 12.6717 12.6717 13.2116 13.2116 13.2841 13.2841 13.3359 13.3359 13.6484 13.6484 14.7573 14.7573 15.8753 15.8753 22.3657 22.3657 k = 0.4432 0.4432-0.0000 ( 826 PWs) bands (ev): 8.5304 8.5304 8.6595 8.6595 9.1885 9.1885 9.2149 9.2149 12.4297 12.4297 12.6626 12.6626 13.1939 13.1939 13.2801 13.2801 13.3247 13.3247 13.6009 13.6009 14.6383 14.6383 15.9755 15.9755 22.3810 22.3810 k = 0.4375 0.4375-0.0000 ( 826 PWs) bands (ev): 8.5340 8.5340 8.6747 8.6747 9.2002 9.2002 9.2269 9.2269 12.3806 12.3806 12.6522 12.6522 13.1745 13.1745 13.2732 13.2732 13.3150 13.3150 13.5537 13.5537 14.5139 14.5139 16.0804 16.0804 22.3948 22.3948 k = 0.4318 0.4318-0.0000 ( 826 PWs) bands (ev): 8.5366 8.5366 8.6918 8.6918 9.2130 9.2130 9.2399 9.2399 12.3281 12.3281 12.6406 12.6406 13.1535 13.1535 13.2616 13.2616 13.3082 13.3082 13.5069 13.5069 14.3855 14.3855 16.1893 16.1893 22.4078 22.4078 k = 0.4261 0.4261-0.0000 ( 826 PWs) bands (ev): 8.5383 8.5383 8.7109 8.7109 9.2269 9.2269 9.2541 9.2541 12.2726 12.2726 12.6274 12.6274 13.1310 13.1310 13.2454 13.2454 13.3042 13.3042 13.4608 13.4608 14.2546 14.2546 16.3019 16.3019 22.4204 22.4204 k = 0.4205 0.4205-0.0000 ( 834 PWs) bands (ev): 8.5385 8.5385 8.7317 8.7317 9.2414 9.2414 9.2693 9.2693 12.2143 12.2143 12.6125 12.6125 13.1068 13.1068 13.2249 13.2249 13.3019 13.3019 13.4154 13.4154 14.1227 14.1227 16.4177 16.4177 22.4328 22.4328 k = 0.4148 0.4148-0.0000 ( 838 PWs) bands (ev): 8.5375 8.5375 8.7543 8.7543 9.2572 9.2572 9.2858 9.2858 12.1538 12.1538 12.5956 12.5956 13.0812 13.0812 13.2011 13.2011 13.3005 13.3005 13.3711 13.3711 13.9912 13.9912 16.5364 16.5364 22.4452 22.4452 k = 0.4091 0.4091-0.0000 ( 830 PWs) bands (ev): 8.5353 8.5353 8.7784 8.7784 9.2748 9.2748 9.3038 9.3038 12.0912 12.0912 12.5767 12.5767 13.0544 13.0544 13.1741 13.1741 13.2988 13.2988 13.3287 13.3287 13.8620 13.8620 16.6578 16.6578 22.4579 22.4579 k = 0.4034 0.4034-0.0000 ( 830 PWs) bands (ev): 8.5312 8.5312 8.8040 8.8040 9.2927 9.2927 9.3227 9.3227 12.0269 12.0269 12.5551 12.5551 13.0262 13.0262 13.1433 13.1433 13.2815 13.2815 13.3031 13.3031 13.7367 13.7367 16.7818 16.7818 22.4710 22.4710 k = 0.3977 0.3977-0.0000 ( 830 PWs) bands (ev): 8.5252 8.5252 8.8309 8.8309 9.3116 9.3116 9.3427 9.3427 11.9613 11.9613 12.5302 12.5302 12.9968 12.9968 13.1081 13.1081 13.2418 13.2418 13.3010 13.3010 13.6178 13.6178 16.9080 16.9080 22.4846 22.4846 k = 0.3920 0.3920-0.0000 ( 830 PWs) bands (ev): 8.5171 8.5171 8.8590 8.8590 9.3313 9.3313 9.3639 9.3639 11.8946 11.8946 12.5014 12.5014 12.9661 12.9661 13.0677 13.0677 13.2011 13.2011 13.3004 13.3004 13.5080 13.5080 17.0364 17.0364 22.4987 22.4987 k = 0.3864 0.3864-0.0000 ( 830 PWs) bands (ev): 8.5065 8.5065 8.8882 8.8882 9.3520 9.3520 9.3863 9.3863 11.8271 11.8271 12.4675 12.4675 12.9344 12.9344 13.0218 13.0218 13.1602 13.1602 13.2995 13.2995 13.4106 13.4106 17.1669 17.1669 22.5134 22.5134 k = 0.3807 0.3807-0.0000 ( 828 PWs) bands (ev): 8.4932 8.4932 8.9184 8.9184 9.3736 9.3736 9.4099 9.4099 11.7589 11.7589 12.4278 12.4278 12.9014 12.9014 12.9707 12.9707 13.1185 13.1185 13.2937 13.2937 13.3323 13.3323 17.2993 17.2993 22.5287 22.5287 k = 0.3750 0.3750-0.0000 ( 828 PWs) bands (ev): 8.4770 8.4770 8.9492 8.9492 9.3960 9.3960 9.4347 9.4347 11.6904 11.6904 12.3807 12.3807 12.8671 12.8671 12.9161 12.9161 13.0754 13.0754 13.2495 13.2495 13.3074 13.3074 17.4336 17.4336 22.5448 22.5448 k = 0.3693 0.3693-0.0000 ( 828 PWs) bands (ev): 8.4574 8.4574 8.9808 8.9808 9.4192 9.4192 9.4608 9.4608 11.6217 11.6217 12.3258 12.3258 12.8306 12.8306 12.8619 12.8619 13.0311 13.0311 13.1958 13.1958 13.3056 13.3056 17.5696 17.5696 22.5617 22.5617 k = 0.3636 0.3636-0.0000 ( 832 PWs) bands (ev): 8.4339 8.4339 9.0128 9.0128 9.4432 9.4432 9.4881 9.4881 11.5529 11.5529 12.2630 12.2630 12.7900 12.7900 12.8131 12.8131 12.9859 12.9859 13.1504 13.1504 13.3055 13.3055 17.7073 17.7073 22.5793 22.5793 k = 0.3580 0.3580-0.0000 ( 832 PWs) bands (ev): 8.4068 8.4068 9.0451 9.0451 9.4679 9.4679 9.5166 9.5166 11.4843 11.4843 12.1935 12.1935 12.7459 12.7459 12.7719 12.7719 12.9408 12.9408 13.1118 13.1118 13.3059 13.3059 17.8467 17.8467 22.5976 22.5976 k = 0.3523 0.3523-0.0000 ( 832 PWs) bands (ev): 8.3754 8.3754 9.0776 9.0776 9.4934 9.4934 9.5463 9.5463 11.4159 11.4159 12.1193 12.1193 12.7032 12.7032 12.7340 12.7340 12.8959 12.8959 13.0776 13.0776 13.3065 13.3065 17.9876 17.9876 22.6167 22.6167 k = 0.3466 0.3466-0.0000 ( 832 PWs) bands (ev): 8.3394 8.3394 9.1101 9.1101 9.5196 9.5196 9.5772 9.5772 11.3479 11.3479 12.0425 12.0425 12.6642 12.6642 12.6970 12.6970 12.8514 12.8514 13.0465 13.0465 13.3072 13.3072 18.1300 18.1300 22.6366 22.6366 k = 0.3409 0.3409-0.0000 ( 831 PWs) bands (ev): 8.2988 8.2988 9.1424 9.1424 9.5465 9.5465 9.6094 9.6094 11.2803 11.2803 11.9654 11.9654 12.6286 12.6286 12.6604 12.6604 12.8073 12.8073 13.0174 13.0174 13.3079 13.3079 18.2739 18.2739 22.6572 22.6572 k = 0.3352 0.3352-0.0000 ( 825 PWs) bands (ev): 8.2530 8.2530 9.1744 9.1744 9.5741 9.5741 9.6433 9.6433 11.2136 11.2136 11.8898 11.8898 12.5955 12.5955 12.6244 12.6244 12.7637 12.7637 12.9899 12.9899 13.3089 13.3089 18.4193 18.4193 22.6783 22.6783 k = 0.3295 0.3295-0.0000 ( 827 PWs) bands (ev): 8.2022 8.2022 9.2057 9.2057 9.6022 9.6022 9.6778 9.6778 11.1473 11.1473 11.8172 11.8172 12.5634 12.5634 12.5899 12.5899 12.7205 12.7205 12.9637 12.9637 13.3099 13.3099 18.5660 18.5660 22.6999 22.6999 k = 0.3239 0.3239-0.0000 ( 827 PWs) bands (ev): 8.1461 8.1461 9.2362 9.2362 9.6309 9.6309 9.7136 9.7136 11.0818 11.0818 11.7489 11.7489 12.5306 12.5306 12.5581 12.5581 12.6779 12.6779 12.9385 12.9385 13.3108 13.3108 18.7140 18.7140 22.7210 22.7210 k = 0.3182 0.3182-0.0000 ( 823 PWs) bands (ev): 8.0848 8.0848 9.2657 9.2657 9.6602 9.6602 9.7507 9.7507 11.0172 11.0172 11.6855 11.6855 12.4958 12.4958 12.5299 12.5299 12.6362 12.6362 12.9142 12.9142 13.3119 13.3119 18.8634 18.8634 22.7331 22.7331 k = 0.3125 0.3125-0.0000 ( 827 PWs) bands (ev): 8.0184 8.0184 9.2940 9.2940 9.6898 9.6898 9.7889 9.7889 10.9532 10.9532 11.6276 11.6276 12.4592 12.4592 12.5041 12.5041 12.5954 12.5954 12.8907 12.8907 13.3130 13.3130 19.0140 19.0140 22.6154 22.6154 k = 0.3068 0.3068-0.0000 ( 831 PWs) bands (ev): 7.9470 7.9470 9.3206 9.3206 9.7201 9.7201 9.8283 9.8283 10.8902 10.8902 11.5754 11.5754 12.4219 12.4219 12.4793 12.4793 12.5568 12.5568 12.8679 12.8679 13.3140 13.3140 19.1659 19.1659 22.4475 22.4475 k = 0.3011 0.3011-0.0000 ( 831 PWs) bands (ev): 7.8709 7.8709 9.3457 9.3457 9.7508 9.7508 9.8688 9.8688 10.8281 10.8281 11.5291 11.5291 12.3843 12.3843 12.4537 12.4537 12.5217 12.5217 12.8459 12.8459 13.3152 13.3152 19.3190 19.3190 22.2779 22.2779 k = 0.2955 0.2955-0.0000 ( 823 PWs) bands (ev): 7.7903 7.7903 9.3689 9.3689 9.7824 9.7824 9.9105 9.9105 10.7671 10.7671 11.4888 11.4888 12.3471 12.3471 12.4253 12.4253 12.4924 12.4924 12.8247 12.8247 13.3165 13.3165 19.4733 19.4733 22.1084 22.1084 k = 0.2898 0.2898-0.0000 ( 823 PWs) bands (ev): 7.7056 7.7056 9.3899 9.3899 9.8139 9.8139 9.9533 9.9533 10.7070 10.7070 11.4544 11.4544 12.3095 12.3095 12.3925 12.3925 12.4696 12.4696 12.8041 12.8041 13.3178 13.3178 19.6287 19.6287 21.9393 21.9393 k = 0.2841 0.2841-0.0000 ( 823 PWs) bands (ev): 7.6172 7.6172 9.4087 9.4087 9.8457 9.8457 9.9972 9.9972 10.6480 10.6480 11.4255 11.4255 12.2720 12.2720 12.3563 12.3563 12.4527 12.4527 12.7841 12.7841 13.3191 13.3191 19.7852 19.7852 21.7707 21.7707 k = 0.2784 0.2784-0.0000 ( 823 PWs) bands (ev): 7.5255 7.5255 9.4248 9.4248 9.8779 9.8779 10.0422 10.0422 10.5902 10.5902 11.4021 11.4021 12.2347 12.2347 12.3184 12.3184 12.4401 12.4401 12.7648 12.7648 13.3205 13.3205 19.9427 19.9427 21.6029 21.6029 k = 0.2727 0.2727-0.0000 ( 823 PWs) bands (ev): 7.4310 7.4310 9.4383 9.4383 9.9103 9.9103 10.0881 10.0881 10.5335 10.5335 11.3837 11.3837 12.1978 12.1978 12.2797 12.2797 12.4311 12.4311 12.7461 12.7461 13.3219 13.3219 20.1013 20.1013 21.4359 21.4359 k = 0.2670 0.2670-0.0000 ( 823 PWs) bands (ev): 7.3339 7.3339 9.4489 9.4489 9.9429 9.9429 10.1349 10.1349 10.4781 10.4781 11.3701 11.3701 12.1613 12.1613 12.2408 12.2408 12.4251 12.4251 12.7281 12.7281 13.3234 13.3234 20.2606 20.2606 21.2699 21.2699 k = 0.2614 0.2614-0.0000 ( 823 PWs) bands (ev): 7.2349 7.2349 9.4565 9.4565 9.9757 9.9757 10.1822 10.1822 10.4243 10.4243 11.3610 11.3610 12.1253 12.1253 12.2021 12.2021 12.4218 12.4218 12.7109 12.7109 13.3249 13.3249 20.4203 20.4203 21.1053 21.1053 k = 0.2557 0.2557-0.0000 ( 827 PWs) bands (ev): 7.1342 7.1342 9.4610 9.4610 10.0086 10.0086 10.2290 10.2290 10.3728 10.3728 11.3560 11.3560 12.0898 12.0898 12.1637 12.1637 12.4211 12.4211 12.6944 12.6944 13.3262 13.3262 20.5787 20.5787 20.9438 20.9438 k = 0.2500 0.2500-0.0000 ( 827 PWs) bands (ev): 7.0323 7.0323 9.4623 9.4623 10.0415 10.0415 10.2680 10.2680 10.3316 10.3316 11.3547 11.3547 12.0550 12.0550 12.1258 12.1258 12.4227 12.4227 12.6788 12.6788 13.3278 13.3278 20.7069 20.7069 20.8145 20.8145 k = 0.2443 0.2443-0.0000 ( 827 PWs) bands (ev): 6.9295 6.9295 9.4606 9.4606 10.0742 10.0742 10.2540 10.2540 10.3456 10.3456 11.3569 11.3569 12.0208 12.0208 12.0886 12.0886 12.4265 12.4265 12.6643 12.6643 13.3295 13.3295 20.5996 20.5996 20.9225 20.9225 k = 0.2386 0.2386-0.0000 ( 823 PWs) bands (ev): 6.8262 6.8262 9.4557 9.4557 10.1064 10.1064 10.2101 10.2101 10.3924 10.3924 11.3622 11.3622 11.9874 11.9874 12.0522 12.0522 12.4321 12.4321 12.6510 12.6510 13.3314 13.3314 20.4415 20.4415 21.0830 21.0830 k = 0.2330 0.2330-0.0000 ( 823 PWs) bands (ev): 6.7227 6.7227 9.4477 9.4477 10.1330 10.1330 10.1691 10.1691 10.4433 10.4433 11.3703 11.3703 11.9547 11.9547 12.0167 12.0167 12.4391 12.4391 12.6393 12.6393 13.3332 13.3332 20.2814 20.2814 21.2475 21.2475 k = 0.2273 0.2273-0.0000 ( 823 PWs) bands (ev): 6.6194 6.6194 9.4368 9.4368 10.1092 10.1092 10.1789 10.1789 10.4956 10.4956 11.3809 11.3809 11.9227 11.9227 11.9824 11.9824 12.4468 12.4468 12.6298 12.6298 13.3350 13.3350 20.1215 20.1215 21.4136 21.4136 k = 0.2216 0.2216-0.0000 ( 823 PWs) bands (ev): 6.5164 6.5164 9.4230 9.4230 10.0648 10.0648 10.2099 10.2099 10.5486 10.5486 11.3937 11.3937 11.8916 11.8916 11.9495 11.9495 12.4543 12.4543 12.6231 12.6231 13.3368 13.3368 19.9623 19.9623 21.5809 21.5809 k = 0.2159 0.2159-0.0000 ( 823 PWs) bands (ev): 6.4141 6.4141 9.4066 9.4066 10.0200 10.0200 10.2422 10.2422 10.6020 10.6020 11.4083 11.4083 11.8612 11.8612 11.9182 11.9182 12.4605 12.4605 12.6204 12.6204 13.3386 13.3386 19.8040 19.8040 21.7491 21.7491 k = 0.2102 0.2102-0.0000 ( 823 PWs) bands (ev): 6.3127 6.3127 9.3876 9.3876 9.9760 9.9760 10.2747 10.2747 10.6554 10.6554 11.4244 11.4244 11.8316 11.8316 11.8891 11.8891 12.4644 12.4644 12.6224 12.6224 13.3405 13.3405 19.6466 19.6466 21.9182 21.9182 k = 0.2045 0.2045-0.0000 ( 815 PWs) bands (ev): 6.2125 6.2125 9.3663 9.3663 9.9331 9.9331 10.3070 10.3070 10.7086 10.7086 11.4424 11.4424 11.8030 11.8030 11.8627 11.8627 12.4652 12.4652 12.6299 12.6299 13.3424 13.3424 19.4902 19.4902 22.0881 22.0881 k = 0.1989 0.1989-0.0000 ( 815 PWs) bands (ev): 6.1134 6.1134 9.3429 9.3429 9.8913 9.8913 10.3391 10.3391 10.7612 10.7612 11.4606 11.4606 11.7747 11.7747 11.8390 11.8390 12.4626 12.4626 12.6427 12.6427 13.3444 13.3444 19.3349 19.3349 22.2586 22.2586 k = 0.1932 0.1932-0.0000 ( 815 PWs) bands (ev): 6.0159 6.0159 9.3177 9.3177 9.8506 9.8506 10.3709 10.3709 10.8127 10.8127 11.4792 11.4792 11.7475 11.7475 11.8189 11.8189 12.4575 12.4575 12.6599 12.6599 13.3464 13.3464 19.1808 19.1808 22.4295 22.4295 k = 0.1875 0.1875-0.0000 ( 815 PWs) bands (ev): 5.9200 5.9200 9.2908 9.2908 9.8111 9.8111 10.4023 10.4023 10.8625 10.8625 11.4976 11.4976 11.7217 11.7217 11.8028 11.8028 12.4504 12.4504 12.6808 12.6808 13.3484 13.3484 19.0277 19.0277 22.5997 22.5997 k = 0.1818 0.1818-0.0000 ( 811 PWs) bands (ev): 5.8259 5.8259 9.2626 9.2626 9.7727 9.7727 10.4334 10.4334 10.9100 10.9100 11.5148 11.5148 11.6983 11.6983 11.7913 11.7913 12.4420 12.4420 12.7046 12.7046 13.3506 13.3506 18.8758 18.8758 22.7492 22.7492 k = 0.1761 0.1761-0.0000 ( 815 PWs) bands (ev): 5.7337 5.7337 9.2330 9.2330 9.7354 9.7354 10.4640 10.4640 10.9542 10.9542 11.5287 11.5287 11.6791 11.6791 11.7851 11.7851 12.4328 12.4328 12.7301 12.7301 13.3527 13.3527 18.7251 18.7251 22.7543 22.7543 k = 0.1705 0.1705-0.0000 ( 815 PWs) bands (ev): 5.6435 5.6435 9.2024 9.2024 9.6995 9.6995 10.4941 10.4941 10.9946 10.9946 11.5366 11.5366 11.6673 11.6673 11.7848 11.7848 12.4232 12.4232 12.7574 12.7574 13.3548 13.3548 18.5757 18.5757 22.7351 22.7351 k = 0.1648 0.1648-0.0000 ( 805 PWs) bands (ev): 5.5555 5.5555 9.1711 9.1711 9.6649 9.6649 10.5239 10.5239 11.0303 11.0303 11.5354 11.5354 11.6662 11.6662 11.7915 11.7915 12.4137 12.4137 12.7860 12.7860 13.3569 13.3569 18.4276 18.4276 22.7150 22.7150 k = 0.1591 0.1591-0.0000 ( 811 PWs) bands (ev): 5.4698 5.4698 9.1390 9.1390 9.6308 9.6308 10.5529 10.5529 11.0602 11.0602 11.5246 11.5246 11.6751 11.6751 11.8052 11.8052 12.4038 12.4038 12.8152 12.8152 13.3590 13.3590 18.2807 18.2807 22.6952 22.6952 k = 0.1534 0.1534-0.0000 ( 811 PWs) bands (ev): 5.3864 5.3864 9.1066 9.1066 9.5984 9.5984 10.5812 10.5812 11.0843 11.0843 11.5079 11.5079 11.6907 11.6907 11.8270 11.8270 12.3941 12.3941 12.8449 12.8449 13.3612 13.3612 18.1353 18.1353 22.6759 22.6759 k = 0.1477 0.1477-0.0000 ( 811 PWs) bands (ev): 5.3055 5.3055 9.0740 9.0740 9.5672 9.5672 10.6089 10.6089 11.1024 11.1024 11.4881 11.4881 11.7098 11.7098 11.8570 11.8570 12.3845 12.3845 12.8749 12.8749 13.3634 13.3634 17.9913 17.9913 22.6574 22.6574 k = 0.1420 0.1420-0.0000 ( 811 PWs) bands (ev): 5.2271 5.2271 9.0414 9.0414 9.5372 9.5372 10.6358 10.6358 11.1149 11.1149 11.4671 11.4671 11.7303 11.7303 11.8950 11.8950 12.3752 12.3752 12.9050 12.9050 13.3656 13.3656 17.8488 17.8488 22.6396 22.6396 k = 0.1364 0.1364-0.0000 ( 811 PWs) bands (ev): 5.1513 5.1513 9.0089 9.0089 9.5084 9.5084 10.6620 10.6620 11.1222 11.1222 11.4457 11.4457 11.7512 11.7512 11.9403 11.9403 12.3662 12.3662 12.9349 12.9349 13.3678 13.3678 17.7078 17.7078 22.6226 22.6226 k = 0.1307 0.1307-0.0000 ( 811 PWs) bands (ev): 5.0782 5.0782 8.9767 8.9767 9.4808 9.4808 10.6873 10.6873 11.1253 11.1253 11.4245 11.4245 11.7721 11.7721 11.9921 11.9921 12.3576 12.3576 12.9646 12.9646 13.3701 13.3701 17.5684 17.5684 22.6064 22.6064 k = 0.1250 0.1250-0.0000 ( 811 PWs) bands (ev): 5.0078 5.0078 8.9448 8.9448 9.4544 9.4544 10.7118 10.7118 11.1249 11.1249 11.4037 11.4037 11.7926 11.7926 12.0493 12.0493 12.3494 12.3494 12.9938 12.9938 13.3723 13.3723 17.4306 17.4306 22.5910 22.5910 k = 0.1193 0.1193-0.0000 ( 811 PWs) bands (ev): 4.9403 4.9403 8.9136 8.9136 9.4291 9.4291 10.7355 10.7355 11.1219 11.1219 11.3836 11.3836 11.8126 11.8126 12.1109 12.1109 12.3417 12.3417 13.0225 13.0225 13.3746 13.3746 17.2946 17.2946 22.5765 22.5765 k = 0.1136 0.1136-0.0000 ( 821 PWs) bands (ev): 4.8755 4.8755 8.8830 8.8830 9.4051 9.4051 10.7581 10.7581 11.1164 11.1164 11.3635 11.3635 11.8319 11.8319 12.1760 12.1760 12.3345 12.3345 13.0501 13.0501 13.3769 13.3769 17.1605 17.1605 22.5628 22.5628 k = 0.1080 0.1080-0.0000 ( 813 PWs) bands (ev): 4.8136 4.8136 8.8532 8.8532 9.3823 9.3823 10.7799 10.7799 11.1103 11.1103 11.3454 11.3454 11.8509 11.8509 12.2433 12.2433 12.3290 12.3290 13.0773 13.0773 13.3792 13.3792 17.0283 17.0283 22.5499 22.5499 k = 0.1023 0.1023-0.0000 ( 813 PWs) bands (ev): 4.7547 4.7547 8.8244 8.8244 9.3606 9.3606 10.8006 10.8006 11.1029 11.1029 11.3276 11.3276 11.8690 11.8690 12.3023 12.3023 12.3345 12.3345 13.1034 13.1034 13.3816 13.3816 16.8982 16.8982 22.5378 22.5378 k = 0.0966 0.0966-0.0000 ( 813 PWs) bands (ev): 4.6988 4.6988 8.7966 8.7966 9.3401 9.3401 10.8202 10.8202 11.0948 11.0948 11.3107 11.3107 11.8861 11.8861 12.3100 12.3100 12.3938 12.3938 13.1285 13.1285 13.3839 13.3839 16.7703 16.7703 22.5265 22.5265 k = 0.0909 0.0909-0.0000 ( 813 PWs) bands (ev): 4.6458 4.6458 8.7699 8.7699 9.3209 9.3209 10.8387 10.8387 11.0863 11.0863 11.2947 11.2947 11.9024 11.9024 12.3060 12.3060 12.4668 12.4668 13.1524 13.1524 13.3863 13.3863 16.6447 16.6447 22.5160 22.5160 k = 0.0852 0.0852-0.0000 ( 815 PWs) bands (ev): 4.5959 4.5959 8.7444 8.7444 9.3028 9.3028 10.8561 10.8561 11.0779 11.0779 11.2795 11.2795 11.9178 11.9178 12.3014 12.3014 12.5419 12.5419 13.1751 13.1751 13.3888 13.3888 16.5218 16.5218 22.5062 22.5062 k = 0.0795 0.0795-0.0000 ( 821 PWs) bands (ev): 4.5491 4.5491 8.7202 8.7202 9.2858 9.2858 10.8722 10.8722 11.0693 11.0693 11.2654 11.2654 11.9316 11.9316 12.2969 12.2969 12.6178 12.6178 13.1964 13.1964 13.3914 13.3914 16.4017 16.4017 22.4971 22.4971 k = 0.0739 0.0739-0.0000 ( 821 PWs) bands (ev): 4.5054 4.5054 8.6974 8.6974 9.2701 9.2701 10.8871 10.8871 11.0612 11.0612 11.2523 11.2523 11.9449 11.9449 12.2930 12.2930 12.6941 12.6941 13.2164 13.2164 13.3940 13.3940 16.2847 16.2847 22.4888 22.4888 k = 0.0682 0.0682-0.0000 ( 821 PWs) bands (ev): 4.4649 4.4649 8.6760 8.6760 9.2555 9.2555 10.9007 10.9007 11.0537 11.0537 11.2403 11.2403 11.9571 11.9571 12.2896 12.2896 12.7702 12.7702 13.2350 13.2350 13.3968 13.3968 16.1711 16.1711 22.4812 22.4812 k = 0.0625 0.0625-0.0000 ( 821 PWs) bands (ev): 4.4275 4.4275 8.6561 8.6561 9.2421 9.2421 10.9130 10.9130 11.0467 11.0467 11.2293 11.2293 11.9682 11.9682 12.2866 12.2866 12.8454 12.8454 13.2520 13.2520 13.3997 13.3997 16.0614 16.0614 22.4742 22.4742 k = 0.0568 0.0568-0.0000 ( 825 PWs) bands (ev): 4.3933 4.3933 8.6377 8.6377 9.2299 9.2299 10.9238 10.9238 11.0403 11.0403 11.2191 11.2191 11.9781 11.9781 12.2840 12.2840 12.9193 12.9193 13.2675 13.2675 13.4029 13.4029 15.9560 15.9560 22.4679 22.4679 k = 0.0511 0.0511-0.0000 ( 821 PWs) bands (ev): 4.3623 4.3623 8.6211 8.6211 9.2189 9.2189 10.9331 10.9331 11.0349 11.0349 11.2102 11.2102 11.9871 11.9871 12.2820 12.2820 12.9912 12.9912 13.2814 13.2814 13.4066 13.4066 15.8557 15.8557 22.4623 22.4623 k = 0.0455 0.0455-0.0000 ( 823 PWs) bands (ev): 4.3345 4.3345 8.6057 8.6057 9.2090 9.2090 10.9410 10.9410 11.0304 11.0304 11.2023 11.2023 11.9949 11.9949 12.2803 12.2803 13.0597 13.0597 13.2936 13.2936 13.4104 13.4104 15.7609 15.7609 22.4573 22.4573 k = 0.0398 0.0398-0.0000 ( 823 PWs) bands (ev): 4.3099 4.3099 8.5923 8.5923 9.2003 9.2003 10.9473 10.9473 11.0269 11.0269 11.1955 11.1955 12.0018 12.0018 12.2789 12.2789 13.1242 13.1242 13.3043 13.3043 13.4148 13.4148 15.6728 15.6728 22.4529 22.4529 k = 0.0341 0.0341-0.0000 ( 823 PWs) bands (ev): 4.2886 4.2886 8.5806 8.5806 9.1928 9.1928 10.9521 10.9521 11.0244 11.0244 11.1896 11.1896 12.0076 12.0076 12.2779 12.2779 13.1831 13.1831 13.3134 13.3134 13.4199 13.4199 15.5923 15.5923 22.4492 22.4492 k = 0.0284 0.0284-0.0000 ( 819 PWs) bands (ev): 4.2706 4.2706 8.5708 8.5708 9.1869 9.1869 10.9555 10.9555 11.0228 11.0228 11.1847 11.1847 12.0125 12.0125 12.2771 12.2771 13.2348 13.2348 13.3211 13.3211 13.4261 13.4261 15.5206 15.5206 22.4460 22.4460 k = 0.0227 0.0227-0.0000 ( 823 PWs) bands (ev): 4.2558 4.2558 8.5624 8.5624 9.1812 9.1812 10.9579 10.9579 11.0218 11.0218 11.1808 11.1808 12.0164 12.0164 12.2766 12.2766 13.2771 13.2771 13.3277 13.3277 13.4336 13.4336 15.4591 15.4591 22.4434 22.4434 k = 0.0170 0.0170-0.0000 ( 819 PWs) bands (ev): 4.2443 4.2443 8.5561 8.5561 9.1772 9.1772 10.9593 10.9593 11.0215 11.0215 11.1778 11.1778 12.0195 12.0195 12.2762 12.2762 13.3080 13.3080 13.3345 13.3345 13.4425 13.4425 15.4092 15.4092 22.4414 22.4414 k = 0.0114 0.0114-0.0000 ( 823 PWs) bands (ev): 4.2360 4.2360 8.5514 8.5514 9.1737 9.1737 10.9601 10.9601 11.0213 11.0213 11.1756 11.1756 12.0216 12.0216 12.2760 12.2760 13.3244 13.3244 13.3430 13.3430 13.4516 13.4516 15.3722 15.3722 22.4400 22.4400 k = 0.0057 0.0057-0.0000 ( 823 PWs) bands (ev): 4.2311 4.2311 8.5487 8.5487 9.1720 9.1720 10.9605 10.9605 11.0213 11.0213 11.1744 11.1744 12.0229 12.0229 12.2758 12.2758 13.3301 13.3301 13.3513 13.3513 13.4588 13.4588 15.3495 15.3495 22.4391 22.4391 k = 0.0000 0.0000 0.0000 ( 823 PWs) bands (ev): 4.2295 4.2295 8.5477 8.5477 9.1714 9.1714 10.9607 10.9607 11.0214 11.0214 11.1739 11.1739 12.0233 12.0233 12.2758 12.2758 13.3314 13.3314 13.3544 13.3544 13.4615 13.4615 15.3419 15.3419 22.4388 22.4388 k = 0.0000 0.0000 0.0000 ( 823 PWs) bands (ev): 4.2295 4.2295 8.5477 8.5477 9.1714 9.1714 10.9607 10.9607 11.0214 11.0214 11.1739 11.1739 12.0233 12.0233 12.2758 12.2758 13.3314 13.3314 13.3544 13.3544 13.4615 13.4615 15.3419 15.3419 22.4388 22.4388 k = 0.0000 0.0000 0.0080 ( 823 PWs) bands (ev): 4.2311 4.2311 8.5479 8.5479 9.1720 9.1720 10.9611 10.9611 11.0216 11.0216 11.1735 11.1735 12.0234 12.0234 12.2751 12.2751 13.3311 13.3311 13.3535 13.3535 13.4607 13.4607 15.3335 15.3335 22.4500 22.4500 k = 0.0000 0.0000 0.0161 ( 823 PWs) bands (ev): 4.2360 4.2360 8.5483 8.5483 9.1736 9.1736 10.9624 10.9624 11.0224 11.0224 11.1720 11.1720 12.0238 12.0238 12.2729 12.2729 13.3302 13.3302 13.3508 13.3508 13.4584 13.4584 15.3087 15.3087 22.4834 22.4834 k = 0.0000 0.0000 0.0241 ( 819 PWs) bands (ev): 4.2443 4.2443 8.5495 8.5495 9.1763 9.1763 10.9646 10.9646 11.0238 11.0238 11.1696 11.1696 12.0244 12.0244 12.2694 12.2694 13.3288 13.3288 13.3463 13.3463 13.4547 13.4547 15.2679 15.2679 22.5385 22.5385 k = 0.0000 0.0000 0.0321 ( 819 PWs) bands (ev): 4.2558 4.2558 8.5503 8.5503 9.1802 9.1802 10.9676 10.9676 11.0255 11.0255 11.1664 11.1664 12.0253 12.0253 12.2644 12.2644 13.3266 13.3266 13.3400 13.3400 13.4495 13.4495 15.2118 15.2118 22.6145 22.6145 k = 0.0000 0.0000 0.0402 ( 823 PWs) bands (ev): 4.2706 4.2706 8.5511 8.5511 9.1850 9.1850 10.9715 10.9715 11.0275 11.0275 11.1625 11.1625 12.0264 12.0264 12.2580 12.2580 13.3237 13.3237 13.3317 13.3317 13.4427 13.4427 15.1417 15.1417 22.7104 22.7104 k = 0.0000 0.0000 0.0482 ( 823 PWs) bands (ev): 4.2886 4.2886 8.5523 8.5523 9.1910 9.1910 10.9762 10.9762 11.0296 11.0296 11.1581 11.1581 12.0278 12.0278 12.2502 12.2502 13.3200 13.3200 13.3218 13.3218 13.4350 13.4350 15.0588 15.0588 22.8249 22.8249 k = 0.0000 0.0000 0.0563 ( 823 PWs) bands (ev): 4.3099 4.3099 8.5535 8.5535 9.1980 9.1980 10.9818 10.9818 11.0316 11.0316 11.1534 11.1534 12.0294 12.0294 12.2409 12.2409 13.3103 13.3103 13.3154 13.3154 13.4262 13.4262 14.9643 14.9643 22.9568 22.9568 k = 0.0000 0.0000 0.0643 ( 823 PWs) bands (ev): 4.3345 4.3345 8.5546 8.5546 9.2061 9.2061 10.9883 10.9883 11.0329 11.0329 11.1489 11.1489 12.0313 12.0313 12.2302 12.2302 13.2971 13.2971 13.3097 13.3097 13.4165 13.4165 14.8598 14.8598 23.1048 23.1048 k = 0.0000 0.0000 0.0723 ( 823 PWs) bands (ev): 4.3623 4.3623 8.5557 8.5557 9.2153 9.2153 10.9955 10.9955 11.0332 11.0332 11.1451 11.1451 12.0334 12.0334 12.2180 12.2180 13.2823 13.2823 13.3027 13.3027 13.4063 13.4063 14.7466 14.7466 23.2674 23.2674 k = 0.0000 0.0000 0.0804 ( 823 PWs) bands (ev): 4.3933 4.3933 8.5566 8.5566 9.2255 9.2255 11.0036 11.0036 11.0318 11.0318 11.1426 11.1426 12.0357 12.0357 12.2044 12.2044 13.2659 13.2659 13.2942 13.2942 13.3958 13.3958 14.6262 14.6262 23.4434 23.4434 k = 0.0000 0.0000 0.0884 ( 819 PWs) bands (ev): 4.4275 4.4275 8.5571 8.5571 9.2367 9.2367 11.0127 11.0127 11.0282 11.0282 11.1423 11.1423 12.0382 12.0382 12.1895 12.1895 13.2479 13.2479 13.2838 13.2838 13.3855 13.3855 14.4999 14.4999 23.6317 23.6317 k = 0.0000 0.0000 0.0964 ( 819 PWs) bands (ev): 4.4649 4.4649 8.5572 8.5572 9.2490 9.2490 11.0217 11.0217 11.0224 11.0224 11.1441 11.1441 12.0409 12.0409 12.1729 12.1729 13.2285 13.2285 13.2713 13.2713 13.3755 13.3755 14.3689 14.3689 23.8309 23.8309 k = 0.0000 0.0000 0.1045 ( 819 PWs) bands (ev): 4.5054 4.5054 8.5566 8.5566 9.2622 9.2622 11.0125 11.0125 11.0328 11.0328 11.1484 11.1484 12.0438 12.0438 12.1547 12.1547 13.2077 13.2077 13.2566 13.2566 13.3662 13.3662 14.2346 14.2346 24.0402 24.0402 k = 0.0000 0.0000 0.1125 ( 831 PWs) bands (ev): 4.5491 4.5491 8.5549 8.5549 9.2758 9.2758 11.0007 11.0007 11.0439 11.0439 11.1549 11.1549 12.0467 12.0467 12.1350 12.1350 13.1852 13.1852 13.2395 13.2395 13.3570 13.3570 14.0980 14.0980 24.2586 24.2586 k = 0.0000 0.0000 0.1205 ( 823 PWs) bands (ev): 4.5959 4.5959 8.5526 8.5526 9.2910 9.2910 10.9866 10.9866 11.0561 11.0561 11.1636 11.1636 12.0501 12.0501 12.1143 12.1143 13.1617 13.1617 13.2205 13.2205 13.3490 13.3490 13.9603 13.9603 24.4851 24.4851 k = 0.0000 0.0000 0.1286 ( 815 PWs) bands (ev): 4.6458 4.6458 8.5494 8.5494 9.3082 9.3082 10.9706 10.9706 11.0687 11.0687 11.1738 11.1738 12.0536 12.0536 12.0912 12.0912 13.1369 13.1369 13.1997 13.1997 13.3418 13.3418 13.8227 13.8227 24.7190 24.7190 k = 0.0000 0.0000 0.1366 ( 815 PWs) bands (ev): 4.6987 4.6987 8.5444 8.5444 9.3253 9.3253 10.9529 10.9529 11.0819 11.0819 11.1853 11.1853 12.0571 12.0571 12.0664 12.0664 13.1106 13.1106 13.1771 13.1771 13.3349 13.3349 13.6860 13.6860 24.9596 24.9596 k = 0.0000 0.0000 0.1446 ( 815 PWs) bands (ev): 4.7546 4.7546 8.5378 8.5378 9.3433 9.3433 10.9337 10.9337 11.0958 11.0958 11.1980 11.1980 12.0397 12.0397 12.0608 12.0608 13.0830 13.0830 13.1530 13.1530 13.3284 13.3284 13.5516 13.5516 25.2062 25.2062 k = 0.0000 0.0000 0.1527 ( 815 PWs) bands (ev): 4.8135 4.8135 8.5293 8.5293 9.3621 9.3621 10.9132 10.9132 11.1102 11.1102 11.2118 11.2118 12.0111 12.0111 12.0646 12.0646 13.0537 13.0537 13.1276 13.1276 13.3223 13.3223 13.4207 13.4207 25.4582 25.4582 k = 0.0000 0.0000 0.1607 ( 823 PWs) bands (ev): 4.8753 4.8753 8.5186 8.5186 9.3818 9.3818 10.8913 10.8913 11.1247 11.1247 11.2260 11.2260 11.9801 11.9801 12.0684 12.0684 13.0220 13.0220 13.1011 13.1011 13.2949 13.2949 13.3163 13.3163 25.7151 25.7151 k = 0.0000 0.0000 0.1688 ( 815 PWs) bands (ev): 4.9399 4.9399 8.5053 8.5053 9.4024 9.4024 10.8686 10.8686 11.1406 11.1406 11.2420 11.2420 11.9473 11.9473 12.0725 12.0725 12.9860 12.9860 13.0736 13.0736 13.1772 13.1772 13.3106 13.3106 25.9765 25.9765 k = 0.0000 0.0000 0.1768 ( 815 PWs) bands (ev): 5.0075 5.0075 8.4892 8.4892 9.4237 9.4237 10.8448 10.8448 11.1564 11.1564 11.2583 11.2583 11.9121 11.9121 12.0766 12.0766 12.9400 12.9400 13.0454 13.0454 13.0743 13.0743 13.3051 13.3051 26.2417 26.2417 k = 0.0000 0.0000 0.1848 ( 815 PWs) bands (ev): 5.0777 5.0777 8.4699 8.4699 9.4458 9.4458 10.8201 10.8201 11.1725 11.1725 11.2752 11.2752 11.8745 11.8745 12.0806 12.0806 12.8729 12.8729 12.9982 12.9982 13.0165 13.0165 13.2996 13.2996 26.5105 26.5105 k = 0.0000 0.0000 0.1929 ( 819 PWs) bands (ev): 5.1507 5.1507 8.4469 8.4469 9.4686 9.4686 10.7947 10.7947 11.1887 11.1887 11.2926 11.2926 11.8346 11.8346 12.0847 12.0847 12.7863 12.7863 12.9477 12.9477 12.9870 12.9870 13.2943 13.2943 26.7823 26.7823 k = 0.0000 0.0000 0.2009 ( 819 PWs) bands (ev): 5.2263 5.2263 8.4202 8.4202 9.4920 9.4920 10.7685 10.7685 11.2050 11.2050 11.3106 11.3106 11.7925 11.7925 12.0888 12.0888 12.6955 12.6955 12.9090 12.9090 12.9572 12.9572 13.2891 13.2891 27.0568 27.0568 k = 0.0000 0.0000 0.2089 ( 819 PWs) bands (ev): 5.3045 5.3045 8.3894 8.3894 9.5161 9.5161 10.7416 10.7416 11.2211 11.2211 11.3289 11.3289 11.7486 11.7486 12.0928 12.0928 12.6081 12.6081 12.8746 12.8746 12.9272 12.9272 13.2841 13.2841 27.3335 27.3335 k = 0.0000 0.0000 0.2170 ( 818 PWs) bands (ev): 5.3852 5.3852 8.3543 8.3543 9.5408 9.5408 10.7142 10.7142 11.2367 11.2367 11.3476 11.3476 11.7034 11.7034 12.0969 12.0969 12.5270 12.5270 12.8420 12.8420 12.8972 12.8972 13.2792 13.2792 27.6122 27.6122 k = 0.0000 0.0000 0.2250 ( 818 PWs) bands (ev): 5.4683 5.4683 8.3144 8.3144 9.5660 9.5660 10.6863 10.6863 11.2513 11.2513 11.3666 11.3666 11.6577 11.6577 12.1008 12.1008 12.4529 12.4529 12.8106 12.8106 12.8672 12.8672 13.2744 13.2744 27.8924 27.8924 k = 0.0000 0.0000 0.2330 ( 818 PWs) bands (ev): 5.5537 5.5537 8.2695 8.2695 9.5917 9.5917 10.6580 10.6580 11.2645 11.2645 11.3856 11.3856 11.6130 11.6130 12.1047 12.1047 12.3860 12.3860 12.7800 12.7800 12.8375 12.8375 13.2698 13.2698 28.1737 28.1737 k = 0.0000 0.0000 0.2411 ( 826 PWs) bands (ev): 5.6413 5.6413 8.2196 8.2196 9.6177 9.6177 10.6291 10.6291 11.2749 11.2749 11.4043 11.4043 11.5707 11.5707 12.1083 12.1083 12.3260 12.3260 12.7502 12.7502 12.8081 12.8081 13.2653 13.2653 28.4557 28.4557 k = 0.0000 0.0000 0.2491 ( 826 PWs) bands (ev): 5.7309 5.7309 8.1645 8.1645 9.6440 9.6440 10.6003 10.6003 11.2816 11.2816 11.4233 11.4233 11.5334 11.5334 12.1119 12.1119 12.2724 12.2724 12.7213 12.7213 12.7793 12.7793 13.2611 13.2611 28.7379 28.7379 k = 0.0000 0.0000 0.2571 ( 826 PWs) bands (ev): 5.8225 5.8225 8.1044 8.1044 9.6705 9.6705 10.5714 10.5714 11.2824 11.2824 11.4420 11.4420 11.5035 11.5035 12.1155 12.1155 12.2248 12.2248 12.6934 12.6934 12.7513 12.7513 13.2571 13.2571 29.0198 29.0198 k = 0.0000 0.0000 0.2652 ( 830 PWs) bands (ev): 5.9158 5.9158 8.0392 8.0392 9.6969 9.6969 10.5426 10.5426 11.2755 11.2755 11.4603 11.4603 11.4835 11.4835 12.1188 12.1188 12.1825 12.1825 12.6663 12.6663 12.7240 12.7240 13.2534 13.2534 29.3007 29.3007 k = 0.0000 0.0000 0.2732 ( 830 PWs) bands (ev): 6.0108 6.0108 7.9693 7.9693 9.7233 9.7233 10.5140 10.5140 11.2610 11.2610 11.4737 11.4737 11.4780 11.4780 12.1220 12.1220 12.1450 12.1450 12.6408 12.6408 12.6981 12.6981 13.2499 13.2499 29.5794 29.5795 k = 0.0000 0.0000 0.2813 ( 830 PWs) bands (ev): 6.1071 6.1071 7.8948 7.8948 9.7495 9.7495 10.4859 10.4859 11.2411 11.2411 11.4723 11.4723 11.4951 11.4951 12.1119 12.1119 12.1250 12.1250 12.6167 12.6167 12.6735 12.6735 13.2466 13.2466 29.8542 29.8542 k = 0.0000 0.0000 0.2893 ( 822 PWs) bands (ev): 6.2046 6.2046 7.8161 7.8161 9.7755 9.7755 10.4585 10.4585 11.2188 11.2188 11.4763 11.4763 11.5113 11.5113 12.0829 12.0829 12.1279 12.1279 12.5947 12.5947 12.6509 12.6509 13.2437 13.2437 30.1197 30.1197 k = 0.0000 0.0000 0.2973 ( 830 PWs) bands (ev): 6.3028 6.3028 7.7338 7.7338 9.8004 9.8004 10.4320 10.4320 11.1962 11.1962 11.4829 11.4829 11.5259 11.5259 12.0572 12.0572 12.1304 12.1304 12.5741 12.5741 12.6298 12.6298 13.2411 13.2411 30.3611 30.3611 k = 0.0000 0.0000 0.3054 ( 830 PWs) bands (ev): 6.4015 6.4015 7.6485 7.6485 9.8240 9.8240 10.4070 10.4070 11.1756 11.1756 11.4911 11.4911 11.5395 11.5395 12.0355 12.0355 12.1326 12.1326 12.5557 12.5557 12.6108 12.6108 13.2388 13.2388 30.5596 30.5596 k = 0.0000 0.0000 0.3134 ( 830 PWs) bands (ev): 6.4999 6.4999 7.5609 7.5609 9.8460 9.8460 10.3838 10.3838 11.1575 11.1575 11.4993 11.4993 11.5515 11.5515 12.0172 12.0172 12.1346 12.1346 12.5397 12.5397 12.5941 12.5941 13.2368 13.2368 30.7309 30.7309 k = 0.0000 0.0000 0.3214 ( 830 PWs) bands (ev): 6.5971 6.5971 7.4723 7.4723 9.8656 9.8656 10.3632 10.3632 11.1424 11.1424 11.5069 11.5069 11.5616 11.5616 12.0023 12.0023 12.1363 12.1363 12.5262 12.5262 12.5801 12.5801 13.2352 13.2352 30.8924 30.8924 k = 0.0000 0.0000 0.3295 ( 830 PWs) bands (ev): 6.6913 6.6913 7.3845 7.3845 9.8822 9.8822 10.3458 10.3458 11.1305 11.1305 11.5133 11.5133 11.5698 11.5698 11.9908 11.9908 12.1376 12.1376 12.5155 12.5155 12.5689 12.5689 13.2339 13.2339 31.0477 31.0477 k = 0.0000 0.0000 0.3375 ( 830 PWs) bands (ev): 6.7786 6.7786 7.3018 7.3018 9.8950 9.8950 10.3325 10.3325 11.1220 11.1220 11.5181 11.5181 11.5757 11.5757 11.9825 11.9825 12.1386 12.1386 12.5078 12.5078 12.5607 12.5607 13.2329 13.2329 31.1927 31.1927 k = 0.0000 0.0000 0.3455 ( 830 PWs) bands (ev): 6.8488 6.8488 7.2342 7.2342 9.9030 9.9030 10.3241 10.3241 11.1169 11.1169 11.5211 11.5211 11.5794 11.5794 11.9775 11.9775 12.1391 12.1391 12.5030 12.5030 12.5557 12.5557 13.2324 13.2324 31.3119 31.3119 k = 0.0000 0.0000 0.3536 ( 830 PWs) bands (ev): 6.8787 6.8787 7.2052 7.2052 9.9058 9.9058 10.3213 10.3213 11.1152 11.1152 11.5221 11.5221 11.5806 11.5806 11.9758 11.9758 12.1393 12.1393 12.5015 12.5015 12.5541 12.5541 13.2322 13.2322 31.3639 31.3639 k = 0.0000 0.0000 0.3536 ( 830 PWs) bands (ev): 6.8787 6.8787 7.2052 7.2052 9.9058 9.9058 10.3213 10.3213 11.1152 11.1152 11.5221 11.5221 11.5806 11.5806 11.9758 11.9758 12.1393 12.1393 12.5015 12.5015 12.5541 12.5541 13.2322 13.2322 31.3639 31.3639 k = 0.0000 0.0079 0.3536 ( 830 PWs) bands (ev): 6.8799 6.8799 7.2065 7.2065 9.9060 9.9060 10.3214 10.3214 11.1144 11.1144 11.5207 11.5207 11.5790 11.5790 11.9793 11.9793 12.1371 12.1371 12.5031 12.5031 12.5554 12.5554 13.2320 13.2320 31.3271 31.3271 k = 0.0000 0.0159 0.3536 ( 830 PWs) bands (ev): 6.8837 6.8837 7.2104 7.2104 9.9068 9.9068 10.3217 10.3217 11.1122 11.1122 11.5164 11.5164 11.5748 11.5748 11.9892 11.9892 12.1306 12.1306 12.5079 12.5079 12.5594 12.5594 13.2314 13.2314 31.1960 31.1960 k = 0.0000 0.0238 0.3536 ( 830 PWs) bands (ev): 6.8899 6.8899 7.2170 7.2170 9.9080 9.9080 10.3222 10.3222 11.1086 11.1086 11.5088 11.5088 11.5689 11.5689 12.0050 12.0050 12.1201 12.1201 12.5154 12.5154 12.5661 12.5661 13.2305 13.2305 30.9952 30.9952 k = 0.0000 0.0317 0.3536 ( 830 PWs) bands (ev): 6.8986 6.8986 7.2261 7.2261 9.9098 9.9098 10.3230 10.3230 11.1036 11.1036 11.4978 11.4978 11.5625 11.5625 12.0258 12.0258 12.1062 12.1062 12.5253 12.5253 12.5753 12.5753 13.2291 13.2291 30.7621 30.7621 k = 0.0000 0.0397 0.3536 ( 830 PWs) bands (ev): 6.9097 6.9097 7.2379 7.2379 9.9120 9.9120 10.3240 10.3240 11.0972 11.0972 11.4835 11.4835 11.5562 11.5562 12.0506 12.0506 12.0894 12.0894 12.5369 12.5369 12.5869 12.5869 13.2274 13.2274 30.5122 30.5122 k = 0.0000 0.0476 0.3536 ( 834 PWs) bands (ev): 6.9233 6.9233 7.2521 7.2521 9.9145 9.9145 10.3249 10.3249 11.0896 11.0896 11.4666 11.4666 11.5501 11.5501 12.0695 12.0695 12.0793 12.0793 12.5501 12.5501 12.6006 12.6006 13.2253 13.2253 30.2526 30.2526 k = 0.0000 0.0556 0.3536 ( 838 PWs) bands (ev): 6.9392 6.9392 7.2689 7.2689 9.9177 9.9177 10.3262 10.3262 11.0809 11.0809 11.4479 11.4479 11.5443 11.5443 12.0489 12.0489 12.1094 12.1094 12.5643 12.5643 12.6161 12.6161 13.2229 13.2229 29.9866 29.9867 k = 0.0000 0.0635 0.3536 ( 832 PWs) bands (ev): 6.9575 6.9575 7.2881 7.2881 9.9220 9.9220 10.3283 10.3283 11.0713 11.0713 11.4284 11.4284 11.5384 11.5384 12.0263 12.0263 12.1421 12.1421 12.5799 12.5799 12.6332 12.6332 13.2202 13.2202 29.7165 29.7165 k = 0.0000 0.0714 0.3536 ( 822 PWs) bands (ev): 6.9782 6.9782 7.3097 7.3097 9.9266 9.9266 10.3304 10.3304 11.0608 11.0608 11.4087 11.4087 11.5323 11.5323 12.0027 12.0027 12.1766 12.1766 12.5968 12.5968 12.6516 12.6516 13.2175 13.2175 29.4436 29.4436 k = 0.0000 0.0794 0.3536 ( 822 PWs) bands (ev): 7.0010 7.0010 7.3336 7.3336 9.9316 9.9316 10.3327 10.3327 11.0493 11.0493 11.3887 11.3887 11.5260 11.5260 11.9779 11.9779 12.2122 12.2122 12.6144 12.6144 12.6706 12.6706 13.2141 13.2141 29.1689 29.1689 k = 0.0000 0.0873 0.3536 ( 822 PWs) bands (ev): 7.0261 7.0261 7.3598 7.3598 9.9371 9.9371 10.3352 10.3352 11.0373 11.0373 11.3691 11.3691 11.5192 11.5192 11.9522 11.9522 12.2490 12.2490 12.6330 12.6330 12.6904 12.6904 13.2105 13.2105 28.8930 28.8930 k = 0.0000 0.0952 0.3536 ( 818 PWs) bands (ev): 7.0533 7.0533 7.3881 7.3881 9.9434 9.9434 10.3382 10.3382 11.0247 11.0247 11.3502 11.3502 11.5121 11.5121 11.9260 11.9260 12.2866 12.2866 12.6525 12.6525 12.7107 12.7107 13.2069 13.2069 28.6165 28.6165 k = 0.0000 0.1032 0.3536 ( 818 PWs) bands (ev): 7.0825 7.0825 7.4184 7.4184 9.9502 9.9502 10.3415 10.3415 11.0116 11.0116 11.3320 11.3320 11.5045 11.5045 11.8992 11.8992 12.3249 12.3249 12.6727 12.6727 12.7311 12.7311 13.2029 13.2029 28.3399 28.3399 k = 0.0000 0.1111 0.3536 ( 818 PWs) bands (ev): 7.1138 7.1138 7.4508 7.4508 9.9578 9.9578 10.3453 10.3453 10.9982 10.9982 11.3148 11.3148 11.4965 11.4965 11.8719 11.8719 12.3637 12.3637 12.6938 12.6938 12.7517 12.7517 13.1987 13.1987 28.0636 28.0636 k = 0.0000 0.1190 0.3536 ( 818 PWs) bands (ev): 7.1468 7.1468 7.4849 7.4849 9.9662 9.9662 10.3496 10.3496 10.9846 10.9846 11.2986 11.2986 11.4881 11.4881 11.8444 11.8444 12.4030 12.4030 12.7154 12.7154 12.7723 12.7723 13.1943 13.1943 27.7879 27.7879 k = 0.0000 0.1270 0.3536 ( 818 PWs) bands (ev): 7.1817 7.1817 7.5208 7.5208 9.9753 9.9753 10.3546 10.3546 10.9709 10.9709 11.2837 11.2837 11.4792 11.4792 11.8166 11.8166 12.4426 12.4426 12.7376 12.7376 12.7930 12.7930 13.1897 13.1897 27.5129 27.5129 k = 0.0000 0.1349 0.3536 ( 818 PWs) bands (ev): 7.2183 7.2183 7.5582 7.5582 9.9853 9.9853 10.3603 10.3603 10.9571 10.9571 11.2701 11.2701 11.4699 11.4699 11.7887 11.7887 12.4824 12.4824 12.7602 12.7602 12.8135 12.8135 13.1851 13.1851 27.2391 27.2391 k = 0.0000 0.1429 0.3536 ( 810 PWs) bands (ev): 7.2564 7.2564 7.5970 7.5970 9.9964 9.9964 10.3669 10.3669 10.9438 10.9438 11.2581 11.2581 11.4604 11.4604 11.7610 11.7610 12.5224 12.5224 12.7832 12.7832 12.8340 12.8340 13.1805 13.1805 26.9665 26.9665 k = 0.0000 0.1508 0.3536 ( 812 PWs) bands (ev): 7.2959 7.2959 7.6371 7.6371 10.0082 10.0082 10.3742 10.3742 10.9303 10.9303 11.2472 11.2472 11.4503 11.4503 11.7329 11.7329 12.5624 12.5624 12.8064 12.8064 12.8543 12.8543 13.1757 13.1757 26.6954 26.6954 k = 0.0000 0.1587 0.3536 ( 810 PWs) bands (ev): 7.3367 7.3367 7.6782 7.6782 10.0214 10.0214 10.3830 10.3830 10.9171 10.9171 11.2377 11.2377 11.4397 11.4397 11.7050 11.7050 12.6024 12.6024 12.8298 12.8298 12.8744 12.8744 13.1710 13.1710 26.4259 26.4259 k = 0.0000 0.1667 0.3536 ( 810 PWs) bands (ev): 7.3786 7.3786 7.7202 7.7202 10.0357 10.0357 10.3928 10.3928 10.9042 10.9042 11.2296 11.2296 11.4288 11.4288 11.6771 11.6771 12.6422 12.6422 12.8532 12.8532 12.8943 12.8943 13.1663 13.1663 26.1582 26.1582 k = 0.0000 0.1746 0.3536 ( 810 PWs) bands (ev): 7.4214 7.4214 7.7628 7.7628 10.0514 10.0514 10.4042 10.4042 10.8917 10.8917 11.2229 11.2229 11.4175 11.4175 11.6493 11.6493 12.6818 12.6818 12.8766 12.8766 12.9140 12.9140 13.1616 13.1616 25.8925 25.8925 k = 0.0000 0.1825 0.3536 ( 810 PWs) bands (ev): 7.4650 7.4650 7.8059 7.8059 10.0685 10.0685 10.4171 10.4171 10.8797 10.8797 11.2176 11.2176 11.4059 11.4059 11.6218 11.6218 12.7210 12.7210 12.8999 12.8999 12.9335 12.9335 13.1571 13.1571 25.6288 25.6288 k = 0.0000 0.1905 0.3536 ( 814 PWs) bands (ev): 7.5092 7.5092 7.8492 7.8492 10.0871 10.0871 10.4318 10.4318 10.8681 10.8681 11.2136 11.2136 11.3939 11.3939 11.5944 11.5944 12.7599 12.7599 12.9230 12.9230 12.9526 12.9526 13.1525 13.1525 25.3673 25.3673 k = 0.0000 0.1984 0.3536 ( 810 PWs) bands (ev): 7.5539 7.5539 7.8925 7.8925 10.1075 10.1075 10.4486 10.4486 10.8572 10.8572 11.2110 11.2110 11.3817 11.3817 11.5676 11.5676 12.7982 12.7982 12.9457 12.9457 12.9718 12.9718 13.1486 13.1486 25.1082 25.1082 k = 0.0000 0.2063 0.3536 ( 810 PWs) bands (ev): 7.5986 7.5986 7.9354 7.9354 10.1298 10.1298 10.4676 10.4676 10.8469 10.8469 11.2096 11.2096 11.3693 11.3693 11.5411 11.5411 12.8358 12.8358 12.9680 12.9680 12.9908 12.9908 13.1448 13.1448 24.8515 24.8515 k = 0.0000 0.2143 0.3536 ( 810 PWs) bands (ev): 7.6434 7.6434 7.9779 7.9779 10.1542 10.1542 10.4890 10.4890 10.8372 10.8372 11.2095 11.2095 11.3566 11.3566 11.5149 11.5149 12.8725 12.8725 12.9894 12.9894 13.0099 13.0099 13.1415 13.1415 24.5974 24.5974 k = 0.0000 0.2222 0.3536 ( 810 PWs) bands (ev): 7.6879 7.6879 8.0196 8.0196 10.1807 10.1807 10.5130 10.5130 10.8282 10.8282 11.2105 11.2105 11.3437 11.3437 11.4893 11.4893 12.9080 12.9080 13.0098 13.0098 13.0294 13.0294 13.1388 13.1388 24.3461 24.3461 k = 0.0000 0.2302 0.3536 ( 810 PWs) bands (ev): 7.7319 7.7319 8.0603 8.0603 10.2097 10.2097 10.5397 10.5397 10.8200 10.8200 11.2126 11.2126 11.3306 11.3306 11.4644 11.4644 12.9421 12.9421 13.0285 13.0285 13.0496 13.0496 13.1371 13.1371 24.0975 24.0975 k = 0.0000 0.2381 0.3536 ( 810 PWs) bands (ev): 7.7753 7.7753 8.0998 8.0998 10.2411 10.2411 10.5692 10.5692 10.8125 10.8125 11.2156 11.2156 11.3175 11.3175 11.4402 11.4402 12.9743 12.9743 13.0449 13.0449 13.0711 13.0711 13.1369 13.1369 23.8519 23.8519 k = 0.0000 0.2460 0.3536 ( 818 PWs) bands (ev): 7.8177 7.8177 8.1378 8.1378 10.2751 10.2751 10.6016 10.6016 10.8056 10.8056 11.2190 11.2190 11.3041 11.3041 11.4171 11.4171 13.0041 13.0041 13.0582 13.0582 13.0938 13.0938 13.1387 13.1387 23.6095 23.6095 k = 0.0000 0.2540 0.3536 ( 822 PWs) bands (ev): 7.8590 7.8590 8.1742 8.1742 10.3118 10.3118 10.6369 10.6369 10.8000 10.8000 11.2234 11.2234 11.2909 11.2909 11.3951 11.3951 13.0311 13.0311 13.0680 13.0680 13.1178 13.1178 13.1434 13.1434 23.3702 23.3702 k = 0.0000 0.2619 0.3536 ( 822 PWs) bands (ev): 7.8990 7.8990 8.2089 8.2089 10.3516 10.3516 10.6751 10.6751 10.7951 10.7951 11.2274 11.2274 11.2782 11.2782 11.3752 11.3752 13.0553 13.0553 13.0744 13.0744 13.1422 13.1422 13.1528 13.1528 23.1343 23.1343 k = 0.0000 0.2698 0.3536 ( 822 PWs) bands (ev): 7.9374 7.9374 8.2416 8.2416 10.3943 10.3943 10.7157 10.7157 10.7914 10.7914 11.2301 11.2301 11.2663 11.2663 11.3582 11.3582 13.0745 13.0745 13.0801 13.0801 13.1585 13.1585 13.1738 13.1738 22.9020 22.9020 k = 0.0000 0.2778 0.3536 ( 822 PWs) bands (ev): 7.9742 7.9742 8.2722 8.2722 10.4399 10.4399 10.7572 10.7572 10.7902 10.7902 11.2292 11.2292 11.2561 11.2561 11.3457 11.3457 13.0777 13.0777 13.0973 13.0973 13.1706 13.1706 13.2011 13.2011 22.6733 22.6733 k = 0.0000 0.2857 0.3536 ( 822 PWs) bands (ev): 8.0092 8.0092 8.3007 8.3007 10.4880 10.4880 10.7809 10.7809 10.8102 10.8102 11.2228 11.2228 11.2477 11.2477 11.3399 11.3399 13.0775 13.0775 13.1148 13.1148 13.1826 13.1826 13.2292 13.2292 22.4486 22.4486 k = 0.0000 0.2937 0.3536 ( 822 PWs) bands (ev): 8.0423 8.0423 8.3271 8.3271 10.5383 10.5383 10.7833 10.7833 10.8545 10.8545 11.2122 11.2122 11.2388 11.2388 11.3427 11.3427 13.0764 13.0764 13.1310 13.1310 13.1942 13.1942 13.2573 13.2573 22.2278 22.2278 k = 0.0000 0.3016 0.3536 ( 822 PWs) bands (ev): 8.0734 8.0734 8.3514 8.3514 10.5896 10.5896 10.7864 10.7864 10.9011 10.9011 11.1998 11.1998 11.2280 11.2280 11.3539 11.3539 13.0747 13.0747 13.1461 13.1461 13.2050 13.2050 13.2849 13.2849 22.0113 22.0113 k = 0.0000 0.3095 0.3536 ( 822 PWs) bands (ev): 8.1025 8.1025 8.3735 8.3735 10.6393 10.6393 10.7944 10.7944 10.9472 10.9472 11.1866 11.1866 11.2161 11.2161 11.3730 11.3730 13.0729 13.0729 13.1602 13.1602 13.2147 13.2147 13.3117 13.3117 21.7991 21.7991 k = 0.0000 0.3175 0.3536 ( 822 PWs) bands (ev): 8.1295 8.1295 8.3936 8.3936 10.6819 10.6819 10.8127 10.8127 10.9910 10.9910 11.1733 11.1733 11.2043 11.2043 11.3996 11.3996 13.0708 13.0708 13.1735 13.1735 13.2232 13.2232 13.3375 13.3375 21.5917 21.5917 k = 0.0000 0.3254 0.3536 ( 822 PWs) bands (ev): 8.1544 8.1544 8.4116 8.4116 10.7105 10.7105 10.8475 10.8475 11.0307 11.0307 11.1605 11.1605 11.1938 11.1938 11.4340 11.4340 13.0688 13.0688 13.1860 13.1860 13.2301 13.2301 13.3621 13.3621 21.3891 21.3891 k = 0.0000 0.3333 0.3536 ( 822 PWs) bands (ev): 8.1773 8.1773 8.4277 8.4277 10.7255 10.7255 10.8973 10.8973 11.0645 11.0645 11.1492 11.1492 11.1858 11.1858 11.4764 11.4764 13.0667 13.0667 13.1979 13.1979 13.2354 13.2354 13.3854 13.3854 21.1917 21.1917 k = 0.0000 0.3413 0.3536 ( 822 PWs) bands (ev): 8.1982 8.1982 8.4421 8.4421 10.7330 10.7330 10.9530 10.9530 11.0908 11.0908 11.1412 11.1412 11.1825 11.1825 11.5269 11.5269 13.0647 13.0647 13.2091 13.2091 13.2388 13.2388 13.4072 13.4072 20.9996 20.9996 k = 0.0000 0.3492 0.3536 ( 822 PWs) bands (ev): 8.2171 8.2171 8.4547 8.4547 10.7370 10.7370 11.0026 11.0026 11.1081 11.1081 11.1441 11.1441 11.1861 11.1861 11.5849 11.5849 13.0627 13.0627 13.2196 13.2196 13.2402 13.2402 13.4273 13.4273 20.8133 20.8133 k = 0.0000 0.3571 0.3536 ( 826 PWs) bands (ev): 8.2343 8.2343 8.4659 8.4659 10.7393 10.7393 11.0308 11.0308 11.1106 11.1106 11.1770 11.1770 11.1966 11.1966 11.6493 11.6493 13.0608 13.0608 13.2295 13.2295 13.2393 13.2393 13.4456 13.4456 20.6329 20.6329 k = 0.0000 0.3651 0.3536 ( 824 PWs) bands (ev): 8.2498 8.2498 8.4756 8.4756 10.7410 10.7410 11.0371 11.0371 11.1052 11.1052 11.2075 11.2075 11.2402 11.2402 11.7189 11.7189 13.0589 13.0589 13.2351 13.2351 13.2400 13.2400 13.4622 13.4622 20.4589 20.4589 k = 0.0000 0.3730 0.3536 ( 824 PWs) bands (ev): 8.2635 8.2635 8.4840 8.4840 10.7421 10.7421 11.0331 11.0331 11.0978 11.0978 11.2211 11.2211 11.3140 11.3140 11.7926 11.7926 13.0572 13.0572 13.2299 13.2299 13.2483 13.2483 13.4768 13.4768 20.2915 20.2915 k = 0.0000 0.3810 0.3536 ( 824 PWs) bands (ev): 8.2758 8.2758 8.4912 8.4912 10.7430 10.7430 11.0251 11.0251 11.0899 11.0899 11.2336 11.2336 11.3942 11.3942 11.8693 11.8693 13.0554 13.0554 13.2215 13.2215 13.2566 13.2566 13.4892 13.4892 20.1312 20.1312 k = 0.0000 0.3889 0.3536 ( 824 PWs) bands (ev): 8.2867 8.2867 8.4974 8.4974 10.7437 10.7437 11.0158 11.0158 11.0818 11.0818 11.2451 11.2451 11.4781 11.4781 11.9478 11.9478 13.0537 13.0537 13.2103 13.2103 13.2643 13.2643 13.4995 13.4995 19.9784 19.9784 k = 0.0000 0.3968 0.3536 ( 828 PWs) bands (ev): 8.2962 8.2962 8.5026 8.5026 10.7442 10.7442 11.0061 11.0061 11.0738 11.0738 11.2555 11.2555 11.5641 11.5641 12.0273 12.0273 13.0520 13.0520 13.1960 13.1960 13.2714 13.2714 13.5075 13.5075 19.8334 19.8334 k = 0.0000 0.4048 0.3536 ( 822 PWs) bands (ev): 8.3047 8.3047 8.5072 8.5072 10.7448 10.7448 10.9969 10.9969 11.0665 11.0665 11.2649 11.2649 11.6516 11.6516 12.1070 12.1070 13.0502 13.0502 13.1788 13.1788 13.2781 13.2781 13.5133 13.5133 19.6966 19.6966 k = 0.0000 0.4127 0.3536 ( 822 PWs) bands (ev): 8.3121 8.3121 8.5109 8.5109 10.7453 10.7453 10.9878 10.9878 11.0595 11.0595 11.2734 11.2734 11.7398 11.7398 12.1861 12.1861 13.0481 13.0481 13.1583 13.1583 13.2842 13.2842 13.5165 13.5165 19.5686 19.5686 k = 0.0000 0.4206 0.3536 ( 822 PWs) bands (ev): 8.3184 8.3184 8.5140 8.5140 10.7456 10.7456 10.9794 10.9794 11.0530 11.0530 11.2811 11.2811 11.8284 11.8284 12.2636 12.2636 13.0454 13.0454 13.1350 13.1350 13.2897 13.2897 13.5174 13.5174 19.4497 19.4497 k = 0.0000 0.4286 0.3536 ( 814 PWs) bands (ev): 8.3242 8.3242 8.5169 8.5169 10.7460 10.7460 10.9717 10.9717 11.0471 11.0471 11.2879 11.2879 11.9168 11.9168 12.3390 12.3390 13.0412 13.0412 13.1097 13.1097 13.2948 13.2948 13.5160 13.5160 19.3405 19.3405 k = 0.0000 0.4365 0.3536 ( 814 PWs) bands (ev): 8.3288 8.3288 8.5190 8.5190 10.7463 10.7463 10.9647 10.9647 11.0417 11.0417 11.2940 11.2940 12.0045 12.0045 12.4112 12.4112 13.0324 13.0324 13.0851 13.0851 13.2993 13.2993 13.5123 13.5123 19.2413 19.2413 k = 0.0000 0.4444 0.3536 ( 814 PWs) bands (ev): 8.3328 8.3328 8.5206 8.5206 10.7465 10.7465 10.9585 10.9585 11.0369 11.0369 11.2993 11.2993 12.0911 12.0911 12.4793 12.4793 13.0125 13.0125 13.0677 13.0677 13.3031 13.3031 13.5067 13.5067 19.1525 19.1525 k = 0.0000 0.4524 0.3536 ( 814 PWs) bands (ev): 8.3360 8.3360 8.5220 8.5220 10.7466 10.7466 10.9530 10.9530 11.0327 11.0327 11.3038 11.3038 12.1760 12.1760 12.5422 12.5422 12.9796 12.9796 13.0594 13.0594 13.3064 13.3064 13.4995 13.4995 19.0747 19.0747 k = 0.0000 0.4603 0.3536 ( 818 PWs) bands (ev): 8.3386 8.3386 8.5229 8.5229 10.7467 10.7467 10.9483 10.9483 11.0291 11.0291 11.3076 11.3076 12.2588 12.2588 12.5990 12.5990 12.9385 12.9385 13.0554 13.0554 13.3091 13.3091 13.4911 13.4911 19.0081 19.0081 k = 0.0000 0.4683 0.3536 ( 820 PWs) bands (ev): 8.3407 8.3407 8.5237 8.5237 10.7467 10.7467 10.9445 10.9445 11.0262 11.0262 11.3107 11.3107 12.3389 12.3389 12.6483 12.6483 12.8919 12.8919 13.0533 13.0533 13.3112 13.3112 13.4823 13.4823 18.9531 18.9531 k = 0.0000 0.4762 0.3536 ( 820 PWs) bands (ev): 8.3423 8.3423 8.5243 8.5243 10.7468 10.7468 10.9415 10.9415 11.0239 11.0239 11.3131 11.3131 12.4154 12.4154 12.6888 12.6888 12.8416 12.8416 13.0519 13.0519 13.3128 13.3128 13.4740 13.4740 18.9100 18.9100 k = 0.0000 0.4841 0.3536 ( 820 PWs) bands (ev): 8.3434 8.3434 8.5247 8.5247 10.7468 10.7468 10.9394 10.9394 11.0223 11.0223 11.3148 11.3148 12.4866 12.4866 12.7190 12.7190 12.7892 12.7892 13.0510 13.0510 13.3139 13.3139 13.4671 13.4671 18.8790 18.8790 k = 0.0000 0.4921 0.3536 ( 820 PWs) bands (ev): 8.3441 8.3441 8.5249 8.5249 10.7468 10.7468 10.9381 10.9381 11.0213 11.0213 11.3159 11.3159 12.5475 12.5475 12.7376 12.7376 12.7398 12.7398 13.0505 13.0505 13.3145 13.3145 13.4626 13.4626 18.8604 18.8604 k = 0.0000 0.5000 0.3536 ( 820 PWs) bands (ev): 8.3443 8.3443 8.5250 8.5250 10.7469 10.7469 10.9377 10.9377 11.0210 11.0210 11.3162 11.3162 12.5772 12.5772 12.7136 12.7136 12.7442 12.7442 13.0503 13.0503 13.3147 13.3147 13.4610 13.4610 18.8541 18.8541 k = 0.0000 0.5000 0.3536 ( 820 PWs) bands (ev): 8.3443 8.3443 8.5250 8.5250 10.7469 10.7469 10.9377 10.9377 11.0210 11.0210 11.3162 11.3162 12.5772 12.5772 12.7136 12.7136 12.7442 12.7442 13.0503 13.0503 13.3147 13.3147 13.4610 13.4610 18.8541 18.8541 k = 0.0079 0.5000 0.3536 ( 820 PWs) bands (ev): 8.3455 8.3455 8.5260 8.5260 10.7472 10.7472 10.9366 10.9366 11.0204 11.0204 11.3171 11.3171 12.5685 12.5685 12.7078 12.7078 12.7212 12.7212 13.0804 13.0804 13.3249 13.3249 13.4614 13.4614 18.8543 18.8543 k = 0.0159 0.5000 0.3536 ( 820 PWs) bands (ev): 8.3490 8.3490 8.5291 8.5291 10.7483 10.7483 10.9333 10.9333 11.0188 11.0188 11.3196 11.3196 12.5438 12.5438 12.6470 12.6470 12.7155 12.7155 13.1509 13.1509 13.3538 13.3538 13.4630 13.4630 18.8548 18.8548 k = 0.0238 0.5000 0.3536 ( 820 PWs) bands (ev): 8.3548 8.3548 8.5343 8.5343 10.7501 10.7501 10.9278 10.9278 11.0161 11.0161 11.3239 11.3239 12.5065 12.5065 12.5666 12.5666 12.7147 12.7147 13.2387 13.2387 13.3953 13.3953 13.4685 13.4685 18.8557 18.8557 k = 0.0317 0.5000 0.3536 ( 820 PWs) bands (ev): 8.3630 8.3630 8.5416 8.5416 10.7525 10.7525 10.9202 10.9202 11.0123 11.0123 11.3299 11.3299 12.4602 12.4602 12.4808 12.4808 12.7139 12.7139 13.3339 13.3339 13.4324 13.4324 13.4918 13.4918 18.8569 18.8569 k = 0.0397 0.5000 0.3536 ( 816 PWs) bands (ev): 8.3735 8.3735 8.5510 8.5510 10.7555 10.7555 10.9106 10.9106 11.0075 11.0075 11.3379 11.3379 12.3930 12.3930 12.4086 12.4086 12.7130 12.7130 13.4259 13.4259 13.4534 13.4534 13.5486 13.5486 18.8585 18.8585 k = 0.0476 0.5000 0.3536 ( 812 PWs) bands (ev): 8.3863 8.3863 8.5623 8.5623 10.7584 10.7584 10.8993 10.8993 11.0019 11.0019 11.3474 11.3474 12.3055 12.3055 12.3531 12.3531 12.7119 12.7119 13.4439 13.4439 13.5419 13.5419 13.6226 13.6226 18.8605 18.8605 k = 0.0556 0.5000 0.3536 ( 808 PWs) bands (ev): 8.4014 8.4014 8.5757 8.5757 10.7611 10.7611 10.8866 10.8866 10.9956 10.9956 11.3587 11.3587 12.2184 12.2184 12.2958 12.2958 12.7106 12.7106 13.4451 13.4451 13.6470 13.6470 13.7045 13.7045 18.8629 18.8629 k = 0.0635 0.5000 0.3536 ( 808 PWs) bands (ev): 8.4186 8.4186 8.5910 8.5910 10.7626 10.7626 10.8731 10.8731 10.9885 10.9885 11.3718 11.3718 12.1321 12.1321 12.2378 12.2378 12.7090 12.7090 13.4448 13.4448 13.7547 13.7547 13.7918 13.7918 18.8657 18.8657 k = 0.0714 0.5000 0.3536 ( 812 PWs) bands (ev): 8.4381 8.4381 8.6081 8.6081 10.7616 10.7616 10.8599 10.8599 10.9808 10.9808 11.3864 11.3864 12.0470 12.0470 12.1798 12.1798 12.7072 12.7072 13.4438 13.4438 13.8642 13.8642 13.8835 13.8835 18.8689 18.8689 k = 0.0794 0.5000 0.3536 ( 808 PWs) bands (ev): 8.4598 8.4598 8.6272 8.6272 10.7568 10.7568 10.8486 10.8486 10.9733 10.9733 11.4031 11.4031 11.9632 11.9632 12.1223 12.1223 12.7053 12.7053 13.4424 13.4424 13.9742 13.9742 13.9800 13.9800 18.8726 18.8726 k = 0.0873 0.5000 0.3536 ( 808 PWs) bands (ev): 8.4836 8.4836 8.6480 8.6480 10.7460 10.7460 10.8402 10.8402 10.9661 10.9661 11.4214 11.4214 11.8809 11.8809 12.0657 12.0657 12.7030 12.7030 13.4407 13.4407 14.0758 14.0758 14.0896 14.0896 18.8768 18.8768 k = 0.0952 0.5000 0.3536 ( 808 PWs) bands (ev): 8.5095 8.5095 8.6706 8.6706 10.7290 10.7290 10.8346 10.8346 10.9602 10.9602 11.4415 11.4415 11.8001 11.8001 12.0102 12.0102 12.7006 12.7006 13.4388 13.4388 14.1769 14.1769 14.2039 14.2039 18.8815 18.8815 k = 0.1032 0.5000 0.3536 ( 808 PWs) bands (ev): 8.5374 8.5374 8.6949 8.6949 10.7068 10.7068 10.8298 10.8298 10.9564 10.9564 11.4632 11.4632 11.7211 11.7211 11.9560 11.9560 12.6980 12.6980 13.4366 13.4366 14.2803 14.2803 14.3199 14.3199 18.8868 18.8868 k = 0.1111 0.5000 0.3536 ( 808 PWs) bands (ev): 8.5674 8.5674 8.7208 8.7208 10.6807 10.6807 10.8239 10.8239 10.9558 10.9558 11.4865 11.4865 11.6438 11.6438 11.9033 11.9033 12.6952 12.6952 13.4343 13.4343 14.3860 14.3860 14.4373 14.4373 18.8926 18.8926 k = 0.1190 0.5000 0.3536 ( 812 PWs) bands (ev): 8.5992 8.5992 8.7482 8.7482 10.6514 10.6514 10.8151 10.8151 10.9587 10.9587 11.5110 11.5110 11.5687 11.5687 11.8521 11.8521 12.6921 12.6921 13.4319 13.4319 14.4939 14.4939 14.5561 14.5561 18.8991 18.8991 k = 0.1270 0.5000 0.3536 ( 812 PWs) bands (ev): 8.6330 8.6330 8.7771 8.7771 10.6200 10.6200 10.8033 10.8033 10.9653 10.9653 11.4938 11.4938 11.5385 11.5385 11.8029 11.8029 12.6889 12.6889 13.4293 13.4293 14.6038 14.6038 14.6762 14.6762 18.9062 18.9062 k = 0.1349 0.5000 0.3536 ( 808 PWs) bands (ev): 8.6687 8.6687 8.8074 8.8074 10.5868 10.5868 10.7884 10.7884 10.9752 10.9752 11.4231 11.4231 11.5647 11.5647 11.7562 11.7562 12.6855 12.6855 13.4267 13.4267 14.7156 14.7156 14.7977 14.7977 18.9141 18.9141 k = 0.1429 0.5000 0.3536 ( 808 PWs) bands (ev): 8.7060 8.7060 8.8391 8.8391 10.5521 10.5521 10.7706 10.7706 10.9872 10.9872 11.3545 11.3545 11.5895 11.5895 11.7141 11.7141 12.6819 12.6819 13.4241 13.4241 14.8293 14.8293 14.9206 14.9206 18.9227 18.9227 k = 0.1508 0.5000 0.3536 ( 808 PWs) bands (ev): 8.7451 8.7451 8.8719 8.8719 10.5161 10.5161 10.7504 10.7504 11.0005 11.0005 11.2887 11.2887 11.6033 11.6033 11.6859 11.6859 12.6782 12.6782 13.4214 13.4214 14.9448 14.9448 15.0447 15.0447 18.9321 18.9321 k = 0.1587 0.5000 0.3536 ( 808 PWs) bands (ev): 8.7857 8.7857 8.9059 8.9059 10.4791 10.4791 10.7279 10.7279 11.0139 11.0139 11.2271 11.2271 11.5871 11.5871 11.6905 11.6905 12.6743 12.6743 13.4187 13.4187 15.0621 15.0621 15.1701 15.1701 18.9425 18.9425 k = 0.1667 0.5000 0.3536 ( 804 PWs) bands (ev): 8.8279 8.8279 8.9409 8.9409 10.4414 10.4414 10.7034 10.7034 11.0244 11.0244 11.1725 11.1725 11.5516 11.5516 11.7172 11.7172 12.6703 12.6703 13.4160 13.4160 15.1811 15.1811 15.2969 15.2969 18.9537 18.9537 k = 0.1746 0.5000 0.3536 ( 812 PWs) bands (ev): 8.8713 8.8713 8.9768 8.9768 10.4029 10.4029 10.6766 10.6766 11.0231 11.0231 11.1331 11.1331 11.5117 11.5117 11.7503 11.7503 12.6660 12.6660 13.4134 13.4134 15.3018 15.3018 15.4248 15.4248 18.9659 18.9659 k = 0.1825 0.5000 0.3536 ( 820 PWs) bands (ev): 8.9161 8.9161 9.0133 9.0133 10.3640 10.3640 10.6478 10.6478 10.9980 10.9980 11.1213 11.1213 11.4710 11.4710 11.7866 11.7866 12.6616 12.6616 13.4109 13.4109 15.4240 15.4240 15.5540 15.5540 18.9792 18.9792 k = 0.1905 0.5000 0.3536 ( 820 PWs) bands (ev): 8.9623 8.9623 9.0509 9.0509 10.3249 10.3249 10.6171 10.6171 10.9561 10.9561 11.1306 11.1306 11.4307 11.4307 11.8251 11.8251 12.6572 12.6572 13.4087 13.4087 15.5479 15.5479 15.6844 15.6844 18.9936 18.9936 k = 0.1984 0.5000 0.3536 ( 820 PWs) bands (ev): 9.0096 9.0096 9.0892 9.0892 10.2858 10.2858 10.5843 10.5843 10.9097 10.9097 11.1482 11.1482 11.3910 11.3910 11.8652 11.8652 12.6527 12.6527 13.4067 13.4067 15.6734 15.6734 15.8160 15.8160 19.0092 19.0092 k = 0.2063 0.5000 0.3536 ( 820 PWs) bands (ev): 9.0579 9.0579 9.1281 9.1281 10.2466 10.2466 10.5496 10.5496 10.8638 10.8638 11.1691 11.1691 11.3521 11.3521 11.9065 11.9065 12.6481 12.6481 13.4050 13.4050 15.8004 15.8004 15.9489 15.9489 19.0262 19.0262 k = 0.2143 0.5000 0.3536 ( 816 PWs) bands (ev): 9.1073 9.1073 9.1676 9.1676 10.2077 10.2077 10.5131 10.5131 10.8198 10.8198 11.1919 11.1919 11.3141 11.3141 11.9488 11.9488 12.6435 12.6435 13.4036 13.4036 15.9289 15.9289 16.0829 16.0829 19.0444 19.0444 k = 0.2222 0.5000 0.3536 ( 828 PWs) bands (ev): 9.1571 9.1571 9.2074 9.2074 10.1685 10.1685 10.4740 10.4740 10.7779 10.7779 11.2151 11.2151 11.2769 11.2769 11.9919 11.9919 12.6388 12.6388 13.4027 13.4027 16.0589 16.0589 16.2180 16.2180 19.0641 19.0641 k = 0.2302 0.5000 0.3536 ( 828 PWs) bands (ev): 9.2075 9.2075 9.2479 9.2479 10.1301 10.1301 10.4341 10.4341 10.7387 10.7387 11.2303 11.2303 11.2497 11.2497 12.0357 12.0357 12.6342 12.6342 13.4024 13.4024 16.1904 16.1904 16.3544 16.3544 19.0853 19.0853 k = 0.2381 0.5000 0.3536 ( 828 PWs) bands (ev): 9.2578 9.2578 9.2892 9.2892 10.0923 10.0923 10.3932 10.3932 10.7018 10.7018 11.2009 11.2009 11.2683 11.2683 12.0800 12.0800 12.6297 12.6297 13.4028 13.4028 16.3234 16.3234 16.4919 16.4919 19.1082 19.1082 k = 0.2460 0.5000 0.3536 ( 828 PWs) bands (ev): 9.3071 9.3071 9.3321 9.3321 10.0550 10.0550 10.3515 10.3515 10.6670 10.6670 11.1661 11.1661 11.2934 11.2934 12.1246 12.1246 12.6253 12.6253 13.4040 13.4040 16.4578 16.4578 16.6305 16.6305 19.1327 19.1327 k = 0.2540 0.5000 0.3536 ( 828 PWs) bands (ev): 9.3537 9.3537 9.3781 9.3781 10.0184 10.0184 10.3094 10.3094 10.6341 10.6341 11.1317 11.1317 11.3192 11.3192 12.1691 12.1691 12.6210 12.6210 13.4061 13.4061 16.5936 16.5936 16.7703 16.7703 19.1590 19.1590 k = 0.2619 0.5000 0.3536 ( 828 PWs) bands (ev): 9.3970 9.3970 9.4275 9.4275 9.9825 9.9825 10.2672 10.2672 10.6028 10.6028 11.0979 11.0979 11.3451 11.3451 12.2133 12.2133 12.6169 12.6169 13.4092 13.4092 16.7308 16.7308 16.9111 16.9111 19.1873 19.1873 k = 0.2698 0.5000 0.3536 ( 828 PWs) bands (ev): 9.4381 9.4381 9.4791 9.4791 9.9475 9.9475 10.2253 10.2253 10.5730 10.5730 11.0648 11.0648 11.3709 11.3709 12.2570 12.2570 12.6131 12.6131 13.4136 13.4136 16.8694 16.8694 17.0530 17.0530 19.2174 19.2174 k = 0.2778 0.5000 0.3536 ( 828 PWs) bands (ev): 9.4779 9.4779 9.5315 9.5315 9.9135 9.9135 10.1839 10.1839 10.5444 10.5444 11.0325 11.0325 11.3965 11.3965 12.2999 12.2999 12.6096 12.6096 13.4193 13.4193 17.0093 17.0093 17.1959 17.1959 19.2497 19.2497 k = 0.2857 0.5000 0.3536 ( 824 PWs) bands (ev): 9.5167 9.5167 9.5843 9.5843 9.8806 9.8806 10.1433 10.1433 10.5171 10.5171 11.0010 11.0010 11.4217 11.4217 12.3417 12.3417 12.6066 12.6066 13.4267 13.4267 17.1506 17.1506 17.3398 17.3398 19.2840 19.2840 k = 0.2937 0.5000 0.3536 ( 824 PWs) bands (ev): 9.5547 9.5547 9.6369 9.6369 9.8489 9.8489 10.1035 10.1035 10.4907 10.4907 10.9703 10.9703 11.4463 11.4463 12.3820 12.3820 12.6040 12.6040 13.4357 13.4357 17.2931 17.2931 17.4847 17.4847 19.3207 19.3207 k = 0.3016 0.5000 0.3536 ( 824 PWs) bands (ev): 9.5916 9.5916 9.6889 9.6889 9.8190 9.8190 10.0647 10.0647 10.4653 10.4653 10.9404 10.9404 11.4702 11.4702 12.4204 12.4204 12.6019 12.6019 13.4466 13.4466 17.4369 17.4369 17.6305 17.6305 19.3596 19.3596 k = 0.3095 0.5000 0.3536 ( 812 PWs) bands (ev): 9.6272 9.6272 9.7380 9.7380 9.7936 9.7936 10.0272 10.0272 10.4411 10.4411 10.9116 10.9116 11.4935 11.4935 12.4570 12.4570 12.6008 12.6008 13.4597 13.4597 17.5820 17.5820 17.7772 17.7772 19.4010 19.4010 k = 0.3175 0.5000 0.3536 ( 812 PWs) bands (ev): 9.6600 9.6600 9.7548 9.7548 9.8027 9.8027 9.9909 9.9909 10.4176 10.4176 10.8834 10.8834 11.5155 11.5155 12.4909 12.4909 12.6001 12.6001 13.4747 13.4747 17.7282 17.7282 17.9248 17.9248 19.4448 19.4448 k = 0.3254 0.5000 0.3536 ( 812 PWs) bands (ev): 9.6840 9.6840 9.7419 9.7419 9.8494 9.8494 9.9561 9.9561 10.3948 10.3948 10.8562 10.8562 11.5364 11.5364 12.5220 12.5220 12.6005 12.6005 13.4918 13.4918 17.8755 17.8755 18.0730 18.0730 19.4911 19.4911 k = 0.3333 0.5000 0.3536 ( 812 PWs) bands (ev): 9.6824 9.6824 9.7515 9.7515 9.8961 9.8961 9.9253 9.9253 10.3730 10.3730 10.8299 10.8299 11.5559 11.5559 12.5498 12.5498 12.6023 12.6023 13.5110 13.5110 18.0239 18.0239 18.2220 18.2220 19.5401 19.5401 k = 0.3413 0.5000 0.3536 ( 812 PWs) bands (ev): 9.6633 9.6633 9.7781 9.7781 9.8871 9.8871 9.9514 9.9514 10.3520 10.3520 10.8045 10.8045 11.5740 11.5740 12.5728 12.5728 12.6067 12.6067 13.5324 13.5324 18.1733 18.1733 18.3716 18.3716 19.5917 19.5917 k = 0.3492 0.5000 0.3536 ( 812 PWs) bands (ev): 9.6409 9.6409 9.8078 9.8078 9.8570 9.8570 9.9992 9.9992 10.3320 10.3320 10.7802 10.7802 11.5906 11.5906 12.5885 12.5885 12.6167 12.6167 13.5556 13.5556 18.3236 18.3236 18.5217 18.5217 19.6459 19.6459 k = 0.3571 0.5000 0.3536 ( 816 PWs) bands (ev): 9.6182 9.6182 9.8263 9.8263 9.8386 9.8386 10.0465 10.0465 10.3128 10.3128 10.7569 10.7569 11.6055 11.6055 12.5968 12.5968 12.6318 12.6318 13.5805 13.5805 18.4748 18.4748 18.6722 18.6722 19.7028 19.7028 k = 0.3651 0.5000 0.3536 ( 808 PWs) bands (ev): 9.5966 9.5966 9.7992 9.7992 9.8669 9.8669 10.0929 10.0929 10.2949 10.2949 10.7349 10.7349 11.6188 11.6188 12.6025 12.6025 12.6480 12.6480 13.6069 13.6069 18.6268 18.6268 18.8229 18.8229 19.7623 19.7623 k = 0.3730 0.5000 0.3536 ( 808 PWs) bands (ev): 9.5757 9.5757 9.7727 9.7727 9.8947 9.8947 10.1378 10.1378 10.2776 10.2776 10.7137 10.7137 11.6304 11.6304 12.6078 12.6078 12.6627 12.6627 13.6343 13.6343 18.7793 18.7793 18.9737 18.9737 19.8244 19.8244 k = 0.3810 0.5000 0.3536 ( 808 PWs) bands (ev): 9.5560 9.5560 9.7477 9.7477 9.9213 9.9213 10.1812 10.1812 10.2614 10.2614 10.6937 10.6937 11.6403 11.6403 12.6132 12.6132 12.6755 12.6755 13.6624 13.6624 18.9323 18.9323 19.1243 19.1243 19.8889 19.8889 k = 0.3889 0.5000 0.3536 ( 812 PWs) bands (ev): 9.5373 9.5373 9.7241 9.7241 9.9465 9.9465 10.2227 10.2227 10.2464 10.2464 10.6748 10.6748 11.6484 11.6484 12.6189 12.6189 12.6864 12.6864 13.6908 13.6908 19.0854 19.0854 19.2745 19.2745 19.9558 19.9558 k = 0.3968 0.5000 0.3536 ( 808 PWs) bands (ev): 9.5201 9.5201 9.7024 9.7024 9.9701 9.9701 10.2316 10.2316 10.2634 10.2634 10.6571 10.6571 11.6551 11.6551 12.6252 12.6252 12.6957 12.6957 13.7193 13.7193 19.2386 19.2386 19.4239 19.4239 20.0248 20.0248 k = 0.4048 0.5000 0.3536 ( 808 PWs) bands (ev): 9.5040 9.5040 9.6820 9.6820 9.9921 9.9921 10.2188 10.2188 10.3011 10.3011 10.6406 10.6406 11.6602 11.6602 12.6317 12.6317 12.7033 12.7033 13.7473 13.7473 19.3913 19.3913 19.5721 19.5721 20.0955 20.0955 k = 0.4127 0.5000 0.3536 ( 808 PWs) bands (ev): 9.4891 9.4891 9.6633 9.6633 10.0124 10.0124 10.2070 10.2070 10.3368 10.3368 10.6254 10.6254 11.6639 11.6639 12.6384 12.6384 12.7095 12.7095 13.7745 13.7745 19.5433 19.5433 19.7186 19.7186 20.1678 20.1678 k = 0.4206 0.5000 0.3536 ( 808 PWs) bands (ev): 9.4754 9.4754 9.6461 9.6461 10.0308 10.0308 10.1964 10.1964 10.3703 10.3703 10.6114 10.6114 11.6664 11.6664 12.6451 12.6451 12.7145 12.7145 13.8005 13.8005 19.6938 19.6938 19.8626 19.8626 20.2410 20.2410 k = 0.4286 0.5000 0.3536 ( 808 PWs) bands (ev): 9.4631 9.4631 9.6306 9.6306 10.0472 10.0472 10.1873 10.1873 10.4012 10.4012 10.5987 10.5987 11.6678 11.6678 12.6518 12.6518 12.7185 12.7185 13.8251 13.8251 19.8421 19.8421 20.0033 20.0033 20.3145 20.3145 k = 0.4365 0.5000 0.3536 ( 812 PWs) bands (ev): 9.4520 9.4520 9.6167 9.6167 10.0612 10.0612 10.1796 10.1796 10.4292 10.4292 10.5874 10.5874 11.6684 11.6684 12.6582 12.6582 12.7216 12.7216 13.8477 13.8477 19.9871 19.9871 20.1395 20.1395 20.3876 20.3876 k = 0.4444 0.5000 0.3536 ( 812 PWs) bands (ev): 9.4422 9.4422 9.6044 9.6044 10.0731 10.0731 10.1735 10.1735 10.4545 10.4545 10.5774 10.5774 11.6683 11.6683 12.6643 12.6643 12.7239 12.7239 13.8684 13.8684 20.1274 20.1274 20.2695 20.2695 20.4593 20.4593 k = 0.4524 0.5000 0.3536 ( 812 PWs) bands (ev): 9.4337 9.4337 9.5937 9.5937 10.0826 10.0826 10.1692 10.1692 10.4768 10.4768 10.5689 10.5689 11.6677 11.6677 12.6699 12.6699 12.7257 12.7257 13.8868 13.8868 20.2608 20.2608 20.3914 20.3914 20.5286 20.5286 k = 0.4603 0.5000 0.3536 ( 812 PWs) bands (ev): 9.4265 9.4265 9.5847 9.5847 10.0896 10.0896 10.1665 10.1665 10.4957 10.4957 10.5620 10.5620 11.6668 11.6668 12.6749 12.6749 12.7270 12.7270 13.9028 13.9028 20.3843 20.3843 20.5022 20.5022 20.5943 20.5943 k = 0.4683 0.5000 0.3536 ( 812 PWs) bands (ev): 9.4206 9.4206 9.5773 9.5773 10.0944 10.0944 10.1654 10.1654 10.5109 10.5109 10.5567 10.5567 11.6658 11.6658 12.6791 12.6791 12.7280 12.7280 13.9160 13.9160 20.4937 20.4937 20.5982 20.5982 20.6554 20.6554 k = 0.4762 0.5000 0.3536 ( 812 PWs) bands (ev): 9.4160 9.4160 9.5715 9.5715 10.0973 10.0973 10.1653 10.1653 10.5219 10.5219 10.5536 10.5536 11.6648 11.6648 12.6825 12.6825 12.7286 12.7286 13.9265 13.9265 20.5832 20.5832 20.6747 20.6747 20.7108 20.7108 k = 0.4841 0.5000 0.3536 ( 812 PWs) bands (ev): 9.4127 9.4127 9.5674 9.5674 10.0988 10.0988 10.1658 10.1658 10.5284 10.5284 10.5528 10.5528 11.6640 11.6640 12.6850 12.6850 12.7290 12.7290 13.9340 13.9340 20.6472 20.6472 20.7277 20.7277 20.7579 20.7579 k = 0.4921 0.5000 0.3536 ( 824 PWs) bands (ev): 9.4104 9.4104 9.5646 9.5646 10.0995 10.0995 10.1662 10.1662 10.5311 10.5311 10.5534 10.5534 11.6633 11.6633 12.6862 12.6862 12.7291 12.7291 13.9383 13.9383 20.6843 20.6843 20.7565 20.7565 20.7915 20.7915 k = 0.5000 0.5000 0.3536 ( 824 PWs) bands (ev): 9.4097 9.4097 9.5638 9.5638 10.0997 10.0997 10.1664 10.1664 10.5317 10.5317 10.5539 10.5539 11.6631 11.6631 12.6867 12.6867 12.7291 12.7291 13.9399 13.9399 20.6962 20.6962 20.7653 20.7653 20.8039 20.8039 k = 0.5000 0.5000 0.3536 ( 824 PWs) bands (ev): 9.4097 9.4097 9.5638 9.5638 10.0997 10.0997 10.1664 10.1664 10.5317 10.5317 10.5539 10.5539 11.6631 11.6631 12.6867 12.6867 12.7291 12.7291 13.9399 13.9399 20.6962 20.6962 20.7653 20.7653 20.8039 20.8039 k = 0.4943 0.4943 0.3536 ( 820 PWs) bands (ev): 9.4106 9.4106 9.5648 9.5648 10.0995 10.0995 10.1662 10.1662 10.5311 10.5311 10.5533 10.5533 11.6634 11.6634 12.6863 12.6863 12.7291 12.7291 13.9384 13.9384 20.6823 20.6823 20.7553 20.7553 20.7930 20.7930 k = 0.4886 0.4886 0.3536 ( 812 PWs) bands (ev): 9.4126 9.4126 9.5673 9.5673 10.0990 10.0990 10.1657 10.1657 10.5294 10.5294 10.5519 10.5519 11.6640 11.6640 12.6850 12.6850 12.7289 12.7289 13.9340 13.9340 20.6261 20.6261 20.7143 20.7143 20.7789 20.7789 k = 0.4830 0.4830 0.3536 ( 812 PWs) bands (ev): 9.4160 9.4160 9.5715 9.5715 10.0979 10.0979 10.1648 10.1648 10.5257 10.5257 10.5497 10.5497 11.6648 11.6648 12.6824 12.6824 12.7285 12.7285 13.9262 13.9262 20.5204 20.5204 20.6319 20.6319 20.7787 20.7787 k = 0.4773 0.4773 0.3536 ( 808 PWs) bands (ev): 9.4208 9.4208 9.5776 9.5776 10.0962 10.0962 10.1636 10.1636 10.5196 10.5196 10.5475 10.5475 11.6661 11.6661 12.6789 12.6789 12.7280 12.7280 13.9154 13.9154 20.3805 20.3805 20.5161 20.5161 20.7886 20.7886 k = 0.4716 0.4716 0.3536 ( 808 PWs) bands (ev): 9.4268 9.4268 9.5851 9.5851 10.0937 10.0937 10.1624 10.1624 10.5110 10.5110 10.5457 10.5457 11.6674 11.6674 12.6743 12.6743 12.7272 12.7272 13.9016 13.9016 20.2192 20.2192 20.3766 20.3766 20.8048 20.8048 k = 0.4659 0.4659 0.3536 ( 808 PWs) bands (ev): 9.4341 9.4341 9.5942 9.5942 10.0904 10.0904 10.1612 10.1612 10.4999 10.4999 10.5442 10.5442 11.6689 11.6689 12.6688 12.6688 12.7262 12.7262 13.8849 13.8849 20.0447 20.0447 20.2200 20.2200 20.8261 20.8261 k = 0.4602 0.4602 0.3536 ( 808 PWs) bands (ev): 9.4426 9.4426 9.6048 9.6048 10.0861 10.0861 10.1603 10.1603 10.4865 10.4865 10.5430 10.5430 11.6704 11.6704 12.6624 12.6624 12.7249 12.7249 13.8654 13.8654 19.8619 19.8619 20.0514 20.0514 20.8518 20.8518 k = 0.4545 0.4545 0.3536 ( 808 PWs) bands (ev): 9.4523 9.4523 9.6170 9.6170 10.0807 10.0807 10.1598 10.1598 10.4711 10.4711 10.5418 10.5418 11.6719 11.6719 12.6551 12.6551 12.7232 12.7232 13.8431 13.8431 19.6742 19.6742 19.8741 19.8741 20.8818 20.8818 k = 0.4489 0.4489 0.3536 ( 808 PWs) bands (ev): 9.4632 9.4632 9.6307 9.6307 10.0742 10.0742 10.1598 10.1598 10.4537 10.4537 10.5406 10.5406 11.6732 11.6732 12.6470 12.6470 12.7212 12.7212 13.8183 13.8183 19.4840 19.4840 19.6908 19.6908 20.9158 20.9158 k = 0.4432 0.4432 0.3536 ( 808 PWs) bands (ev): 9.4753 9.4753 9.6457 9.6457 10.0665 10.0665 10.1604 10.1604 10.4346 10.4346 10.5394 10.5394 11.6742 11.6742 12.6382 12.6382 12.7188 12.7188 13.7910 13.7910 19.2928 19.2928 19.5034 19.5034 20.9538 20.9538 k = 0.4375 0.4375 0.3536 ( 808 PWs) bands (ev): 9.4884 9.4884 9.6620 9.6620 10.0578 10.0578 10.1614 10.1614 10.4140 10.4140 10.5381 10.5381 11.6748 11.6748 12.6287 12.6287 12.7159 12.7159 13.7613 13.7613 19.1017 19.1017 19.3136 19.3136 20.9957 20.9957 k = 0.4318 0.4318 0.3536 ( 814 PWs) bands (ev): 9.5022 9.5022 9.6793 9.6793 10.0481 10.0481 10.1630 10.1630 10.3919 10.3919 10.5367 10.5367 11.6748 11.6748 12.6185 12.6185 12.7123 12.7123 13.7294 13.7294 18.9117 18.9117 19.1224 19.1224 21.0414 21.0414 k = 0.4261 0.4261 0.3536 ( 814 PWs) bands (ev): 9.5173 9.5173 9.6977 9.6977 10.0379 10.0379 10.1650 10.1650 10.3687 10.3687 10.5351 10.5351 11.6743 11.6743 12.6078 12.6078 12.7083 12.7083 13.6954 13.6954 18.7232 18.7232 18.9308 18.9308 21.0908 21.0908 k = 0.4205 0.4205 0.3536 ( 812 PWs) bands (ev): 9.5332 9.5332 9.7170 9.7170 10.0272 10.0272 10.1673 10.1673 10.3444 10.3444 10.5334 10.5334 11.6731 11.6731 12.5966 12.5966 12.7037 12.7037 13.6596 13.6596 18.5369 18.5369 18.7395 18.7395 21.1439 21.1439 k = 0.4148 0.4148 0.3536 ( 812 PWs) bands (ev): 9.5497 9.5497 9.7364 9.7364 10.0164 10.0164 10.1700 10.1700 10.3193 10.3193 10.5314 10.5314 11.6711 11.6711 12.5850 12.5850 12.6983 12.6983 13.6220 13.6220 18.3531 18.3531 18.5491 18.5491 21.2006 21.2006 k = 0.4091 0.4091 0.3536 ( 808 PWs) bands (ev): 9.5668 9.5668 9.7558 9.7558 10.0063 10.0063 10.1728 10.1728 10.2938 10.2938 10.5293 10.5293 11.6682 11.6682 12.5731 12.5731 12.6922 12.6922 13.5828 13.5828 18.1721 18.1721 18.3602 18.3602 21.2609 21.2609 k = 0.4034 0.4034 0.3536 ( 810 PWs) bands (ev): 9.5841 9.5841 9.7739 9.7739 9.9973 9.9973 10.1756 10.1756 10.2679 10.2679 10.5268 10.5268 11.6644 11.6644 12.5609 12.5609 12.6853 12.6853 13.5421 13.5421 17.9942 17.9942 18.1731 18.1731 21.3245 21.3245 k = 0.3977 0.3977 0.3536 ( 810 PWs) bands (ev): 9.6014 9.6014 9.7896 9.7896 9.9912 9.9912 10.1776 10.1776 10.2429 10.2429 10.5241 10.5241 11.6595 11.6595 12.5484 12.5484 12.6775 12.6775 13.5001 13.5001 17.8195 17.8195 17.9882 17.9882 21.3916 21.3916 k = 0.3920 0.3920 0.3536 ( 810 PWs) bands (ev): 9.6183 9.6183 9.8012 9.8012 9.9895 9.9895 10.1770 10.1770 10.2210 10.2210 10.5210 10.5210 11.6536 11.6536 12.5359 12.5359 12.6688 12.6688 13.4569 13.4569 17.6484 17.6484 17.8059 17.8059 21.4620 21.4620 k = 0.3864 0.3864 0.3536 ( 810 PWs) bands (ev): 9.6345 9.6345 9.8068 9.8068 9.9938 9.9938 10.1685 10.1685 10.2078 10.2078 10.5177 10.5177 11.6467 11.6467 12.5233 12.5233 12.6592 12.6592 13.4126 13.4126 17.4808 17.4808 17.6264 17.6264 21.5357 21.5357 k = 0.3807 0.3807 0.3536 ( 810 PWs) bands (ev): 9.6493 9.6493 9.8056 9.8056 10.0051 10.0051 10.1505 10.1505 10.2054 10.2054 10.5140 10.5140 11.6386 11.6386 12.5106 12.5106 12.6485 12.6485 13.3674 13.3674 17.3170 17.3170 17.4499 17.4499 21.6125 21.6125 k = 0.3750 0.3750 0.3536 ( 814 PWs) bands (ev): 9.6618 9.6618 9.7981 9.7981 10.0227 10.0227 10.1298 10.1298 10.2076 10.2076 10.5098 10.5098 11.6294 11.6294 12.4981 12.4981 12.6368 12.6368 13.3214 13.3214 17.1570 17.1570 17.2768 17.2768 21.6925 21.6925 k = 0.3693 0.3693 0.3536 ( 814 PWs) bands (ev): 9.6710 9.6710 9.7855 9.7855 10.0453 10.0453 10.1107 10.1107 10.2117 10.2117 10.5054 10.5054 11.6192 11.6192 12.4857 12.4857 12.6241 12.6241 13.2747 13.2747 17.0010 17.0010 17.1071 17.1071 21.7755 21.7755 k = 0.3636 0.3636 0.3536 ( 814 PWs) bands (ev): 9.6759 9.6759 9.7692 9.7692 10.0706 10.0706 10.0959 10.0959 10.2165 10.2165 10.5006 10.5006 11.6079 11.6079 12.4736 12.4736 12.6104 12.6104 13.2276 13.2276 16.8491 16.8491 16.9412 16.9412 21.8615 21.8615 k = 0.3580 0.3580 0.3536 ( 814 PWs) bands (ev): 9.6751 9.6751 9.7500 9.7500 10.0806 10.0806 10.1038 10.1038 10.2219 10.2219 10.4954 10.4954 11.5956 11.5956 12.4616 12.4616 12.5956 12.5956 13.1799 13.1799 16.7012 16.7012 16.7791 16.7791 21.9504 21.9504 k = 0.3523 0.3523 0.3536 ( 812 PWs) bands (ev): 9.6680 9.6680 9.7284 9.7284 10.0764 10.0764 10.1335 10.1335 10.2277 10.2277 10.4898 10.4898 11.5824 11.5824 12.4500 12.4500 12.5800 12.5800 13.1320 13.1320 16.5574 16.5574 16.6211 16.6211 22.0422 22.0422 k = 0.3466 0.3466 0.3536 ( 812 PWs) bands (ev): 9.6541 9.6541 9.7047 9.7047 10.0773 10.0773 10.1656 10.1656 10.2339 10.2339 10.4838 10.4838 11.5683 11.5683 12.4387 12.4387 12.5633 12.5633 13.0839 13.0839 16.4178 16.4178 16.4672 16.4672 22.1367 22.1367 k = 0.3409 0.3409 0.3536 ( 812 PWs) bands (ev): 9.6338 9.6338 9.6788 9.6788 10.0839 10.0839 10.1985 10.1985 10.2407 10.2407 10.4773 10.4773 11.5535 11.5535 12.4278 12.4278 12.5457 12.5457 13.0356 13.0356 16.2824 16.2824 16.3175 16.3175 22.2340 22.2340 k = 0.3352 0.3352 0.3536 ( 820 PWs) bands (ev): 9.6076 9.6076 9.6510 9.6510 10.0954 10.0954 10.2307 10.2307 10.2491 10.2491 10.4704 10.4704 11.5378 11.5378 12.4171 12.4171 12.5273 12.5273 12.9872 12.9872 16.1510 16.1510 16.1722 16.1722 22.3340 22.3340 k = 0.3295 0.3295 0.3536 ( 818 PWs) bands (ev): 9.5764 9.5764 9.6216 9.6216 10.1110 10.1110 10.2506 10.2506 10.2710 10.2710 10.4630 10.4630 11.5219 11.5219 12.4071 12.4071 12.5085 12.5085 12.9392 12.9392 16.0238 16.0238 16.0314 16.0314 22.4366 22.4366 k = 0.3239 0.3239 0.3536 ( 818 PWs) bands (ev): 9.5406 9.5406 9.5910 9.5910 10.1294 10.1294 10.2597 10.2597 10.3043 10.3043 10.4554 10.4554 11.5056 11.5056 12.3972 12.3972 12.4893 12.4893 12.8912 12.8912 15.8950 15.8950 15.9008 15.9008 22.5417 22.5417 k = 0.3182 0.3182 0.3536 ( 818 PWs) bands (ev): 9.5008 9.5008 9.5592 9.5592 10.1496 10.1496 10.2684 10.2684 10.3388 10.3388 10.4475 10.4475 11.4891 11.4891 12.3876 12.3876 12.4699 12.4699 12.8434 12.8434 15.7633 15.7633 15.7818 15.7818 22.6494 22.6494 k = 0.3125 0.3125 0.3536 ( 818 PWs) bands (ev): 9.4576 9.4576 9.5262 9.5262 10.1707 10.1707 10.2779 10.2779 10.3734 10.3734 10.4393 10.4393 11.4726 11.4726 12.3780 12.3780 12.4509 12.4509 12.7960 12.7960 15.6361 15.6361 15.6667 15.6667 22.7596 22.7596 k = 0.3068 0.3068 0.3536 ( 818 PWs) bands (ev): 9.4115 9.4115 9.4920 9.4920 10.1915 10.1915 10.2888 10.2888 10.4076 10.4076 10.4309 10.4309 11.4563 11.4563 12.3681 12.3681 12.4326 12.4326 12.7489 12.7489 15.5135 15.5135 15.5555 15.5555 22.8721 22.8721 k = 0.3011 0.3011 0.3536 ( 818 PWs) bands (ev): 9.3629 9.3629 9.4565 9.4565 10.2110 10.2110 10.3014 10.3014 10.4221 10.4221 10.4419 10.4419 11.4404 11.4404 12.3575 12.3575 12.4158 12.4158 12.7024 12.7024 15.3954 15.3954 15.4482 15.4482 22.9871 22.9871 k = 0.2955 0.2955 0.3536 ( 814 PWs) bands (ev): 9.3120 9.3120 9.4196 9.4196 10.2284 10.2284 10.3163 10.3163 10.4142 10.4142 10.4752 10.4752 11.4251 11.4251 12.3457 12.3457 12.4013 12.4013 12.6565 12.6565 15.2819 15.2819 15.3445 15.3445 23.1043 23.1043 k = 0.2898 0.2898 0.3536 ( 814 PWs) bands (ev): 9.2590 9.2590 9.3812 9.3812 10.2429 10.2429 10.3326 10.3326 10.4074 10.4074 10.5075 10.5075 11.4106 11.4106 12.3324 12.3324 12.3895 12.3895 12.6111 12.6111 15.1727 15.1727 15.2444 15.2444 23.2239 23.2239 k = 0.2841 0.2841 0.3536 ( 818 PWs) bands (ev): 9.2040 9.2040 9.3412 9.3412 10.2545 10.2545 10.3475 10.3475 10.4042 10.4042 10.5389 10.5389 11.3970 11.3970 12.3179 12.3179 12.3803 12.3803 12.5664 12.5664 15.0677 15.0677 15.1476 15.1476 23.3457 23.3457 k = 0.2784 0.2784 0.3536 ( 818 PWs) bands (ev): 9.1475 9.1475 9.2998 9.2998 10.2639 10.2639 10.3556 10.3556 10.4097 10.4097 10.5692 10.5692 11.3848 11.3848 12.3030 12.3030 12.3734 12.3734 12.5225 12.5225 14.9670 14.9670 15.0543 15.0543 23.4697 23.4697 k = 0.2727 0.2727 0.3536 ( 818 PWs) bands (ev): 9.0893 9.0893 9.2567 9.2567 10.2713 10.2713 10.3544 10.3544 10.4257 10.4257 10.5982 10.5982 11.3740 11.3740 12.2884 12.2884 12.3683 12.3683 12.4796 12.4796 14.8704 14.8704 14.9640 14.9640 23.5959 23.5959 k = 0.2670 0.2670 0.3536 ( 818 PWs) bands (ev): 9.0297 9.0297 9.2121 9.2121 10.2768 10.2768 10.3487 10.3487 10.4472 10.4472 10.6258 10.6258 11.3648 11.3648 12.2746 12.2746 12.3643 12.3643 12.4377 12.4377 14.7776 14.7776 14.8768 14.8768 23.7242 23.7242 k = 0.2614 0.2614 0.3536 ( 818 PWs) bands (ev): 8.9688 8.9688 9.1659 9.1659 10.2803 10.2803 10.3419 10.3419 10.4706 10.4706 10.6520 10.6520 11.3574 11.3574 12.2621 12.2621 12.3608 12.3608 12.3976 12.3976 14.6887 14.6887 14.7925 14.7925 23.8547 23.8547 k = 0.2557 0.2557 0.3536 ( 818 PWs) bands (ev): 8.9067 8.9067 9.1181 9.1181 10.2812 10.2812 10.3360 10.3360 10.4946 10.4946 10.6766 10.6766 11.3521 11.3521 12.2508 12.2508 12.3503 12.3503 12.3669 12.3669 14.6033 14.6033 14.7109 14.7109 23.9873 23.9873 k = 0.2500 0.2500 0.3536 ( 814 PWs) bands (ev): 8.8435 8.8435 9.0688 9.0688 10.2788 10.2788 10.3322 10.3322 10.5184 10.5184 10.6998 10.6998 11.3490 11.3490 12.2406 12.2406 12.3173 12.3173 12.3619 12.3619 14.5213 14.5213 14.6318 14.6318 24.1219 24.1219 k = 0.2443 0.2443 0.3536 ( 814 PWs) bands (ev): 8.7794 8.7794 9.0179 9.0179 10.2731 10.2731 10.3309 10.3309 10.5416 10.5416 10.7213 10.7213 11.3479 11.3479 12.2292 12.2292 12.2847 12.2847 12.3612 12.3612 14.4425 14.4425 14.5551 14.5551 24.2585 24.2585 k = 0.2386 0.2386 0.3536 ( 814 PWs) bands (ev): 8.7145 8.7145 8.9656 8.9656 10.2646 10.2646 10.3316 10.3316 10.5640 10.5640 10.7414 10.7414 11.3491 11.3491 12.2116 12.2116 12.2612 12.2612 12.3617 12.3617 14.3668 14.3668 14.4807 14.4807 24.3972 24.3972 k = 0.2330 0.2330 0.3536 ( 814 PWs) bands (ev): 8.6490 8.6490 8.9119 8.9119 10.2544 10.2544 10.3335 10.3335 10.5854 10.5854 10.7601 10.7601 11.3527 11.3527 12.1844 12.1844 12.2507 12.2507 12.3629 12.3629 14.2940 14.2940 14.4084 14.4084 24.5379 24.5379 k = 0.2273 0.2273 0.3536 ( 822 PWs) bands (ev): 8.5830 8.5830 8.8569 8.8569 10.2429 10.2429 10.3358 10.3358 10.6054 10.6054 10.7772 10.7772 11.3584 11.3584 12.1523 12.1523 12.2482 12.2482 12.3646 12.3646 14.2238 14.2238 14.3380 14.3380 24.6805 24.6805 k = 0.2216 0.2216 0.3536 ( 822 PWs) bands (ev): 8.5167 8.5167 8.8008 8.8008 10.2308 10.2308 10.3385 10.3385 10.6246 10.6246 10.7935 10.7935 11.3666 11.3666 12.1193 12.1193 12.2502 12.2502 12.3670 12.3670 14.1562 14.1562 14.2695 14.2695 24.8252 24.8252 k = 0.2159 0.2159 0.3536 ( 822 PWs) bands (ev): 8.4501 8.4501 8.7436 8.7436 10.2183 10.2183 10.3413 10.3413 10.6428 10.6428 10.8088 10.8088 11.3770 11.3770 12.0865 12.0865 12.2553 12.2553 12.3700 12.3700 14.0910 14.0910 14.2028 14.2028 24.9717 24.9717 k = 0.2102 0.2102 0.3536 ( 822 PWs) bands (ev): 8.3835 8.3835 8.6855 8.6855 10.2056 10.2056 10.3439 10.3439 10.6599 10.6599 10.8233 10.8233 11.3894 11.3894 12.0543 12.0543 12.2626 12.2626 12.3734 12.3734 14.0282 14.0282 14.1376 14.1376 25.1202 25.1202 k = 0.2045 0.2045 0.3536 ( 820 PWs) bands (ev): 8.3170 8.3170 8.6267 8.6267 10.1928 10.1928 10.3465 10.3465 10.6760 10.6760 10.8372 10.8372 11.4037 11.4037 12.0233 12.0233 12.2720 12.2720 12.3774 12.3774 13.9675 13.9675 14.0740 14.0740 25.2706 25.2706 k = 0.1989 0.1989 0.3536 ( 820 PWs) bands (ev): 8.2507 8.2507 8.5673 8.5673 10.1798 10.1798 10.3488 10.3488 10.6914 10.6914 10.8508 10.8508 11.4199 11.4199 11.9931 11.9931 12.2829 12.2829 12.3816 12.3816 13.9090 13.9090 14.0117 14.0117 25.4230 25.4230 k = 0.1932 0.1932 0.3536 ( 820 PWs) bands (ev): 8.1848 8.1848 8.5074 8.5074 10.1668 10.1668 10.3508 10.3508 10.7061 10.7061 10.8641 10.8641 11.4376 11.4376 11.9639 11.9639 12.2950 12.2950 12.3862 12.3862 13.8525 13.8525 13.9507 13.9507 25.5772 25.5772 k = 0.1875 0.1875 0.3536 ( 824 PWs) bands (ev): 8.1194 8.1194 8.4473 8.4473 10.1538 10.1538 10.3526 10.3526 10.7200 10.7200 10.8771 10.8771 11.4567 11.4567 11.9358 11.9358 12.3080 12.3080 12.3911 12.3911 13.7979 13.7979 13.8908 13.8908 25.7333 25.7333 k = 0.1818 0.1818 0.3536 ( 824 PWs) bands (ev): 8.0547 8.0547 8.3870 8.3870 10.1409 10.1409 10.3541 10.3541 10.7337 10.7337 10.8905 10.8905 11.4770 11.4770 11.9088 11.9088 12.3215 12.3215 12.3964 12.3964 13.7453 13.7453 13.8322 13.8322 25.8913 25.8913 k = 0.1761 0.1761 0.3536 ( 820 PWs) bands (ev): 7.9907 7.9907 8.3269 8.3269 10.1283 10.1283 10.3554 10.3554 10.7471 10.7471 10.9042 10.9042 11.4985 11.4985 11.8831 11.8831 12.3354 12.3354 12.4020 12.4020 13.6948 13.6948 13.7746 13.7746 26.0511 26.0511 k = 0.1705 0.1705 0.3536 ( 820 PWs) bands (ev): 7.9277 7.9277 8.2670 8.2670 10.1157 10.1157 10.3563 10.3563 10.7604 10.7604 10.9182 10.9182 11.5207 11.5207 11.8584 11.8584 12.3488 12.3488 12.4079 12.4079 13.6461 13.6461 13.7180 13.7180 26.2129 26.2129 k = 0.1648 0.1648 0.3536 ( 820 PWs) bands (ev): 7.8657 7.8657 8.2075 8.2075 10.1033 10.1033 10.3569 10.3569 10.7736 10.7736 10.9326 10.9326 11.5435 11.5435 11.8349 11.8349 12.3617 12.3617 12.4142 12.4142 13.5995 13.5995 13.6624 13.6624 26.3764 26.3764 k = 0.1591 0.1591 0.3536 ( 820 PWs) bands (ev): 7.8048 7.8048 8.1486 8.1486 10.0911 10.0911 10.3572 10.3572 10.7869 10.7869 10.9477 10.9477 11.5668 11.5668 11.8126 11.8126 12.3735 12.3735 12.4208 12.4208 13.5550 13.5550 13.6078 13.6078 26.5419 26.5419 k = 0.1534 0.1534 0.3536 ( 820 PWs) bands (ev): 7.7452 7.7452 8.0905 8.0905 10.0792 10.0792 10.3573 10.3573 10.8003 10.8003 10.9634 10.9634 11.5905 11.5905 11.7914 11.7914 12.3840 12.3840 12.4276 12.4276 13.5126 13.5126 13.5541 13.5541 26.7092 26.7092 k = 0.1477 0.1477 0.3536 ( 824 PWs) bands (ev): 7.6869 7.6869 8.0332 8.0332 10.0673 10.0673 10.3569 10.3569 10.8138 10.8138 10.9798 10.9798 11.6143 11.6143 11.7714 11.7714 12.3929 12.3929 12.4345 12.4345 13.4723 13.4723 13.5016 13.5016 26.8783 26.8783 k = 0.1420 0.1420 0.3536 ( 816 PWs) bands (ev): 7.6301 7.6301 7.9770 7.9770 10.0562 10.0562 10.3566 10.3566 10.8279 10.8279 10.9974 10.9974 11.6381 11.6381 11.7529 11.7529 12.4000 12.4000 12.4415 12.4415 13.4331 13.4331 13.4514 13.4514 27.0493 27.0493 k = 0.1364 0.1364 0.3536 ( 816 PWs) bands (ev): 7.5749 7.5749 7.9220 7.9220 10.0451 10.0451 10.3559 10.3559 10.8420 10.8420 11.0154 11.0154 11.6612 11.6612 11.7362 11.7362 12.4052 12.4052 12.4481 12.4481 13.3906 13.3906 13.4079 13.4079 27.2221 27.2221 k = 0.1307 0.1307 0.3536 ( 820 PWs) bands (ev): 7.5212 7.5212 7.8683 7.8683 10.0344 10.0344 10.3549 10.3549 10.8563 10.8563 11.0342 11.0342 11.6816 11.6816 11.7230 11.7230 12.4082 12.4082 12.4541 12.4541 13.3424 13.3424 13.3736 13.3736 27.3967 27.3967 k = 0.1250 0.1250 0.3536 ( 820 PWs) bands (ev): 7.4693 7.4693 7.8160 7.8160 10.0240 10.0240 10.3537 10.3537 10.8709 10.8709 11.0539 11.0539 11.6888 11.6888 11.7243 11.7243 12.4088 12.4088 12.4598 12.4598 13.2931 13.2931 13.3443 13.3443 27.5731 27.5731 k = 0.1193 0.1193 0.3536 ( 818 PWs) bands (ev): 7.4193 7.4193 7.7653 7.7653 10.0139 10.0139 10.3523 10.3523 10.8857 10.8857 11.0746 11.0746 11.6799 11.6799 11.7428 11.7428 12.4068 12.4068 12.4650 12.4650 13.2442 13.2442 13.3187 13.3187 27.7514 27.7514 k = 0.1136 0.1136 0.3536 ( 818 PWs) bands (ev): 7.3711 7.3711 7.7163 7.7163 10.0043 10.0043 10.3507 10.3507 10.9007 10.9007 11.0960 11.0960 11.6676 11.6676 11.7653 11.7653 12.4017 12.4017 12.4700 12.4700 13.1958 13.1958 13.2965 13.2965 27.9314 27.9314 k = 0.1080 0.1080 0.3536 ( 822 PWs) bands (ev): 7.3248 7.3248 7.6691 7.6691 9.9950 9.9950 10.3490 10.3490 10.9159 10.9159 11.1182 11.1182 11.6554 11.6554 11.7882 11.7882 12.3931 12.3931 12.4747 12.4747 13.1482 13.1482 13.2774 13.2774 28.1132 28.1132 k = 0.1023 0.1023 0.3536 ( 818 PWs) bands (ev): 7.2805 7.2805 7.6237 7.6237 9.9862 9.9862 10.3472 10.3472 10.9312 10.9312 11.1413 11.1413 11.6437 11.6437 11.8117 11.8117 12.3815 12.3815 12.4793 12.4793 13.1015 13.1015 13.2619 13.2619 28.2967 28.2967 k = 0.0966 0.0966 0.3536 ( 818 PWs) bands (ev): 7.2384 7.2384 7.5804 7.5804 9.9778 9.9778 10.3453 10.3453 10.9465 10.9465 11.1651 11.1651 11.6329 11.6329 11.8351 11.8351 12.3666 12.3666 12.4839 12.4839 13.0555 13.0555 13.2491 13.2491 28.4819 28.4819 k = 0.0909 0.0909 0.3536 ( 822 PWs) bands (ev): 7.1983 7.1983 7.5390 7.5390 9.9698 9.9698 10.3433 10.3433 10.9614 10.9614 11.1894 11.1894 11.6228 11.6228 11.8582 11.8582 12.3485 12.3485 12.4883 12.4883 13.0103 13.0103 13.2392 13.2392 28.6688 28.6688 k = 0.0852 0.0852 0.3536 ( 822 PWs) bands (ev): 7.1605 7.1605 7.4999 7.4999 9.9622 9.9622 10.3413 10.3413 10.9765 10.9765 11.2146 11.2146 11.6135 11.6135 11.8812 11.8812 12.3277 12.3277 12.4925 12.4925 12.9661 12.9661 13.2317 13.2317 28.8573 28.8573 k = 0.0795 0.0795 0.3536 ( 822 PWs) bands (ev): 7.1248 7.1248 7.4629 7.4629 9.9551 9.9551 10.3393 10.3393 10.9914 10.9914 11.2405 11.2405 11.6051 11.6051 11.9039 11.9039 12.3044 12.3044 12.4966 12.4966 12.9230 12.9230 13.2264 13.2264 29.0473 29.0473 k = 0.0739 0.0739 0.3536 ( 822 PWs) bands (ev): 7.0915 7.0915 7.4282 7.4282 9.9485 9.9485 10.3372 10.3372 11.0059 11.0059 11.2670 11.2670 11.5975 11.5975 11.9264 11.9264 12.2791 12.2791 12.5005 12.5005 12.8809 12.8809 13.2230 13.2230 29.2388 29.2388 k = 0.0682 0.0682 0.3536 ( 826 PWs) bands (ev): 7.0604 7.0604 7.3958 7.3958 9.9420 9.9420 10.3350 10.3350 11.0200 11.0200 11.2937 11.2937 11.5907 11.5907 11.9487 11.9487 12.2519 12.2519 12.5041 12.5041 12.8400 12.8400 13.2210 13.2210 29.4315 29.4315 k = 0.0625 0.0625 0.3536 ( 826 PWs) bands (ev): 7.0317 7.0317 7.3658 7.3658 9.9363 9.9363 10.3330 10.3330 11.0335 11.0335 11.3208 11.3208 11.5846 11.5846 11.9706 11.9706 12.2235 12.2235 12.5074 12.5074 12.8005 12.8005 13.2204 13.2204 29.6253 29.6253 k = 0.0568 0.0568 0.3536 ( 826 PWs) bands (ev): 7.0054 7.0054 7.3383 7.3383 9.9310 9.9310 10.3312 10.3312 11.0464 11.0464 11.3481 11.3481 11.5793 11.5793 11.9922 11.9922 12.1942 12.1942 12.5104 12.5104 12.7626 12.7626 13.2206 13.2206 29.8200 29.8200 k = 0.0511 0.0511 0.3536 ( 826 PWs) bands (ev): 6.9815 6.9815 7.3133 7.3133 9.9262 9.9262 10.3294 10.3294 11.0585 11.0585 11.3752 11.3752 11.5748 11.5748 12.0134 12.0134 12.1644 12.1644 12.5130 12.5130 12.7263 12.7263 13.2216 13.2216 30.0150 30.0150 k = 0.0455 0.0455 0.3536 ( 834 PWs) bands (ev): 6.9600 6.9600 7.2908 7.2908 9.9216 9.9216 10.3275 10.3275 11.0696 11.0696 11.4017 11.4017 11.5711 11.5711 12.0338 12.0338 12.1345 12.1345 12.5151 12.5151 12.6920 12.6920 13.2229 13.2229 30.2097 30.2097 k = 0.0398 0.0398 0.3536 ( 834 PWs) bands (ev): 6.9411 6.9411 7.2708 7.2708 9.9179 9.9179 10.3261 10.3261 11.0797 11.0797 11.4275 11.4275 11.5684 11.5684 12.0534 12.0534 12.1053 12.1053 12.5167 12.5167 12.6602 12.6602 13.2243 13.2243 30.4034 30.4034 k = 0.0341 0.0341 0.3536 ( 830 PWs) bands (ev): 6.9246 6.9246 7.2535 7.2535 9.9149 9.9149 10.3251 10.3251 11.0889 11.0889 11.4519 11.4519 11.5667 11.5667 12.0703 12.0703 12.0791 12.0791 12.5175 12.5175 12.6312 12.6312 13.2260 13.2260 30.5942 30.5942 k = 0.0284 0.0284 0.3536 ( 830 PWs) bands (ev): 6.9106 6.9106 7.2388 7.2388 9.9121 9.9121 10.3239 10.3239 11.0967 11.0967 11.4740 11.4740 11.5663 11.5663 12.0497 12.0497 12.0908 12.0908 12.5172 12.5172 12.6058 12.6058 13.2277 13.2277 30.7797 30.7797 k = 0.0227 0.0227 0.3536 ( 830 PWs) bands (ev): 6.8991 6.8991 7.2267 7.2267 9.9098 9.9098 10.3230 10.3230 11.1032 11.1032 11.4926 11.4926 11.5676 11.5676 12.0258 12.0258 12.1065 12.1065 12.5155 12.5155 12.5850 12.5850 13.2292 13.2292 30.9553 30.9553 k = 0.0170 0.0170 0.3536 ( 830 PWs) bands (ev): 6.8902 6.8902 7.2173 7.2173 9.9081 9.9081 10.3222 10.3222 11.1084 11.1084 11.5067 11.5067 11.5708 11.5708 12.0053 12.0053 12.1200 12.1200 12.5119 12.5119 12.5698 12.5698 13.2305 13.2305 31.1134 31.1134 k = 0.0114 0.0114 0.3536 ( 830 PWs) bands (ev): 6.8838 6.8838 7.2106 7.2106 9.9068 9.9068 10.3217 10.3217 11.1122 11.1122 11.5159 11.5159 11.5751 11.5751 11.9895 11.9895 12.1304 12.1304 12.5072 12.5072 12.5603 12.5603 13.2314 13.2314 31.2433 31.2433 k = 0.0057 0.0057 0.3536 ( 830 PWs) bands (ev): 6.8800 6.8800 7.2065 7.2065 9.9060 9.9060 10.3214 10.3214 11.1144 11.1144 11.5207 11.5207 11.5790 11.5790 11.9793 11.9793 12.1371 12.1371 12.5031 12.5031 12.5555 12.5555 13.2320 13.2320 31.3317 31.3317 k = 0.0000 0.0000 0.3536 ( 830 PWs) bands (ev): 6.8787 6.8787 7.2052 7.2052 9.9058 9.9058 10.3213 10.3213 11.1152 11.1152 11.5221 11.5221 11.5806 11.5806 11.9758 11.9758 12.1393 12.1393 12.5015 12.5015 12.5541 12.5541 13.2322 13.2322 31.3639 31.3639 k = 0.0000 0.5000-0.0000 ( 814 PWs) bands (ev): 8.8650 8.8650 9.0796 9.0796 10.1236 10.1236 10.3576 10.3576 10.5770 10.5770 10.9203 10.9203 11.3812 11.3812 11.7417 11.7417 12.2251 12.2251 12.8125 12.8125 13.9350 13.9350 15.1527 15.1527 24.4192 24.4192 k = 0.0000 0.5000 0.0080 ( 816 PWs) bands (ev): 8.8641 8.8641 9.0783 9.0783 10.1259 10.1259 10.3575 10.3575 10.5792 10.5792 10.9207 10.9207 11.3805 11.3805 11.7393 11.7393 12.2277 12.2277 12.8133 12.8133 13.9346 13.9346 15.1519 15.1519 24.3896 24.3896 k = 0.0000 0.5000 0.0161 ( 820 PWs) bands (ev): 8.8614 8.8614 9.0744 9.0744 10.1329 10.1329 10.3577 10.3577 10.5858 10.5858 10.9223 10.9223 11.3781 11.3781 11.7319 11.7319 12.2352 12.2352 12.8157 12.8157 13.9336 13.9336 15.1496 15.1496 24.2440 24.2440 k = 0.0000 0.5000 0.0241 ( 820 PWs) bands (ev): 8.8570 8.8570 9.0682 9.0682 10.1444 10.1444 10.3581 10.3581 10.5967 10.5967 10.9250 10.9250 11.3743 11.3743 11.7204 11.7204 12.2474 12.2474 12.8199 12.8199 13.9318 13.9318 15.1458 15.1458 24.0572 24.0572 k = 0.0000 0.5000 0.0321 ( 820 PWs) bands (ev): 8.8509 8.8509 9.0596 9.0596 10.1602 10.1602 10.3592 10.3592 10.6115 10.6115 10.9287 10.9287 11.3692 11.3692 11.7052 11.7052 12.2635 12.2635 12.8257 12.8257 13.9294 13.9294 15.1404 15.1404 23.8572 23.8572 k = 0.0000 0.5000 0.0402 ( 820 PWs) bands (ev): 8.8432 8.8432 9.0489 9.0489 10.1803 10.1803 10.3611 10.3611 10.6299 10.6299 10.9334 10.9334 11.3627 11.3627 11.6869 11.6869 12.2830 12.2830 12.8330 12.8330 13.9262 13.9262 15.1334 15.1334 23.6525 23.6525 k = 0.0000 0.5000 0.0482 ( 820 PWs) bands (ev): 8.8339 8.8339 9.0364 9.0364 10.2041 10.2041 10.3643 10.3643 10.6516 10.6516 10.9391 10.9391 11.3549 11.3549 11.6663 11.6663 12.3050 12.3050 12.8418 12.8418 13.9222 13.9222 15.1248 15.1248 23.4467 23.4467 k = 0.0000 0.5000 0.0563 ( 820 PWs) bands (ev): 8.8232 8.8232 9.0222 9.0222 10.2314 10.2314 10.3689 10.3689 10.6763 10.6763 10.9458 10.9458 11.3459 11.3459 11.6438 11.6438 12.3292 12.3292 12.8520 12.8520 13.9175 13.9175 15.1146 15.1146 23.2415 23.2415 k = 0.0000 0.5000 0.0643 ( 820 PWs) bands (ev): 8.8112 8.8112 9.0066 9.0066 10.2616 10.2616 10.3755 10.3755 10.7037 10.7037 10.9534 10.9534 11.3358 11.3358 11.6200 11.6200 12.3549 12.3549 12.8635 12.8635 13.9120 13.9120 15.1027 15.1027 23.0381 23.0381 k = 0.0000 0.5000 0.0723 ( 824 PWs) bands (ev): 8.7979 8.7979 8.9898 8.9898 10.2937 10.2937 10.3848 10.3848 10.7336 10.7336 10.9618 10.9618 11.3247 11.3247 11.5951 11.5951 12.3817 12.3817 12.8758 12.8758 13.9056 13.9056 15.0890 15.0890 22.8370 22.8370 k = 0.0000 0.5000 0.0804 ( 820 PWs) bands (ev): 8.7836 8.7836 8.9721 8.9721 10.3259 10.3259 10.3987 10.3987 10.7657 10.7657 10.9711 10.9711 11.3129 11.3129 11.5700 11.5700 12.4095 12.4095 12.8897 12.8897 13.8984 13.8984 15.0735 15.0735 22.6386 22.6386 k = 0.0000 0.5000 0.0884 ( 820 PWs) bands (ev): 8.7683 8.7683 8.9536 8.9536 10.3544 10.3544 10.4206 10.4206 10.8000 10.8000 10.9811 10.9811 11.3003 11.3003 11.5443 11.5443 12.4379 12.4379 12.9043 12.9043 13.8902 13.8902 15.0562 15.0562 22.4434 22.4434 k = 0.0000 0.5000 0.0964 ( 816 PWs) bands (ev): 8.7521 8.7521 8.9345 8.9345 10.3767 10.3767 10.4533 10.4533 10.8362 10.8362 10.9920 10.9920 11.2870 11.2870 11.5184 11.5184 12.4667 12.4667 12.9198 12.9198 13.8811 13.8811 15.0370 15.0370 22.2514 22.2514 k = 0.0000 0.5000 0.1045 ( 816 PWs) bands (ev): 8.7352 8.7352 8.9150 8.9150 10.3939 10.3939 10.4946 10.4946 10.8742 10.8742 11.0035 11.0035 11.2734 11.2734 11.4925 11.4925 12.4956 12.4956 12.9359 12.9359 13.8710 13.8710 15.0158 15.0158 22.0631 22.0631 k = 0.0000 0.5000 0.1125 ( 820 PWs) bands (ev): 8.7178 8.7178 8.8952 8.8952 10.4089 10.4089 10.5416 10.5416 10.9134 10.9134 11.0157 11.0157 11.2595 11.2595 11.4668 11.4668 12.5246 12.5246 12.9526 12.9526 13.8597 13.8597 14.9924 14.9924 21.8784 21.8784 k = 0.0000 0.5000 0.1205 ( 820 PWs) bands (ev): 8.6999 8.6999 8.8753 8.8753 10.4236 10.4236 10.5926 10.5926 10.9534 10.9534 11.0292 11.0292 11.2455 11.2455 11.4414 11.4414 12.5535 12.5535 12.9698 12.9698 13.8473 13.8473 14.9669 14.9669 21.6976 21.6976 k = 0.0000 0.5000 0.1286 ( 820 PWs) bands (ev): 8.6816 8.6816 8.8553 8.8553 10.4385 10.4385 10.6469 10.6469 10.9925 10.9925 11.0451 11.0451 11.2319 11.2319 11.4165 11.4165 12.5823 12.5823 12.9874 12.9874 13.8337 13.8337 14.9392 14.9392 21.5210 21.5210 k = 0.0000 0.5000 0.1366 ( 816 PWs) bands (ev): 8.6631 8.6631 8.8355 8.8355 10.4538 10.4538 10.7040 10.7040 11.0259 11.0259 11.0680 11.0680 11.2193 11.2193 11.3921 11.3921 12.6107 12.6107 13.0052 13.0052 13.8189 13.8189 14.9091 14.9091 21.3485 21.3485 k = 0.0000 0.5000 0.1446 ( 816 PWs) bands (ev): 8.6445 8.6445 8.8158 8.8158 10.4695 10.4695 10.7634 10.7634 11.0480 11.0480 11.1008 11.1008 11.2091 11.2091 11.3684 11.3684 12.6387 12.6387 13.0232 13.0232 13.8027 13.8027 14.8767 14.8767 21.1805 21.1805 k = 0.0000 0.5000 0.1527 ( 816 PWs) bands (ev): 8.6259 8.6259 8.7964 8.7964 10.4855 10.4855 10.8251 10.8251 11.0631 11.0631 11.1343 11.1343 11.2070 11.2070 11.3455 11.3455 12.6664 12.6664 13.0413 13.0413 13.7852 13.7852 14.8419 14.8419 21.0171 21.0171 k = 0.0000 0.5000 0.1607 ( 816 PWs) bands (ev): 8.6073 8.6073 8.7773 8.7773 10.5017 10.5017 10.8887 10.8887 11.0749 11.0749 11.1505 11.1505 11.2267 11.2267 11.3242 11.3242 12.6935 12.6935 13.0593 13.0593 13.7661 13.7661 14.8045 14.8045 20.8583 20.8583 k = 0.0000 0.5000 0.1688 ( 812 PWs) bands (ev): 8.5889 8.5889 8.7586 8.7586 10.5183 10.5183 10.9539 10.9539 11.0840 11.0840 11.1504 11.1504 11.2644 11.2644 11.3072 11.3072 12.7199 12.7199 13.0772 13.0772 13.7455 13.7455 14.7644 14.7644 20.7045 20.7045 k = 0.0000 0.5000 0.1768 ( 812 PWs) bands (ev): 8.5707 8.5707 8.7404 8.7404 10.5348 10.5348 11.0189 11.0189 11.0904 11.0904 11.1479 11.1479 11.2762 11.2762 11.3257 11.3257 12.7456 12.7456 13.0949 13.0949 13.7232 13.7232 14.7217 14.7217 20.5557 20.5557 k = 0.0000 0.5000 0.1848 ( 812 PWs) bands (ev): 8.5529 8.5529 8.7226 8.7226 10.5513 10.5513 11.0677 11.0677 11.1088 11.1088 11.1482 11.1482 11.2623 11.2623 11.3758 11.3758 12.7705 12.7705 13.1123 13.1123 13.6991 13.6991 14.6763 14.6763 20.4121 20.4121 k = 0.0000 0.5000 0.1929 ( 814 PWs) bands (ev): 8.5353 8.5353 8.7053 8.7053 10.5677 10.5677 11.0715 11.0715 11.1507 11.1507 11.1662 11.1662 11.2514 11.2514 11.4304 11.4304 12.7947 12.7947 13.1293 13.1293 13.6734 13.6734 14.6282 14.6282 20.2738 20.2738 k = 0.0000 0.5000 0.2009 ( 814 PWs) bands (ev): 8.5183 8.5183 8.6887 8.6887 10.5838 10.5838 11.0640 11.0640 11.1528 11.1528 11.2121 11.2121 11.2659 11.2659 11.4874 11.4874 12.8180 12.8180 13.1460 13.1460 13.6457 13.6457 14.5773 14.5773 20.1411 20.1411 k = 0.0000 0.5000 0.2089 ( 814 PWs) bands (ev): 8.5018 8.5018 8.6727 8.6727 10.5995 10.5995 11.0539 11.0539 11.1515 11.1515 11.2182 11.2182 11.3284 11.3284 11.5462 11.5462 12.8405 12.8405 13.1621 13.1621 13.6162 13.6162 14.5237 14.5237 20.0141 20.0141 k = 0.0000 0.5000 0.2170 ( 814 PWs) bands (ev): 8.4861 8.4861 8.6576 8.6576 10.6145 10.6145 11.0433 11.0433 11.1454 11.1454 11.2204 11.2204 11.4027 11.4027 11.6064 11.6064 12.8619 12.8619 13.1775 13.1775 13.5846 13.5846 14.4673 14.4673 19.8930 19.8930 k = 0.0000 0.5000 0.2250 ( 814 PWs) bands (ev): 8.4709 8.4709 8.6431 8.6431 10.6292 10.6292 11.0324 11.0324 11.1357 11.1357 11.2257 11.2257 11.4802 11.4802 11.6679 11.6679 12.8824 12.8824 13.1924 13.1924 13.5511 13.5511 14.4084 14.4084 19.7779 19.7779 k = 0.0000 0.5000 0.2330 ( 814 PWs) bands (ev): 8.4563 8.4563 8.6292 8.6292 10.6433 10.6433 11.0216 11.0216 11.1242 11.1242 11.2331 11.2331 11.5595 11.5595 11.7307 11.7307 12.9018 12.9018 13.2065 13.2065 13.5155 13.5155 14.3469 14.3469 19.6689 19.6689 k = 0.0000 0.5000 0.2411 ( 814 PWs) bands (ev): 8.4425 8.4425 8.6162 8.6162 10.6567 10.6567 11.0112 11.0112 11.1121 11.1121 11.2415 11.2415 11.6402 11.6402 11.7945 11.7945 12.9202 12.9202 13.2199 13.2199 13.4779 13.4779 14.2830 14.2830 19.5662 19.5662 k = 0.0000 0.5000 0.2491 ( 814 PWs) bands (ev): 8.4295 8.4295 8.6039 8.6039 10.6693 10.6693 11.0013 11.0013 11.1002 11.1002 11.2503 11.2503 11.7219 11.7219 11.8593 11.8593 12.9374 12.9374 13.2323 13.2323 13.4383 13.4383 14.2169 14.2169 19.4700 19.4700 k = 0.0000 0.5000 0.2571 ( 814 PWs) bands (ev): 8.4173 8.4173 8.5924 8.5924 10.6810 10.6810 10.9920 10.9920 11.0887 11.0887 11.2590 11.2590 11.8043 11.8043 11.9249 11.9249 12.9535 12.9535 13.2435 13.2435 13.3969 13.3969 14.1488 14.1488 19.3804 19.3804 k = 0.0000 0.5000 0.2652 ( 814 PWs) bands (ev): 8.4059 8.4059 8.5818 8.5818 10.6918 10.6918 10.9833 10.9833 11.0780 11.0780 11.2674 11.2674 11.8872 11.8872 11.9913 11.9913 12.9684 12.9684 13.2529 13.2529 13.3544 13.3544 14.0789 14.0789 19.2975 19.2975 k = 0.0000 0.5000 0.2732 ( 812 PWs) bands (ev): 8.3955 8.3955 8.5722 8.5722 10.7017 10.7017 10.9754 10.9754 11.0681 11.0681 11.2753 11.2753 11.9701 11.9701 12.0584 12.0584 12.9820 12.9820 13.2574 13.2574 13.3138 13.3138 14.0078 14.0078 19.2214 19.2214 k = 0.0000 0.5000 0.2813 ( 806 PWs) bands (ev): 8.3861 8.3861 8.5635 8.5635 10.7108 10.7108 10.9683 10.9683 11.0593 11.0593 11.2829 11.2829 12.0526 12.0526 12.1261 12.1261 12.9944 12.9944 13.2405 13.2405 13.2916 13.2916 13.9359 13.9359 19.1523 19.1523 k = 0.0000 0.5000 0.2893 ( 806 PWs) bands (ev): 8.3775 8.3775 8.5555 8.5555 10.7187 10.7187 10.9619 10.9619 11.0512 11.0512 11.2897 11.2897 12.1340 12.1340 12.1940 12.1940 13.0054 13.0054 13.1976 13.1976 13.2923 13.2923 13.8636 13.8636 19.0901 19.0901 k = 0.0000 0.5000 0.2973 ( 808 PWs) bands (ev): 8.3698 8.3698 8.5484 8.5484 10.7255 10.7255 10.9562 10.9562 11.0442 11.0442 11.2957 11.2957 12.2137 12.2137 12.2621 12.2621 13.0149 13.0149 13.1475 13.1475 13.2975 13.2975 13.7919 13.7919 19.0351 19.0351 k = 0.0000 0.5000 0.3054 ( 816 PWs) bands (ev): 8.3630 8.3630 8.5422 8.5422 10.7313 10.7313 10.9512 10.9512 11.0378 11.0378 11.3010 11.3010 12.2906 12.2906 12.3303 12.3303 13.0220 13.0220 13.0951 13.0951 13.3026 13.3026 13.7218 13.7218 18.9873 18.9873 k = 0.0000 0.5000 0.3134 ( 820 PWs) bands (ev): 8.3573 8.3573 8.5369 8.5369 10.7361 10.7361 10.9469 10.9469 11.0324 11.0324 11.3056 11.3056 12.3636 12.3636 12.3983 12.3983 13.0192 13.0192 13.0491 13.0491 13.3072 13.3072 13.6550 13.6550 18.9467 18.9467 k = 0.0000 0.5000 0.3214 ( 820 PWs) bands (ev): 8.3526 8.3526 8.5326 8.5326 10.7400 10.7400 10.9436 10.9436 11.0283 11.0283 11.3094 11.3094 12.4308 12.4308 12.4656 12.4656 12.9744 12.9744 13.0420 13.0420 13.3108 13.3108 13.5934 13.5934 18.9134 18.9134 k = 0.0000 0.5000 0.3295 ( 820 PWs) bands (ev): 8.3490 8.3490 8.5293 8.5293 10.7430 10.7430 10.9410 10.9410 11.0251 11.0251 11.3123 11.3123 12.4897 12.4897 12.5320 12.5320 12.9164 12.9164 13.0451 13.0451 13.3133 13.3133 13.5397 13.5397 18.8875 18.8875 k = 0.0000 0.5000 0.3375 ( 820 PWs) bands (ev): 8.3464 8.3464 8.5269 8.5269 10.7452 10.7452 10.9392 10.9392 11.0228 11.0228 11.3145 11.3145 12.5364 12.5364 12.5978 12.5978 12.8560 12.8560 13.0479 13.0479 13.3145 13.3145 13.4975 13.4975 18.8690 18.8690 k = 0.0000 0.5000 0.3455 ( 820 PWs) bands (ev): 8.3448 8.3448 8.5254 8.5254 10.7464 10.7464 10.9381 10.9381 11.0214 11.0214 11.3158 11.3158 12.5667 12.5667 12.6624 12.6624 12.7944 12.7944 13.0497 13.0497 13.3147 13.3147 13.4703 13.4703 18.8578 18.8578 k = 0.0000 0.5000 0.3536 ( 820 PWs) bands (ev): 8.3443 8.3443 8.5250 8.5250 10.7469 10.7469 10.9377 10.9377 11.0210 11.0210 11.3162 11.3162 12.5772 12.5772 12.7136 12.7136 12.7442 12.7442 13.0503 13.0503 13.3147 13.3147 13.4610 13.4610 18.8541 18.8541 k = 0.5000 0.5000-0.0000 ( 824 PWs) bands (ev): 8.4937 8.4937 8.5978 8.5978 9.1322 9.1322 9.1580 9.1580 12.6771 12.6771 12.7087 12.7087 13.2877 13.2877 13.2907 13.2907 13.3942 13.3942 13.9418 13.9418 15.3435 15.3435 15.3566 15.3566 22.1708 22.1708 k = 0.5000 0.5000 0.0080 ( 824 PWs) bands (ev): 8.4947 8.4947 8.5987 8.5987 9.1328 9.1328 9.1585 9.1585 12.6771 12.6771 12.7077 12.7077 13.2823 13.2823 13.2846 13.2846 13.3930 13.3930 13.9417 13.9417 15.3510 15.3510 15.3640 15.3640 22.1711 22.1711 k = 0.5000 0.5000 0.0161 ( 824 PWs) bands (ev): 8.4977 8.4977 8.6013 8.6013 9.1346 9.1346 9.1603 9.1603 12.6770 12.6770 12.7047 12.7047 13.2658 13.2658 13.2667 13.2667 13.3896 13.3896 13.9416 13.9416 15.3731 15.3731 15.3861 15.3861 22.1720 22.1720 k = 0.5000 0.5000 0.0241 ( 816 PWs) bands (ev): 8.5028 8.5028 8.6057 8.6057 9.1380 9.1380 9.1638 9.1638 12.6769 12.6769 12.6998 12.6998 13.2377 13.2377 13.2385 13.2385 13.3846 13.3846 13.9415 13.9415 15.4092 15.4092 15.4220 15.4220 22.1735 22.1735 k = 0.5000 0.5000 0.0321 ( 824 PWs) bands (ev): 8.5096 8.5096 8.6116 8.6116 9.1420 9.1420 9.1678 9.1678 12.6767 12.6767 12.6924 12.6924 13.1985 13.1985 13.2008 13.2008 13.3782 13.3782 13.9414 13.9414 15.4580 15.4580 15.4706 15.4706 22.1757 22.1757 k = 0.5000 0.5000 0.0402 ( 816 PWs) bands (ev): 8.5186 8.5186 8.6195 8.6195 9.1478 9.1478 9.1736 9.1736 12.6764 12.6764 12.6836 12.6836 13.1507 13.1507 13.1543 13.1543 13.3712 13.3712 13.9412 13.9412 15.5184 15.5184 15.5308 15.5308 22.1784 22.1784 k = 0.5000 0.5000 0.0482 ( 824 PWs) bands (ev): 8.5293 8.5293 8.6287 8.6287 9.1536 9.1536 9.1795 9.1795 12.6726 12.6726 12.6758 12.6758 13.0955 13.0955 13.0999 13.0999 13.3632 13.3632 13.9410 13.9410 15.5890 15.5890 15.6011 15.6011 22.1819 22.1819 k = 0.5000 0.5000 0.0563 ( 824 PWs) bands (ev): 8.5420 8.5420 8.6396 8.6396 9.1612 9.1612 9.1871 9.1871 12.6595 12.6595 12.6752 12.6752 13.0344 13.0344 13.0394 13.0394 13.3543 13.3543 13.9408 13.9408 15.6684 15.6684 15.6803 15.6803 22.1859 22.1859 k = 0.5000 0.5000 0.0643 ( 824 PWs) bands (ev): 8.5566 8.5566 8.6521 8.6521 9.1699 9.1699 9.1959 9.1959 12.6443 12.6443 12.6741 12.6741 12.9685 12.9685 12.9741 12.9741 13.3443 13.3443 13.9407 13.9407 15.7556 15.7556 15.7672 15.7672 22.1907 22.1907 k = 0.5000 0.5000 0.0723 ( 820 PWs) bands (ev): 8.5733 8.5733 8.6665 8.6665 9.1798 9.1798 9.2059 9.2059 12.6267 12.6267 12.6723 12.6723 12.8992 12.8992 12.9053 12.9053 13.3333 13.3333 13.9406 13.9406 15.8495 15.8495 15.8608 15.8608 22.1961 22.1961 k = 0.5000 0.5000 0.0804 ( 828 PWs) bands (ev): 8.5914 8.5914 8.6819 8.6819 9.1908 9.1908 9.2170 9.2170 12.6064 12.6064 12.6685 12.6685 12.8273 12.8273 12.8348 12.8348 13.3212 13.3212 13.9402 13.9402 15.9491 15.9491 15.9602 15.9602 22.2022 22.2022 k = 0.5000 0.5000 0.0884 ( 828 PWs) bands (ev): 8.6115 8.6115 8.6990 8.6990 9.2031 9.2031 9.2294 9.2294 12.5827 12.5827 12.6596 12.6596 12.7550 12.7550 12.7672 12.7672 13.3080 13.3080 13.9402 13.9402 16.0539 16.0539 16.0647 16.0647 22.2090 22.2090 k = 0.5000 0.5000 0.0964 ( 828 PWs) bands (ev): 8.6333 8.6333 8.7175 8.7175 9.2165 9.2165 9.2429 9.2429 12.5535 12.5535 12.6317 12.6317 12.6845 12.6845 12.7168 12.7168 13.2938 13.2938 13.9401 13.9401 16.1632 16.1632 16.1738 16.1738 22.2165 22.2165 k = 0.5000 0.5000 0.1045 ( 828 PWs) bands (ev): 8.6568 8.6568 8.7373 8.7373 9.2311 9.2311 9.2576 9.2576 12.5145 12.5145 12.5722 12.5722 12.6208 12.6208 12.6966 12.6966 13.2785 13.2785 13.9400 13.9400 16.2764 16.2764 16.2867 16.2867 22.2249 22.2249 k = 0.5000 0.5000 0.1125 ( 828 PWs) bands (ev): 8.6819 8.6819 8.7584 8.7584 9.2468 9.2468 9.2735 9.2735 12.4605 12.4605 12.4982 12.4982 12.5696 12.5696 12.6900 12.6900 13.2622 13.2622 13.9400 13.9400 16.3932 16.3932 16.4033 16.4033 22.2340 22.2340 k = 0.5000 0.5000 0.1205 ( 828 PWs) bands (ev): 8.7086 8.7086 8.7807 8.7807 9.2637 9.2637 9.2906 9.2906 12.3929 12.3929 12.4199 12.4199 12.5297 12.5297 12.6871 12.6871 13.2449 13.2449 13.9399 13.9399 16.5132 16.5132 16.5230 16.5230 22.2439 22.2439 k = 0.5000 0.5000 0.1286 ( 828 PWs) bands (ev): 8.7368 8.7368 8.8042 8.8042 9.2818 9.2818 9.3088 9.3088 12.3182 12.3182 12.3398 12.3398 12.4952 12.4952 12.6856 12.6856 13.2268 13.2268 13.9399 13.9399 16.6361 16.6361 16.6457 16.6457 22.2547 22.2547 k = 0.5000 0.5000 0.1366 ( 828 PWs) bands (ev): 8.7665 8.7665 8.8287 8.8287 9.3011 9.3011 9.3283 9.3283 12.2404 12.2404 12.2592 12.2592 12.4624 12.4624 12.6846 12.6846 13.2077 13.2077 13.9399 13.9399 16.7616 16.7616 16.7710 16.7710 22.2664 22.2664 k = 0.5000 0.5000 0.1446 ( 828 PWs) bands (ev): 8.7975 8.7975 8.8542 8.8542 9.3215 9.3215 9.3490 9.3490 12.1613 12.1613 12.1783 12.1783 12.4296 12.4296 12.6840 12.6840 13.1878 13.1878 13.9399 13.9399 16.8896 16.8896 16.8988 16.8988 22.2790 22.2790 k = 0.5000 0.5000 0.1527 ( 828 PWs) bands (ev): 8.8298 8.8298 8.8805 8.8805 9.3432 9.3432 9.3708 9.3708 12.0817 12.0817 12.0976 12.0976 12.3964 12.3964 12.6836 12.6836 13.1671 13.1671 13.9399 13.9399 17.0199 17.0199 17.0289 17.0289 22.2925 22.2925 k = 0.5000 0.5000 0.1607 ( 828 PWs) bands (ev): 8.8633 8.8633 8.9075 8.9075 9.3659 9.3659 9.3938 9.3938 12.0021 12.0021 12.0172 12.0172 12.3624 12.3624 12.6833 12.6833 13.1458 13.1458 13.9399 13.9399 17.1523 17.1523 17.1612 17.1612 22.3070 22.3070 k = 0.5000 0.5000 0.1688 ( 824 PWs) bands (ev): 8.8980 8.8980 8.9353 8.9353 9.3899 9.3899 9.4181 9.4181 11.9229 11.9229 11.9373 11.9373 12.3279 12.3279 12.6831 12.6831 13.1242 13.1242 13.9399 13.9399 17.2868 17.2868 17.2954 17.2954 22.3226 22.3226 k = 0.5000 0.5000 0.1768 ( 824 PWs) bands (ev): 8.9335 8.9335 8.9635 8.9635 9.4150 9.4150 9.4435 9.4435 11.8442 11.8442 11.8580 11.8580 12.2923 12.2923 12.6829 12.6829 13.1017 13.1017 13.9399 13.9399 17.4231 17.4231 17.4315 17.4315 22.3392 22.3392 k = 0.5000 0.5000 0.1848 ( 824 PWs) bands (ev): 8.9699 8.9699 8.9922 8.9922 9.4412 9.4412 9.4701 9.4701 11.7662 11.7662 11.7795 11.7795 12.2559 12.2559 12.6828 12.6828 13.0788 13.0788 13.9399 13.9399 17.5612 17.5612 17.5694 17.5694 22.3570 22.3570 k = 0.5000 0.5000 0.1929 ( 824 PWs) bands (ev): 9.0070 9.0070 9.0210 9.0210 9.4686 9.4686 9.4978 9.4978 11.6890 11.6890 11.7019 11.7019 12.2189 12.2189 12.6828 12.6828 13.0557 13.0557 13.9399 13.9399 17.7010 17.7010 17.7091 17.7091 22.3759 22.3759 k = 0.5000 0.5000 0.2009 ( 824 PWs) bands (ev): 9.0446 9.0446 9.0500 9.0500 9.4971 9.4971 9.5268 9.5268 11.6127 11.6127 11.6252 11.6252 12.1814 12.1814 12.6827 12.6827 13.0323 13.0323 13.9399 13.9399 17.8425 17.8425 17.8503 17.8503 22.3960 22.3960 k = 0.5000 0.5000 0.2089 ( 824 PWs) bands (ev): 9.0790 9.0790 9.0827 9.0827 9.5267 9.5267 9.5569 9.5569 11.5375 11.5375 11.5495 11.5495 12.1434 12.1434 12.6827 12.6827 13.0088 13.0088 13.9399 13.9399 17.9855 17.9855 17.9932 17.9932 22.4174 22.4174 k = 0.5000 0.5000 0.2170 ( 824 PWs) bands (ev): 9.1078 9.1078 9.1210 9.1210 9.5574 9.5574 9.5882 9.5882 11.4634 11.4634 11.4749 11.4749 12.1053 12.1053 12.6827 12.6827 12.9853 12.9853 13.9399 13.9399 18.1300 18.1300 18.1375 18.1375 22.4400 22.4400 k = 0.5000 0.5000 0.2250 ( 824 PWs) bands (ev): 9.1363 9.1363 9.1594 9.1594 9.5892 9.5892 9.6206 9.6206 11.3904 11.3904 11.4014 11.4014 12.0670 12.0670 12.6828 12.6828 12.9620 12.9620 13.9399 13.9399 18.2759 18.2759 18.2833 18.2833 22.4640 22.4640 k = 0.5000 0.5000 0.2330 ( 812 PWs) bands (ev): 9.1643 9.1643 9.1976 9.1976 9.6225 9.6225 9.6546 9.6546 11.3190 11.3190 11.3294 11.3294 12.0291 12.0291 12.6829 12.6829 12.9391 12.9391 13.9401 13.9401 18.4233 18.4233 18.4306 18.4306 22.4894 22.4894 k = 0.5000 0.5000 0.2411 ( 816 PWs) bands (ev): 9.1916 9.1916 9.2354 9.2354 9.6562 9.6562 9.6891 9.6891 11.2486 11.2486 11.2584 11.2584 11.9912 11.9912 12.6830 12.6830 12.9164 12.9164 13.9401 13.9401 18.5720 18.5720 18.5792 18.5792 22.5161 22.5161 k = 0.5000 0.5000 0.2491 ( 816 PWs) bands (ev): 9.2180 9.2180 9.2726 9.2726 9.6910 9.6910 9.7248 9.7248 11.1796 11.1796 11.1887 11.1887 11.9541 11.9541 12.6831 12.6831 12.8944 12.8944 13.9401 13.9401 18.7221 18.7221 18.7291 18.7291 22.5442 22.5443 k = 0.5000 0.5000 0.2571 ( 808 PWs) bands (ev): 9.2435 9.2435 9.3089 9.3089 9.7268 9.7268 9.7616 9.7616 11.1124 11.1124 11.1206 11.1206 11.9182 11.9182 12.6833 12.6833 12.8735 12.8735 13.9401 13.9401 18.8734 18.8734 18.8804 18.8804 22.5733 22.5733 k = 0.5000 0.5000 0.2652 ( 816 PWs) bands (ev): 9.2674 9.2674 9.3438 9.3438 9.7633 9.7633 9.7992 9.7992 11.0466 11.0466 11.0538 11.0538 11.8828 11.8828 12.6832 12.6832 12.8528 12.8528 13.9400 13.9400 19.0259 19.0259 19.0328 19.0328 22.5972 22.5973 k = 0.5000 0.5000 0.2732 ( 816 PWs) bands (ev): 9.2903 9.2903 9.3775 9.3775 9.8004 9.8004 9.8378 9.8378 10.9826 10.9826 10.9886 10.9886 11.8492 11.8492 12.6834 12.6834 12.8336 12.8336 13.9400 13.9400 19.1796 19.1796 19.1865 19.1865 22.4726 22.4729 k = 0.5000 0.5000 0.2813 ( 816 PWs) bands (ev): 9.3116 9.3116 9.4094 9.4094 9.8381 9.8381 9.8770 9.8770 10.9205 10.9205 10.9252 10.9252 11.8173 11.8173 12.6836 12.6836 12.8155 12.8155 13.9401 13.9401 19.3344 19.3344 19.3414 19.3414 22.3019 22.3020 k = 0.5000 0.5000 0.2893 ( 816 PWs) bands (ev): 9.3311 9.3311 9.4391 9.4391 9.8762 9.8762 9.9169 9.9169 10.8606 10.8606 10.8636 10.8636 11.7876 11.7876 12.6839 12.6839 12.7988 12.7988 13.9401 13.9401 19.4904 19.4904 19.4974 19.4974 22.1308 22.1310 k = 0.5000 0.5000 0.2973 ( 816 PWs) bands (ev): 9.3489 9.3489 9.4665 9.4665 9.9142 9.9142 9.9571 9.9571 10.8033 10.8033 10.8042 10.8042 11.7603 11.7603 12.6842 12.6842 12.7835 12.7835 13.9401 13.9401 19.6473 19.6473 19.6546 19.6546 21.9600 21.9600 k = 0.5000 0.5000 0.3054 ( 816 PWs) bands (ev): 9.3646 9.3646 9.4910 9.4910 9.9517 9.9517 9.9973 9.9973 10.7474 10.7474 10.7490 10.7490 11.7358 11.7358 12.6846 12.6846 12.7699 12.7699 13.9401 13.9401 19.8053 19.8053 19.8128 19.8128 21.7897 21.7897 k = 0.5000 0.5000 0.3134 ( 816 PWs) bands (ev): 9.3781 9.3781 9.5125 9.5125 9.9880 9.9880 10.0368 10.0368 10.6938 10.6938 10.6984 10.6984 11.7144 11.7144 12.6850 12.6850 12.7580 12.7580 13.9401 13.9401 19.9641 19.9641 19.9721 19.9721 21.6202 21.6202 k = 0.5000 0.5000 0.3214 ( 816 PWs) bands (ev): 9.3893 9.3893 9.5305 9.5305 10.0222 10.0222 10.0748 10.0748 10.6443 10.6443 10.6525 10.6525 11.6963 11.6963 12.6855 12.6855 12.7480 12.7480 13.9401 13.9401 20.1237 20.1237 20.1325 20.1325 21.4515 21.4515 k = 0.5000 0.5000 0.3295 ( 816 PWs) bands (ev): 9.3982 9.3982 9.5449 9.5449 10.0528 10.0528 10.1096 10.1096 10.6004 10.6004 10.6129 10.6129 11.6820 11.6820 12.6861 12.6861 12.7399 12.7399 13.9401 13.9401 20.2835 20.2835 20.2939 20.2939 21.2837 21.2837 k = 0.5000 0.5000 0.3375 ( 816 PWs) bands (ev): 9.4046 9.4046 9.5553 9.5553 10.0776 10.0776 10.1390 10.1390 10.5647 10.5647 10.5816 10.5816 11.6716 11.6716 12.6865 12.6865 12.7340 12.7340 13.9401 13.9401 20.4426 20.4426 20.4562 20.4562 21.1167 21.1167 k = 0.5000 0.5000 0.3455 ( 824 PWs) bands (ev): 9.4084 9.4084 9.5616 9.5616 10.0938 10.0938 10.1590 10.1590 10.5404 10.5404 10.5610 10.5610 11.6652 11.6652 12.6866 12.6866 12.7304 12.7304 13.9399 13.9399 20.5963 20.5963 20.6190 20.6190 20.9510 20.9510 k = 0.5000 0.5000 0.3536 ( 824 PWs) bands (ev): 9.4097 9.4097 9.5638 9.5638 10.0997 10.0997 10.1664 10.1664 10.5317 10.5317 10.5539 10.5539 11.6631 11.6631 12.6867 12.6867 12.7291 12.7291 13.9399 13.9399 20.6962 20.6962 20.7653 20.7653 20.8039 20.8039 Writing output data file FeNi.save init_run : 0.12s CPU 0.40s WALL ( 1 calls) electrons : 58.18s CPU 60.25s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.00s CPU 0.17s WALL ( 1 calls) Called by electrons: c_bands : 58.18s CPU 60.24s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.02s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.02s WALL ( 569 calls) cegterg : 52.94s CPU 54.18s WALL ( 770 calls) Called by sum_band: Called by *egterg: h_psi : 20.06s CPU 20.73s WALL ( 12763 calls) s_psi : 1.20s CPU 1.36s WALL ( 12763 calls) g_psi : 0.04s CPU 0.04s WALL ( 11424 calls) cdiaghg : 30.58s CPU 31.30s WALL ( 11993 calls) cegterg:over : 1.59s CPU 1.59s WALL ( 11424 calls) cegterg:upda : 1.16s CPU 1.17s WALL ( 11424 calls) cegterg:last : 0.54s CPU 0.52s WALL ( 1869 calls) cdiaghg:chol : 1.58s CPU 1.60s WALL ( 11993 calls) cdiaghg:inve : 0.50s CPU 0.52s WALL ( 11993 calls) cdiaghg:para : 2.04s CPU 2.08s WALL ( 23986 calls) Called by h_psi: h_psi:vloc : 16.97s CPU 17.63s WALL ( 12763 calls) h_psi:vnl : 3.04s CPU 3.05s WALL ( 12763 calls) add_vuspsi : 1.63s CPU 1.76s WALL ( 12763 calls) General routines calbec : 1.36s CPU 1.26s WALL ( 12763 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 16.10s CPU 16.78s WALL ( 618108 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.11s CPU 0.45s WALL ( 1138 calls) Parallel routines fft_scatter : 9.84s CPU 10.55s WALL ( 618131 calls) PWSCF : 1m 7.71s CPU 1m25.75s WALL This run was terminated on: 18:12:20 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=