Program PWSCF v.5.4.0 starts on 20Mar2017 at 21:15:24 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 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: ./BiIO.save/ file Bi.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5D 5D renormalized file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 28 11 3 2234 579 91 Max 29 12 4 2251 604 104 Sum 2069 853 249 161337 42663 6881 bravais-lattice index = 14 lattice parameter (alat) = 7.5306 a.u. unit-cell volume = 978.3097 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 457.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.530558 celldm(2)= 1.000000 celldm(3)= 2.290841 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 2.290841 ) 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 0.436521 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Bi read from file: /users/gautes/Pseudo/Bi.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 2a6cbf750f457e6adc9554330ec86bb0 Pseudo is Ultrasoft + core correction, Zval = 15.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1283 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for I read from file: /users/gautes/Pseudo/I.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 7c65668ffc3f6431347fa26e98076fd5 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1247 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 O 6.00 15.99940 O( 1.00) Bi 15.00 208.98040 Bi( 1.00) I 7.00 126.90450 I( 1.00) 16 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 335 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0029851 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0029851 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0029851 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0029851 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0029851 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0029851 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0029851 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0029851 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0029851 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0029851 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0029851 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0029851 k( 14) = ( 0.0000000 0.1625000 -0.0000000), wk = 0.0029851 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0029851 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0029851 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0029851 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0029851 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0029851 k( 20) = ( 0.0000000 0.2375000 -0.0000000), wk = 0.0029851 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0029851 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0029851 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0029851 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0029851 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0029851 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0029851 k( 27) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0029851 k( 28) = ( 0.0000000 0.3375000 -0.0000000), wk = 0.0029851 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0029851 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0029851 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0029851 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0029851 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0029851 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0029851 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0029851 k( 36) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0029851 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0029851 k( 38) = ( 0.0000000 0.4625000 -0.0000000), wk = 0.0029851 k( 39) = ( 0.0000000 0.4750000 -0.0000000), wk = 0.0029851 k( 40) = ( 0.0000000 0.4875000 -0.0000000), wk = 0.0029851 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029851 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029851 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0029851 k( 44) = ( 0.0250000 0.5000000 -0.0000000), wk = 0.0029851 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0029851 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0029851 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0029851 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0029851 k( 49) = ( 0.0875000 0.5000000 -0.0000000), wk = 0.0029851 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0029851 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0029851 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0029851 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0029851 k( 54) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0029851 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0029851 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0029851 k( 57) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0029851 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0029851 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0029851 k( 60) = ( 0.2250000 0.5000000 -0.0000000), wk = 0.0029851 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0029851 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0029851 k( 63) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0029851 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0029851 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0029851 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0029851 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0029851 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0029851 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0029851 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0029851 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0029851 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0029851 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0029851 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0029851 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0029851 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0029851 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0029851 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0029851 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0029851 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0029851 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0029851 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029851 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029851 k( 84) = ( 0.4910714 0.4910714 -0.0000000), wk = 0.0029851 k( 85) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0029851 k( 86) = ( 0.4732143 0.4732143 -0.0000000), wk = 0.0029851 k( 87) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0029851 k( 88) = ( 0.4553571 0.4553571 -0.0000000), wk = 0.0029851 k( 89) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0029851 k( 90) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0029851 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0029851 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0029851 k( 93) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0029851 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0029851 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0029851 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0029851 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0029851 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0029851 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0029851 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0029851 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0029851 k( 102) = ( 0.3303571 0.3303571 -0.0000000), wk = 0.0029851 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0029851 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0029851 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0029851 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0029851 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0029851 k( 108) = ( 0.2767857 0.2767857 -0.0000000), wk = 0.0029851 k( 109) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0029851 k( 110) = ( 0.2589286 0.2589286 -0.0000000), wk = 0.0029851 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0029851 k( 112) = ( 0.2410714 0.2410714 -0.0000000), wk = 0.0029851 k( 113) = ( 0.2321429 0.2321429 -0.0000000), wk = 0.0029851 k( 114) = ( 0.2232143 0.2232143 -0.0000000), wk = 0.0029851 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0029851 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0029851 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0029851 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0029851 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0029851 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0029851 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0029851 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0029851 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0029851 k( 124) = ( 0.1339286 0.1339286 -0.0000000), wk = 0.0029851 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0029851 k( 126) = ( 0.1160714 0.1160714 -0.0000000), wk = 0.0029851 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0029851 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0029851 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0029851 k( 130) = ( 0.0803571 0.0803571 -0.0000000), wk = 0.0029851 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0029851 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0029851 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0029851 k( 134) = ( 0.0446429 0.0446429 -0.0000000), wk = 0.0029851 k( 135) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0029851 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0029851 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0029851 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0029851 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 141) = ( 0.0000000 0.0000000 0.0121256), wk = 0.0029851 k( 142) = ( 0.0000000 0.0000000 0.0242512), wk = 0.0029851 k( 143) = ( 0.0000000 0.0000000 0.0363767), wk = 0.0029851 k( 144) = ( 0.0000000 0.0000000 0.0485023), wk = 0.0029851 k( 145) = ( 0.0000000 0.0000000 0.0606279), wk = 0.0029851 k( 146) = ( 0.0000000 0.0000000 0.0727535), wk = 0.0029851 k( 147) = ( 0.0000000 0.0000000 0.0848791), wk = 0.0029851 k( 148) = ( 0.0000000 0.0000000 0.0970047), wk = 0.0029851 k( 149) = ( 0.0000000 0.0000000 0.1091302), wk = 0.0029851 k( 150) = ( 0.0000000 0.0000000 0.1212558), wk = 0.0029851 k( 151) = ( 0.0000000 0.0000000 0.1333814), wk = 0.0029851 k( 152) = ( 0.0000000 0.0000000 0.1455070), wk = 0.0029851 k( 153) = ( 0.0000000 0.0000000 0.1576326), wk = 0.0029851 k( 154) = ( 0.0000000 0.0000000 0.1697582), wk = 0.0029851 k( 155) = ( 0.0000000 0.0000000 0.1818837), wk = 0.0029851 k( 156) = ( 0.0000000 0.0000000 0.1940093), wk = 0.0029851 k( 157) = ( 0.0000000 0.0000000 0.2061349), wk = 0.0029851 k( 158) = ( 0.0000000 0.0000000 0.2182605), wk = 0.0029851 k( 159) = ( 0.0000000 0.0000000 0.2182605), wk = 0.0029851 k( 160) = ( 0.0000000 0.0125000 0.2182605), wk = 0.0029851 k( 161) = ( 0.0000000 0.0250000 0.2182605), wk = 0.0029851 k( 162) = ( 0.0000000 0.0375000 0.2182605), wk = 0.0029851 k( 163) = ( 0.0000000 0.0500000 0.2182605), wk = 0.0029851 k( 164) = ( 0.0000000 0.0625000 0.2182605), wk = 0.0029851 k( 165) = ( 0.0000000 0.0750000 0.2182605), wk = 0.0029851 k( 166) = ( 0.0000000 0.0875000 0.2182605), wk = 0.0029851 k( 167) = ( 0.0000000 0.1000000 0.2182605), wk = 0.0029851 k( 168) = ( 0.0000000 0.1125000 0.2182605), wk = 0.0029851 k( 169) = ( 0.0000000 0.1250000 0.2182605), wk = 0.0029851 k( 170) = ( 0.0000000 0.1375000 0.2182605), wk = 0.0029851 k( 171) = ( 0.0000000 0.1500000 0.2182605), wk = 0.0029851 k( 172) = ( 0.0000000 0.1625000 0.2182605), wk = 0.0029851 k( 173) = ( 0.0000000 0.1750000 0.2182605), wk = 0.0029851 k( 174) = ( 0.0000000 0.1875000 0.2182605), wk = 0.0029851 k( 175) = ( 0.0000000 0.2000000 0.2182605), wk = 0.0029851 k( 176) = ( 0.0000000 0.2125000 0.2182605), wk = 0.0029851 k( 177) = ( 0.0000000 0.2250000 0.2182605), wk = 0.0029851 k( 178) = ( 0.0000000 0.2375000 0.2182605), wk = 0.0029851 k( 179) = ( 0.0000000 0.2500000 0.2182605), wk = 0.0029851 k( 180) = ( 0.0000000 0.2625000 0.2182605), wk = 0.0029851 k( 181) = ( 0.0000000 0.2750000 0.2182605), wk = 0.0029851 k( 182) = ( 0.0000000 0.2875000 0.2182605), wk = 0.0029851 k( 183) = ( 0.0000000 0.3000000 0.2182605), wk = 0.0029851 k( 184) = ( 0.0000000 0.3125000 0.2182605), wk = 0.0029851 k( 185) = ( 0.0000000 0.3250000 0.2182605), wk = 0.0029851 k( 186) = ( 0.0000000 0.3375000 0.2182605), wk = 0.0029851 k( 187) = ( 0.0000000 0.3500000 0.2182605), wk = 0.0029851 k( 188) = ( 0.0000000 0.3625000 0.2182605), wk = 0.0029851 k( 189) = ( 0.0000000 0.3750000 0.2182605), wk = 0.0029851 k( 190) = ( 0.0000000 0.3875000 0.2182605), wk = 0.0029851 k( 191) = ( 0.0000000 0.4000000 0.2182605), wk = 0.0029851 k( 192) = ( 0.0000000 0.4125000 0.2182605), wk = 0.0029851 k( 193) = ( 0.0000000 0.4250000 0.2182605), wk = 0.0029851 k( 194) = ( 0.0000000 0.4375000 0.2182605), wk = 0.0029851 k( 195) = ( 0.0000000 0.4500000 0.2182605), wk = 0.0029851 k( 196) = ( 0.0000000 0.4625000 0.2182605), wk = 0.0029851 k( 197) = ( 0.0000000 0.4750000 0.2182605), wk = 0.0029851 k( 198) = ( 0.0000000 0.4875000 0.2182605), wk = 0.0029851 k( 199) = ( 0.0000000 0.5000000 0.2182605), wk = 0.0029851 k( 200) = ( 0.0000000 0.5000000 0.2182605), wk = 0.0029851 k( 201) = ( 0.0125000 0.5000000 0.2182605), wk = 0.0029851 k( 202) = ( 0.0250000 0.5000000 0.2182605), wk = 0.0029851 k( 203) = ( 0.0375000 0.5000000 0.2182605), wk = 0.0029851 k( 204) = ( 0.0500000 0.5000000 0.2182605), wk = 0.0029851 k( 205) = ( 0.0625000 0.5000000 0.2182605), wk = 0.0029851 k( 206) = ( 0.0750000 0.5000000 0.2182605), wk = 0.0029851 k( 207) = ( 0.0875000 0.5000000 0.2182605), wk = 0.0029851 k( 208) = ( 0.1000000 0.5000000 0.2182605), wk = 0.0029851 k( 209) = ( 0.1125000 0.5000000 0.2182605), wk = 0.0029851 k( 210) = ( 0.1250000 0.5000000 0.2182605), wk = 0.0029851 k( 211) = ( 0.1375000 0.5000000 0.2182605), wk = 0.0029851 k( 212) = ( 0.1500000 0.5000000 0.2182605), wk = 0.0029851 k( 213) = ( 0.1625000 0.5000000 0.2182605), wk = 0.0029851 k( 214) = ( 0.1750000 0.5000000 0.2182605), wk = 0.0029851 k( 215) = ( 0.1875000 0.5000000 0.2182605), wk = 0.0029851 k( 216) = ( 0.2000000 0.5000000 0.2182605), wk = 0.0029851 k( 217) = ( 0.2125000 0.5000000 0.2182605), wk = 0.0029851 k( 218) = ( 0.2250000 0.5000000 0.2182605), wk = 0.0029851 k( 219) = ( 0.2375000 0.5000000 0.2182605), wk = 0.0029851 k( 220) = ( 0.2500000 0.5000000 0.2182605), wk = 0.0029851 k( 221) = ( 0.2625000 0.5000000 0.2182605), wk = 0.0029851 k( 222) = ( 0.2750000 0.5000000 0.2182605), wk = 0.0029851 k( 223) = ( 0.2875000 0.5000000 0.2182605), wk = 0.0029851 k( 224) = ( 0.3000000 0.5000000 0.2182605), wk = 0.0029851 k( 225) = ( 0.3125000 0.5000000 0.2182605), wk = 0.0029851 k( 226) = ( 0.3250000 0.5000000 0.2182605), wk = 0.0029851 k( 227) = ( 0.3375000 0.5000000 0.2182605), wk = 0.0029851 k( 228) = ( 0.3500000 0.5000000 0.2182605), wk = 0.0029851 k( 229) = ( 0.3625000 0.5000000 0.2182605), wk = 0.0029851 k( 230) = ( 0.3750000 0.5000000 0.2182605), wk = 0.0029851 k( 231) = ( 0.3875000 0.5000000 0.2182605), wk = 0.0029851 k( 232) = ( 0.4000000 0.5000000 0.2182605), wk = 0.0029851 k( 233) = ( 0.4125000 0.5000000 0.2182605), wk = 0.0029851 k( 234) = ( 0.4250000 0.5000000 0.2182605), wk = 0.0029851 k( 235) = ( 0.4375000 0.5000000 0.2182605), wk = 0.0029851 k( 236) = ( 0.4500000 0.5000000 0.2182605), wk = 0.0029851 k( 237) = ( 0.4625000 0.5000000 0.2182605), wk = 0.0029851 k( 238) = ( 0.4750000 0.5000000 0.2182605), wk = 0.0029851 k( 239) = ( 0.4875000 0.5000000 0.2182605), wk = 0.0029851 k( 240) = ( 0.5000000 0.5000000 0.2182605), wk = 0.0029851 k( 241) = ( 0.5000000 0.5000000 0.2182605), wk = 0.0029851 k( 242) = ( 0.4910714 0.4910714 0.2182605), wk = 0.0029851 k( 243) = ( 0.4821429 0.4821429 0.2182605), wk = 0.0029851 k( 244) = ( 0.4732143 0.4732143 0.2182605), wk = 0.0029851 k( 245) = ( 0.4642857 0.4642857 0.2182605), wk = 0.0029851 k( 246) = ( 0.4553571 0.4553571 0.2182605), wk = 0.0029851 k( 247) = ( 0.4464286 0.4464286 0.2182605), wk = 0.0029851 k( 248) = ( 0.4375000 0.4375000 0.2182605), wk = 0.0029851 k( 249) = ( 0.4285714 0.4285714 0.2182605), wk = 0.0029851 k( 250) = ( 0.4196429 0.4196429 0.2182605), wk = 0.0029851 k( 251) = ( 0.4107143 0.4107143 0.2182605), wk = 0.0029851 k( 252) = ( 0.4017857 0.4017857 0.2182605), wk = 0.0029851 k( 253) = ( 0.3928571 0.3928571 0.2182605), wk = 0.0029851 k( 254) = ( 0.3839286 0.3839286 0.2182605), wk = 0.0029851 k( 255) = ( 0.3750000 0.3750000 0.2182605), wk = 0.0029851 k( 256) = ( 0.3660714 0.3660714 0.2182605), wk = 0.0029851 k( 257) = ( 0.3571429 0.3571429 0.2182605), wk = 0.0029851 k( 258) = ( 0.3482143 0.3482143 0.2182605), wk = 0.0029851 k( 259) = ( 0.3392857 0.3392857 0.2182605), wk = 0.0029851 k( 260) = ( 0.3303571 0.3303571 0.2182605), wk = 0.0029851 k( 261) = ( 0.3214286 0.3214286 0.2182605), wk = 0.0029851 k( 262) = ( 0.3125000 0.3125000 0.2182605), wk = 0.0029851 k( 263) = ( 0.3035714 0.3035714 0.2182605), wk = 0.0029851 k( 264) = ( 0.2946429 0.2946429 0.2182605), wk = 0.0029851 k( 265) = ( 0.2857143 0.2857143 0.2182605), wk = 0.0029851 k( 266) = ( 0.2767857 0.2767857 0.2182605), wk = 0.0029851 k( 267) = ( 0.2678571 0.2678571 0.2182605), wk = 0.0029851 k( 268) = ( 0.2589286 0.2589286 0.2182605), wk = 0.0029851 k( 269) = ( 0.2500000 0.2500000 0.2182605), wk = 0.0029851 k( 270) = ( 0.2410714 0.2410714 0.2182605), wk = 0.0029851 k( 271) = ( 0.2321429 0.2321429 0.2182605), wk = 0.0029851 k( 272) = ( 0.2232143 0.2232143 0.2182605), wk = 0.0029851 k( 273) = ( 0.2142857 0.2142857 0.2182605), wk = 0.0029851 k( 274) = ( 0.2053571 0.2053571 0.2182605), wk = 0.0029851 k( 275) = ( 0.1964286 0.1964286 0.2182605), wk = 0.0029851 k( 276) = ( 0.1875000 0.1875000 0.2182605), wk = 0.0029851 k( 277) = ( 0.1785714 0.1785714 0.2182605), wk = 0.0029851 k( 278) = ( 0.1696429 0.1696429 0.2182605), wk = 0.0029851 k( 279) = ( 0.1607143 0.1607143 0.2182605), wk = 0.0029851 k( 280) = ( 0.1517857 0.1517857 0.2182605), wk = 0.0029851 k( 281) = ( 0.1428571 0.1428571 0.2182605), wk = 0.0029851 k( 282) = ( 0.1339286 0.1339286 0.2182605), wk = 0.0029851 k( 283) = ( 0.1250000 0.1250000 0.2182605), wk = 0.0029851 k( 284) = ( 0.1160714 0.1160714 0.2182605), wk = 0.0029851 k( 285) = ( 0.1071429 0.1071429 0.2182605), wk = 0.0029851 k( 286) = ( 0.0982143 0.0982143 0.2182605), wk = 0.0029851 k( 287) = ( 0.0892857 0.0892857 0.2182605), wk = 0.0029851 k( 288) = ( 0.0803571 0.0803571 0.2182605), wk = 0.0029851 k( 289) = ( 0.0714286 0.0714286 0.2182605), wk = 0.0029851 k( 290) = ( 0.0625000 0.0625000 0.2182605), wk = 0.0029851 k( 291) = ( 0.0535714 0.0535714 0.2182605), wk = 0.0029851 k( 292) = ( 0.0446429 0.0446429 0.2182605), wk = 0.0029851 k( 293) = ( 0.0357143 0.0357143 0.2182605), wk = 0.0029851 k( 294) = ( 0.0267857 0.0267857 0.2182605), wk = 0.0029851 k( 295) = ( 0.0178571 0.0178571 0.2182605), wk = 0.0029851 k( 296) = ( 0.0089286 0.0089286 0.2182605), wk = 0.0029851 k( 297) = ( 0.0000000 0.0000000 0.2182605), wk = 0.0029851 k( 298) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029851 k( 299) = ( 0.0000000 0.5000000 0.0121256), wk = 0.0029851 k( 300) = ( 0.0000000 0.5000000 0.0242512), wk = 0.0029851 k( 301) = ( 0.0000000 0.5000000 0.0363767), wk = 0.0029851 k( 302) = ( 0.0000000 0.5000000 0.0485023), wk = 0.0029851 k( 303) = ( 0.0000000 0.5000000 0.0606279), wk = 0.0029851 k( 304) = ( 0.0000000 0.5000000 0.0727535), wk = 0.0029851 k( 305) = ( 0.0000000 0.5000000 0.0848791), wk = 0.0029851 k( 306) = ( 0.0000000 0.5000000 0.0970047), wk = 0.0029851 k( 307) = ( 0.0000000 0.5000000 0.1091302), wk = 0.0029851 k( 308) = ( 0.0000000 0.5000000 0.1212558), wk = 0.0029851 k( 309) = ( 0.0000000 0.5000000 0.1333814), wk = 0.0029851 k( 310) = ( 0.0000000 0.5000000 0.1455070), wk = 0.0029851 k( 311) = ( 0.0000000 0.5000000 0.1576326), wk = 0.0029851 k( 312) = ( 0.0000000 0.5000000 0.1697582), wk = 0.0029851 k( 313) = ( 0.0000000 0.5000000 0.1818837), wk = 0.0029851 k( 314) = ( 0.0000000 0.5000000 0.1940093), wk = 0.0029851 k( 315) = ( 0.0000000 0.5000000 0.2061349), wk = 0.0029851 k( 316) = ( 0.0000000 0.5000000 0.2182605), wk = 0.0029851 k( 317) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029851 k( 318) = ( 0.5000000 0.5000000 0.0121256), wk = 0.0029851 k( 319) = ( 0.5000000 0.5000000 0.0242512), wk = 0.0029851 k( 320) = ( 0.5000000 0.5000000 0.0363767), wk = 0.0029851 k( 321) = ( 0.5000000 0.5000000 0.0485023), wk = 0.0029851 k( 322) = ( 0.5000000 0.5000000 0.0606279), wk = 0.0029851 k( 323) = ( 0.5000000 0.5000000 0.0727535), wk = 0.0029851 k( 324) = ( 0.5000000 0.5000000 0.0848791), wk = 0.0029851 k( 325) = ( 0.5000000 0.5000000 0.0970047), wk = 0.0029851 k( 326) = ( 0.5000000 0.5000000 0.1091302), wk = 0.0029851 k( 327) = ( 0.5000000 0.5000000 0.1212558), wk = 0.0029851 k( 328) = ( 0.5000000 0.5000000 0.1333814), wk = 0.0029851 k( 329) = ( 0.5000000 0.5000000 0.1455070), wk = 0.0029851 k( 330) = ( 0.5000000 0.5000000 0.1576326), wk = 0.0029851 k( 331) = ( 0.5000000 0.5000000 0.1697582), wk = 0.0029851 k( 332) = ( 0.5000000 0.5000000 0.1818837), wk = 0.0029851 k( 333) = ( 0.5000000 0.5000000 0.1940093), wk = 0.0029851 k( 334) = ( 0.5000000 0.5000000 0.2061349), wk = 0.0029851 k( 335) = ( 0.5000000 0.5000000 0.2182605), wk = 0.0029851 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0029851 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0029851 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0029851 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0029851 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0029851 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0029851 k( 8) = ( 0.0000000 0.0875000 0.0000000), wk = 0.0029851 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0029851 k( 10) = ( 0.0000000 0.1125000 0.0000000), wk = 0.0029851 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0029851 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0029851 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0029851 k( 14) = ( 0.0000000 0.1625000 0.0000000), wk = 0.0029851 k( 15) = ( 0.0000000 0.1750000 0.0000000), wk = 0.0029851 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0029851 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0029851 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0029851 k( 19) = ( 0.0000000 0.2250000 0.0000000), wk = 0.0029851 k( 20) = ( 0.0000000 0.2375000 0.0000000), wk = 0.0029851 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0029851 k( 22) = ( 0.0000000 0.2625000 0.0000000), wk = 0.0029851 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0029851 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0029851 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0029851 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0029851 k( 27) = ( 0.0000000 0.3250000 0.0000000), wk = 0.0029851 k( 28) = ( 0.0000000 0.3375000 0.0000000), wk = 0.0029851 k( 29) = ( 0.0000000 0.3500000 0.0000000), wk = 0.0029851 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0029851 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0029851 k( 32) = ( 0.0000000 0.3875000 0.0000000), wk = 0.0029851 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0029851 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0029851 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0029851 k( 36) = ( 0.0000000 0.4375000 0.0000000), wk = 0.0029851 k( 37) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0029851 k( 38) = ( 0.0000000 0.4625000 0.0000000), wk = 0.0029851 k( 39) = ( 0.0000000 0.4750000 0.0000000), wk = 0.0029851 k( 40) = ( 0.0000000 0.4875000 0.0000000), wk = 0.0029851 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029851 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029851 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0029851 k( 44) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0029851 k( 45) = ( 0.0375000 0.5000000 0.0000000), wk = 0.0029851 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0029851 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0029851 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0029851 k( 49) = ( 0.0875000 0.5000000 0.0000000), wk = 0.0029851 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0029851 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0029851 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0029851 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0029851 k( 54) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0029851 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0029851 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0029851 k( 57) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0029851 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0029851 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0029851 k( 60) = ( 0.2250000 0.5000000 0.0000000), wk = 0.0029851 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0029851 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0029851 k( 63) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0029851 k( 64) = ( 0.2750000 0.5000000 0.0000000), wk = 0.0029851 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0029851 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0029851 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0029851 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0029851 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0029851 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0029851 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0029851 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0029851 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0029851 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0029851 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0029851 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0029851 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0029851 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0029851 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0029851 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0029851 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0029851 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029851 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029851 k( 84) = ( 0.4910714 0.4910714 -0.0000000), wk = 0.0029851 k( 85) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0029851 k( 86) = ( 0.4732143 0.4732143 -0.0000000), wk = 0.0029851 k( 87) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0029851 k( 88) = ( 0.4553571 0.4553571 0.0000000), wk = 0.0029851 k( 89) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0029851 k( 90) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0029851 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0029851 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0029851 k( 93) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0029851 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0029851 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0029851 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0029851 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0029851 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0029851 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0029851 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0029851 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0029851 k( 102) = ( 0.3303571 0.3303571 0.0000000), wk = 0.0029851 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0029851 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0029851 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0029851 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0029851 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0029851 k( 108) = ( 0.2767857 0.2767857 0.0000000), wk = 0.0029851 k( 109) = ( 0.2678571 0.2678571 0.0000000), wk = 0.0029851 k( 110) = ( 0.2589286 0.2589286 -0.0000000), wk = 0.0029851 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0029851 k( 112) = ( 0.2410714 0.2410714 -0.0000000), wk = 0.0029851 k( 113) = ( 0.2321429 0.2321429 -0.0000000), wk = 0.0029851 k( 114) = ( 0.2232143 0.2232143 -0.0000000), wk = 0.0029851 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0029851 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0029851 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0029851 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0029851 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0029851 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0029851 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0029851 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0029851 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0029851 k( 124) = ( 0.1339286 0.1339286 0.0000000), wk = 0.0029851 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0029851 k( 126) = ( 0.1160714 0.1160714 -0.0000000), wk = 0.0029851 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0029851 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0029851 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0029851 k( 130) = ( 0.0803571 0.0803571 0.0000000), wk = 0.0029851 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0029851 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0029851 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0029851 k( 134) = ( 0.0446429 0.0446429 -0.0000000), wk = 0.0029851 k( 135) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0029851 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0029851 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0029851 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0029851 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 141) = ( 0.0000000 0.0000000 0.0277778), wk = 0.0029851 k( 142) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0029851 k( 143) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0029851 k( 144) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0029851 k( 145) = ( 0.0000000 0.0000000 0.1388889), wk = 0.0029851 k( 146) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0029851 k( 147) = ( 0.0000000 0.0000000 0.1944444), wk = 0.0029851 k( 148) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0029851 k( 149) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0029851 k( 150) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0029851 k( 151) = ( 0.0000000 0.0000000 0.3055556), wk = 0.0029851 k( 152) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0029851 k( 153) = ( 0.0000000 0.0000000 0.3611111), wk = 0.0029851 k( 154) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0029851 k( 155) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0029851 k( 156) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0029851 k( 157) = ( 0.0000000 0.0000000 0.4722222), wk = 0.0029851 k( 158) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029851 k( 159) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029851 k( 160) = ( 0.0000000 0.0125000 0.5000000), wk = 0.0029851 k( 161) = ( 0.0000000 0.0250000 0.5000000), wk = 0.0029851 k( 162) = ( 0.0000000 0.0375000 0.5000000), wk = 0.0029851 k( 163) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0029851 k( 164) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0029851 k( 165) = ( 0.0000000 0.0750000 0.5000000), wk = 0.0029851 k( 166) = ( 0.0000000 0.0875000 0.5000000), wk = 0.0029851 k( 167) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0029851 k( 168) = ( 0.0000000 0.1125000 0.5000000), wk = 0.0029851 k( 169) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0029851 k( 170) = ( 0.0000000 0.1375000 0.5000000), wk = 0.0029851 k( 171) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0029851 k( 172) = ( 0.0000000 0.1625000 0.5000000), wk = 0.0029851 k( 173) = ( 0.0000000 0.1750000 0.5000000), wk = 0.0029851 k( 174) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0029851 k( 175) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0029851 k( 176) = ( 0.0000000 0.2125000 0.5000000), wk = 0.0029851 k( 177) = ( 0.0000000 0.2250000 0.5000000), wk = 0.0029851 k( 178) = ( 0.0000000 0.2375000 0.5000000), wk = 0.0029851 k( 179) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0029851 k( 180) = ( 0.0000000 0.2625000 0.5000000), wk = 0.0029851 k( 181) = ( 0.0000000 0.2750000 0.5000000), wk = 0.0029851 k( 182) = ( 0.0000000 0.2875000 0.5000000), wk = 0.0029851 k( 183) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0029851 k( 184) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0029851 k( 185) = ( 0.0000000 0.3250000 0.5000000), wk = 0.0029851 k( 186) = ( 0.0000000 0.3375000 0.5000000), wk = 0.0029851 k( 187) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0029851 k( 188) = ( 0.0000000 0.3625000 0.5000000), wk = 0.0029851 k( 189) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0029851 k( 190) = ( 0.0000000 0.3875000 0.5000000), wk = 0.0029851 k( 191) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0029851 k( 192) = ( 0.0000000 0.4125000 0.5000000), wk = 0.0029851 k( 193) = ( 0.0000000 0.4250000 0.5000000), wk = 0.0029851 k( 194) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0029851 k( 195) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0029851 k( 196) = ( 0.0000000 0.4625000 0.5000000), wk = 0.0029851 k( 197) = ( 0.0000000 0.4750000 0.5000000), wk = 0.0029851 k( 198) = ( 0.0000000 0.4875000 0.5000000), wk = 0.0029851 k( 199) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029851 k( 200) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029851 k( 201) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0029851 k( 202) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0029851 k( 203) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0029851 k( 204) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0029851 k( 205) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0029851 k( 206) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0029851 k( 207) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0029851 k( 208) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0029851 k( 209) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0029851 k( 210) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0029851 k( 211) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0029851 k( 212) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0029851 k( 213) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0029851 k( 214) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0029851 k( 215) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0029851 k( 216) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0029851 k( 217) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0029851 k( 218) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0029851 k( 219) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0029851 k( 220) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0029851 k( 221) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0029851 k( 222) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0029851 k( 223) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0029851 k( 224) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0029851 k( 225) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0029851 k( 226) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0029851 k( 227) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0029851 k( 228) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0029851 k( 229) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0029851 k( 230) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0029851 k( 231) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0029851 k( 232) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0029851 k( 233) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0029851 k( 234) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0029851 k( 235) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0029851 k( 236) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0029851 k( 237) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0029851 k( 238) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0029851 k( 239) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0029851 k( 240) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029851 k( 241) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029851 k( 242) = ( 0.4910714 0.4910714 0.5000000), wk = 0.0029851 k( 243) = ( 0.4821429 0.4821429 0.5000000), wk = 0.0029851 k( 244) = ( 0.4732143 0.4732143 0.5000000), wk = 0.0029851 k( 245) = ( 0.4642857 0.4642857 0.5000000), wk = 0.0029851 k( 246) = ( 0.4553571 0.4553571 0.5000000), wk = 0.0029851 k( 247) = ( 0.4464286 0.4464286 0.5000000), wk = 0.0029851 k( 248) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0029851 k( 249) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0029851 k( 250) = ( 0.4196429 0.4196429 0.5000000), wk = 0.0029851 k( 251) = ( 0.4107143 0.4107143 0.5000000), wk = 0.0029851 k( 252) = ( 0.4017857 0.4017857 0.5000000), wk = 0.0029851 k( 253) = ( 0.3928571 0.3928571 0.5000000), wk = 0.0029851 k( 254) = ( 0.3839286 0.3839286 0.5000000), wk = 0.0029851 k( 255) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0029851 k( 256) = ( 0.3660714 0.3660714 0.5000000), wk = 0.0029851 k( 257) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0029851 k( 258) = ( 0.3482143 0.3482143 0.5000000), wk = 0.0029851 k( 259) = ( 0.3392857 0.3392857 0.5000000), wk = 0.0029851 k( 260) = ( 0.3303571 0.3303571 0.5000000), wk = 0.0029851 k( 261) = ( 0.3214286 0.3214286 0.5000000), wk = 0.0029851 k( 262) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0029851 k( 263) = ( 0.3035714 0.3035714 0.5000000), wk = 0.0029851 k( 264) = ( 0.2946429 0.2946429 0.5000000), wk = 0.0029851 k( 265) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0029851 k( 266) = ( 0.2767857 0.2767857 0.5000000), wk = 0.0029851 k( 267) = ( 0.2678571 0.2678571 0.5000000), wk = 0.0029851 k( 268) = ( 0.2589286 0.2589286 0.5000000), wk = 0.0029851 k( 269) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0029851 k( 270) = ( 0.2410714 0.2410714 0.5000000), wk = 0.0029851 k( 271) = ( 0.2321429 0.2321429 0.5000000), wk = 0.0029851 k( 272) = ( 0.2232143 0.2232143 0.5000000), wk = 0.0029851 k( 273) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0029851 k( 274) = ( 0.2053571 0.2053571 0.5000000), wk = 0.0029851 k( 275) = ( 0.1964286 0.1964286 0.5000000), wk = 0.0029851 k( 276) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0029851 k( 277) = ( 0.1785714 0.1785714 0.5000000), wk = 0.0029851 k( 278) = ( 0.1696429 0.1696429 0.5000000), wk = 0.0029851 k( 279) = ( 0.1607143 0.1607143 0.5000000), wk = 0.0029851 k( 280) = ( 0.1517857 0.1517857 0.5000000), wk = 0.0029851 k( 281) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0029851 k( 282) = ( 0.1339286 0.1339286 0.5000000), wk = 0.0029851 k( 283) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0029851 k( 284) = ( 0.1160714 0.1160714 0.5000000), wk = 0.0029851 k( 285) = ( 0.1071429 0.1071429 0.5000000), wk = 0.0029851 k( 286) = ( 0.0982143 0.0982143 0.5000000), wk = 0.0029851 k( 287) = ( 0.0892857 0.0892857 0.5000000), wk = 0.0029851 k( 288) = ( 0.0803571 0.0803571 0.5000000), wk = 0.0029851 k( 289) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0029851 k( 290) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0029851 k( 291) = ( 0.0535714 0.0535714 0.5000000), wk = 0.0029851 k( 292) = ( 0.0446429 0.0446429 0.5000000), wk = 0.0029851 k( 293) = ( 0.0357143 0.0357143 0.5000000), wk = 0.0029851 k( 294) = ( 0.0267857 0.0267857 0.5000000), wk = 0.0029851 k( 295) = ( 0.0178571 0.0178571 0.5000000), wk = 0.0029851 k( 296) = ( 0.0089286 0.0089286 0.5000000), wk = 0.0029851 k( 297) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029851 k( 298) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029851 k( 299) = ( 0.0000000 0.5000000 0.0277778), wk = 0.0029851 k( 300) = ( 0.0000000 0.5000000 0.0555556), wk = 0.0029851 k( 301) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0029851 k( 302) = ( 0.0000000 0.5000000 0.1111111), wk = 0.0029851 k( 303) = ( 0.0000000 0.5000000 0.1388889), wk = 0.0029851 k( 304) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0029851 k( 305) = ( 0.0000000 0.5000000 0.1944444), wk = 0.0029851 k( 306) = ( 0.0000000 0.5000000 0.2222222), wk = 0.0029851 k( 307) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0029851 k( 308) = ( 0.0000000 0.5000000 0.2777778), wk = 0.0029851 k( 309) = ( 0.0000000 0.5000000 0.3055556), wk = 0.0029851 k( 310) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0029851 k( 311) = ( 0.0000000 0.5000000 0.3611111), wk = 0.0029851 k( 312) = ( 0.0000000 0.5000000 0.3888889), wk = 0.0029851 k( 313) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0029851 k( 314) = ( 0.0000000 0.5000000 0.4444444), wk = 0.0029851 k( 315) = ( 0.0000000 0.5000000 0.4722222), wk = 0.0029851 k( 316) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029851 k( 317) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029851 k( 318) = ( 0.5000000 0.5000000 0.0277778), wk = 0.0029851 k( 319) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0029851 k( 320) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0029851 k( 321) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0029851 k( 322) = ( 0.5000000 0.5000000 0.1388889), wk = 0.0029851 k( 323) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0029851 k( 324) = ( 0.5000000 0.5000000 0.1944444), wk = 0.0029851 k( 325) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0029851 k( 326) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0029851 k( 327) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0029851 k( 328) = ( 0.5000000 0.5000000 0.3055556), wk = 0.0029851 k( 329) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0029851 k( 330) = ( 0.5000000 0.5000000 0.3611111), wk = 0.0029851 k( 331) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0029851 k( 332) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0029851 k( 333) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0029851 k( 334) = ( 0.5000000 0.5000000 0.4722222), wk = 0.0029851 k( 335) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029851 Dense grid: 161337 G-vectors FFT dimensions: ( 54, 54, 120) Smooth grid: 42663 G-vectors FFT dimensions: ( 36, 36, 75) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 172, 68) NL pseudopotentials 0.22 Mb ( 86, 164) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.02 Mb ( 2243) G-vector shells 0.01 Mb ( 1136) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.71 Mb ( 172, 272) Each subspace H/S matrix 0.03 Mb ( 45, 45) Each matrix 0.34 Mb ( 164, 2, 68) The potential is recalculated from file : ./BiIO.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.6 secs Computing kpt #: 2 total cpu time spent up to now is 6.3 secs Computing kpt #: 3 total cpu time spent up to now is 7.5 secs Computing kpt #: 4 total cpu time spent up to now is 8.9 secs Computing kpt #: 5 total cpu time spent up to now is 10.1 secs Computing kpt #: 6 total cpu time spent up to now is 12.0 secs Computing kpt #: 7 total cpu time spent up to now is 13.2 secs Computing kpt #: 8 total cpu time spent up to now is 14.3 secs Computing kpt #: 9 total cpu time spent up to now is 15.4 secs Computing kpt #: 10 total cpu time spent up to now is 16.4 secs Computing kpt #: 11 total cpu time spent up to now is 17.7 secs Computing kpt #: 12 total cpu time spent up to now is 18.7 secs Computing kpt #: 13 total cpu time spent up to now is 19.8 secs Computing kpt #: 14 total cpu time spent up to now is 20.9 secs Computing kpt #: 15 total cpu time spent up to now is 22.1 secs Computing kpt #: 16 total cpu time spent up to now is 23.0 secs Computing kpt #: 17 total cpu time spent up to now is 24.1 secs Computing kpt #: 18 total cpu time spent up to now is 25.1 secs Computing kpt #: 19 total cpu time spent up to now is 26.3 secs Computing kpt #: 20 total cpu time spent up to now is 27.4 secs Computing kpt #: 21 total cpu time spent up to now is 28.5 secs Computing kpt #: 22 total cpu time spent up to now is 29.4 secs Computing kpt #: 23 total cpu time spent up to now is 30.5 secs Computing kpt #: 24 total cpu time spent up to now is 31.5 secs Computing kpt #: 25 total cpu time spent up to now is 32.7 secs Computing kpt #: 26 total cpu time spent up to now is 33.7 secs Computing kpt #: 27 total cpu time spent up to now is 34.9 secs Computing kpt #: 28 total cpu time spent up to now is 35.8 secs Computing kpt #: 29 total cpu time spent up to now is 37.0 secs Computing kpt #: 30 total cpu time spent up to now is 38.1 secs Computing kpt #: 31 total cpu time spent up to now is 39.0 secs Computing kpt #: 32 total cpu time spent up to now is 40.0 secs Computing kpt #: 33 total cpu time spent up to now is 40.9 secs Computing kpt #: 34 total cpu time spent up to now is 41.9 secs Computing kpt #: 35 total cpu time spent up to now is 43.0 secs Computing kpt #: 36 total cpu time spent up to now is 44.0 secs Computing kpt #: 37 total cpu time spent up to now is 44.9 secs Computing kpt #: 38 total cpu time spent up to now is 45.9 secs Computing kpt #: 39 total cpu time spent up to now is 46.9 secs Computing kpt #: 40 total cpu time spent up to now is 47.8 secs Computing kpt #: 41 total cpu time spent up to now is 48.8 secs Computing kpt #: 42 total cpu time spent up to now is 49.8 secs Computing kpt #: 43 total cpu time spent up to now is 50.8 secs Computing kpt #: 44 total cpu time spent up to now is 51.8 secs Computing kpt #: 45 total cpu time spent up to now is 52.8 secs Computing kpt #: 46 total cpu time spent up to now is 53.9 secs Computing kpt #: 47 total cpu time spent up to now is 54.9 secs Computing kpt #: 48 total cpu time spent up to now is 55.8 secs Computing kpt #: 49 total cpu time spent up to now is 56.9 secs Computing kpt #: 50 total cpu time spent up to now is 57.9 secs Computing kpt #: 51 total cpu time spent up to now is 58.8 secs Computing kpt #: 52 total cpu time spent up to now is 59.9 secs Computing kpt #: 53 total cpu time spent up to now is 60.9 secs Computing kpt #: 54 total cpu time spent up to now is 62.1 secs Computing kpt #: 55 total cpu time spent up to now is 63.2 secs Computing kpt #: 56 total cpu time spent up to now is 64.3 secs Computing kpt #: 57 total cpu time spent up to now is 65.3 secs Computing kpt #: 58 total cpu time spent up to now is 66.5 secs Computing kpt #: 59 total cpu time spent up to now is 67.6 secs Computing kpt #: 60 total cpu time spent up to now is 68.5 secs Computing kpt #: 61 total cpu time spent up to now is 69.5 secs Computing kpt #: 62 total cpu time spent up to now is 70.4 secs Computing kpt #: 63 total cpu time spent up to now is 71.3 secs Computing kpt #: 64 total cpu time spent up to now is 72.2 secs Computing kpt #: 65 total cpu time spent up to now is 73.3 secs Computing kpt #: 66 total cpu time spent up to now is 74.2 secs Computing kpt #: 67 total cpu time spent up to now is 75.3 secs Computing kpt #: 68 total cpu time spent up to now is 76.1 secs Computing kpt #: 69 total cpu time spent up to now is 77.1 secs Computing kpt #: 70 total cpu time spent up to now is 78.2 secs Computing kpt #: 71 total cpu time spent up to now is 79.2 secs Computing kpt #: 72 total cpu time spent up to now is 80.2 secs Computing kpt #: 73 total cpu time spent up to now is 81.1 secs Computing kpt #: 74 total cpu time spent up to now is 82.1 secs Computing kpt #: 75 total cpu time spent up to now is 83.1 secs Computing kpt #: 76 total cpu time spent up to now is 84.1 secs Computing kpt #: 77 total cpu time spent up to now is 84.9 secs Computing kpt #: 78 total cpu time spent up to now is 85.9 secs Computing kpt #: 79 total cpu time spent up to now is 86.9 secs Computing kpt #: 80 total cpu time spent up to now is 87.7 secs Computing kpt #: 81 total cpu time spent up to now is 88.8 secs Computing kpt #: 82 total cpu time spent up to now is 89.7 secs Computing kpt #: 83 total cpu time spent up to now is 90.6 secs Computing kpt #: 84 total cpu time spent up to now is 91.5 secs Computing kpt #: 85 total cpu time spent up to now is 92.4 secs Computing kpt #: 86 total cpu time spent up to now is 93.4 secs Computing kpt #: 87 total cpu time spent up to now is 94.3 secs Computing kpt #: 88 total cpu time spent up to now is 95.4 secs Computing kpt #: 89 total cpu time spent up to now is 96.4 secs Computing kpt #: 90 total cpu time spent up to now is 97.4 secs Computing kpt #: 91 total cpu time spent up to now is 98.3 secs Computing kpt #: 92 total cpu time spent up to now is 99.2 secs Computing kpt #: 93 total cpu time spent up to now is 100.3 secs Computing kpt #: 94 total cpu time spent up to now is 101.3 secs Computing kpt #: 95 total cpu time spent up to now is 102.5 secs Computing kpt #: 96 total cpu time spent up to now is 103.4 secs Computing kpt #: 97 total cpu time spent up to now is 104.6 secs Computing kpt #: 98 total cpu time spent up to now is 105.6 secs Computing kpt #: 99 total cpu time spent up to now is 106.6 secs Computing kpt #: 100 total cpu time spent up to now is 107.7 secs Computing kpt #: 101 total cpu time spent up to now is 108.9 secs Computing kpt #: 102 total cpu time spent up to now is 109.9 secs Computing kpt #: 103 total cpu time spent up to now is 110.9 secs Computing kpt #: 104 total cpu time spent up to now is 111.9 secs Computing kpt #: 105 total cpu time spent up to now is 113.3 secs Computing kpt #: 106 total cpu time spent up to now is 114.4 secs Computing kpt #: 107 total cpu time spent up to now is 115.5 secs Computing kpt #: 108 total cpu time spent up to now is 116.4 secs Computing kpt #: 109 total cpu time spent up to now is 117.4 secs Computing kpt #: 110 total cpu time spent up to now is 118.4 secs Computing kpt #: 111 total cpu time spent up to now is 119.4 secs Computing kpt #: 112 total cpu time spent up to now is 120.6 secs Computing kpt #: 113 total cpu time spent up to now is 121.7 secs Computing kpt #: 114 total cpu time spent up to now is 122.9 secs Computing kpt #: 115 total cpu time spent up to now is 124.0 secs Computing kpt #: 116 total cpu time spent up to now is 125.2 secs Computing kpt #: 117 total cpu time spent up to now is 126.6 secs Computing kpt #: 118 total cpu time spent up to now is 128.8 secs Computing kpt #: 119 total cpu time spent up to now is 129.9 secs Computing kpt #: 120 total cpu time spent up to now is 130.9 secs Computing kpt #: 121 total cpu time spent up to now is 131.8 secs Computing kpt #: 122 total cpu time spent up to now is 132.9 secs Computing kpt #: 123 total cpu time spent up to now is 133.9 secs Computing kpt #: 124 total cpu time spent up to now is 134.9 secs Computing kpt #: 125 total cpu time spent up to now is 135.9 secs Computing kpt #: 126 total cpu time spent up to now is 137.0 secs Computing kpt #: 127 total cpu time spent up to now is 138.1 secs Computing kpt #: 128 total cpu time spent up to now is 139.2 secs Computing kpt #: 129 total cpu time spent up to now is 140.2 secs Computing kpt #: 130 total cpu time spent up to now is 141.4 secs Computing kpt #: 131 total cpu time spent up to now is 142.5 secs Computing kpt #: 132 total cpu time spent up to now is 143.7 secs Computing kpt #: 133 total cpu time spent up to now is 145.1 secs Computing kpt #: 134 total cpu time spent up to now is 146.4 secs Computing kpt #: 135 total cpu time spent up to now is 147.6 secs Computing kpt #: 136 total cpu time spent up to now is 148.9 secs Computing kpt #: 137 total cpu time spent up to now is 150.2 secs Computing kpt #: 138 total cpu time spent up to now is 151.4 secs Computing kpt #: 139 total cpu time spent up to now is 152.6 secs Computing kpt #: 140 total cpu time spent up to now is 153.8 secs Computing kpt #: 141 total cpu time spent up to now is 155.2 secs Computing kpt #: 142 total cpu time spent up to now is 156.3 secs Computing kpt #: 143 total cpu time spent up to now is 158.9 secs Computing kpt #: 144 total cpu time spent up to now is 160.2 secs Computing kpt #: 145 total cpu time spent up to now is 161.6 secs Computing kpt #: 146 total cpu time spent up to now is 162.8 secs Computing kpt #: 147 total cpu time spent up to now is 164.2 secs Computing kpt #: 148 total cpu time spent up to now is 165.4 secs Computing kpt #: 149 total cpu time spent up to now is 166.7 secs Computing kpt #: 150 total cpu time spent up to now is 168.0 secs Computing kpt #: 151 total cpu time spent up to now is 169.3 secs Computing kpt #: 152 total cpu time spent up to now is 170.6 secs Computing kpt #: 153 total cpu time spent up to now is 172.0 secs Computing kpt #: 154 total cpu time spent up to now is 173.2 secs Computing kpt #: 155 total cpu time spent up to now is 174.7 secs Computing kpt #: 156 total cpu time spent up to now is 176.1 secs Computing kpt #: 157 total cpu time spent up to now is 177.4 secs Computing kpt #: 158 total cpu time spent up to now is 178.7 secs Computing kpt #: 159 total cpu time spent up to now is 179.9 secs Computing kpt #: 160 total cpu time spent up to now is 181.4 secs Computing kpt #: 161 total cpu time spent up to now is 182.8 secs Computing kpt #: 162 total cpu time spent up to now is 184.2 secs Computing kpt #: 163 total cpu time spent up to now is 185.7 secs Computing kpt #: 164 total cpu time spent up to now is 187.1 secs Computing kpt #: 165 total cpu time spent up to now is 188.6 secs Computing kpt #: 166 total cpu time spent up to now is 189.8 secs Computing kpt #: 167 total cpu time spent up to now is 191.0 secs Computing kpt #: 168 total cpu time spent up to now is 192.2 secs Computing kpt #: 169 total cpu time spent up to now is 193.3 secs Computing kpt #: 170 total cpu time spent up to now is 194.4 secs Computing kpt #: 171 total cpu time spent up to now is 195.4 secs Computing kpt #: 172 total cpu time spent up to now is 196.4 secs Computing kpt #: 173 total cpu time spent up to now is 197.5 secs Computing kpt #: 174 total cpu time spent up to now is 198.4 secs Computing kpt #: 175 total cpu time spent up to now is 199.4 secs Computing kpt #: 176 total cpu time spent up to now is 200.3 secs Computing kpt #: 177 total cpu time spent up to now is 203.9 secs Computing kpt #: 178 total cpu time spent up to now is 204.8 secs Computing kpt #: 179 total cpu time spent up to now is 205.8 secs Computing kpt #: 180 total cpu time spent up to now is 206.7 secs Computing kpt #: 181 total cpu time spent up to now is 207.8 secs Computing kpt #: 182 total cpu time spent up to now is 208.7 secs Computing kpt #: 183 total cpu time spent up to now is 209.7 secs Computing kpt #: 184 total cpu time spent up to now is 210.7 secs Computing kpt #: 185 total cpu time spent up to now is 211.7 secs Computing kpt #: 186 total cpu time spent up to now is 212.6 secs Computing kpt #: 187 total cpu time spent up to now is 213.5 secs Computing kpt #: 188 total cpu time spent up to now is 214.6 secs Computing kpt #: 189 total cpu time spent up to now is 215.6 secs Computing kpt #: 190 total cpu time spent up to now is 216.6 secs Computing kpt #: 191 total cpu time spent up to now is 217.5 secs Computing kpt #: 192 total cpu time spent up to now is 218.4 secs Computing kpt #: 193 total cpu time spent up to now is 219.5 secs Computing kpt #: 194 total cpu time spent up to now is 220.5 secs Computing kpt #: 195 total cpu time spent up to now is 221.4 secs Computing kpt #: 196 total cpu time spent up to now is 222.3 secs Computing kpt #: 197 total cpu time spent up to now is 223.5 secs Computing kpt #: 198 total cpu time spent up to now is 224.4 secs Computing kpt #: 199 total cpu time spent up to now is 225.4 secs Computing kpt #: 200 total cpu time spent up to now is 226.2 secs Computing kpt #: 201 total cpu time spent up to now is 227.2 secs Computing kpt #: 202 total cpu time spent up to now is 228.2 secs Computing kpt #: 203 total cpu time spent up to now is 229.2 secs Computing kpt #: 204 total cpu time spent up to now is 230.2 secs Computing kpt #: 205 total cpu time spent up to now is 231.1 secs Computing kpt #: 206 total cpu time spent up to now is 232.3 secs Computing kpt #: 207 total cpu time spent up to now is 233.2 secs Computing kpt #: 208 total cpu time spent up to now is 234.5 secs Computing kpt #: 209 total cpu time spent up to now is 235.4 secs Computing kpt #: 210 total cpu time spent up to now is 236.5 secs Computing kpt #: 211 total cpu time spent up to now is 237.5 secs Computing kpt #: 212 total cpu time spent up to now is 238.7 secs Computing kpt #: 213 total cpu time spent up to now is 239.7 secs Computing kpt #: 214 total cpu time spent up to now is 240.7 secs Computing kpt #: 215 total cpu time spent up to now is 241.8 secs Computing kpt #: 216 total cpu time spent up to now is 243.1 secs Computing kpt #: 217 total cpu time spent up to now is 244.1 secs Computing kpt #: 218 total cpu time spent up to now is 245.3 secs Computing kpt #: 219 total cpu time spent up to now is 246.3 secs Computing kpt #: 220 total cpu time spent up to now is 247.4 secs Computing kpt #: 221 total cpu time spent up to now is 248.4 secs Computing kpt #: 222 total cpu time spent up to now is 249.3 secs Computing kpt #: 223 total cpu time spent up to now is 250.4 secs Computing kpt #: 224 total cpu time spent up to now is 251.6 secs Computing kpt #: 225 total cpu time spent up to now is 252.6 secs Computing kpt #: 226 total cpu time spent up to now is 253.6 secs Computing kpt #: 227 total cpu time spent up to now is 254.7 secs Computing kpt #: 228 total cpu time spent up to now is 255.6 secs Computing kpt #: 229 total cpu time spent up to now is 256.7 secs Computing kpt #: 230 total cpu time spent up to now is 257.7 secs Computing kpt #: 231 total cpu time spent up to now is 258.6 secs Computing kpt #: 232 total cpu time spent up to now is 259.5 secs Computing kpt #: 233 total cpu time spent up to now is 260.4 secs Computing kpt #: 234 total cpu time spent up to now is 261.4 secs Computing kpt #: 235 total cpu time spent up to now is 262.4 secs Computing kpt #: 236 total cpu time spent up to now is 263.3 secs Computing kpt #: 237 total cpu time spent up to now is 264.2 secs Computing kpt #: 238 total cpu time spent up to now is 265.1 secs Computing kpt #: 239 total cpu time spent up to now is 266.0 secs Computing kpt #: 240 total cpu time spent up to now is 266.8 secs Computing kpt #: 241 total cpu time spent up to now is 267.8 secs Computing kpt #: 242 total cpu time spent up to now is 268.7 secs Computing kpt #: 243 total cpu time spent up to now is 269.8 secs Computing kpt #: 244 total cpu time spent up to now is 270.6 secs Computing kpt #: 245 total cpu time spent up to now is 271.5 secs Computing kpt #: 246 total cpu time spent up to now is 272.4 secs Computing kpt #: 247 total cpu time spent up to now is 273.2 secs Computing kpt #: 248 total cpu time spent up to now is 274.0 secs Computing kpt #: 249 total cpu time spent up to now is 275.1 secs Computing kpt #: 250 total cpu time spent up to now is 276.0 secs Computing kpt #: 251 total cpu time spent up to now is 277.0 secs Computing kpt #: 252 total cpu time spent up to now is 277.9 secs Computing kpt #: 253 total cpu time spent up to now is 278.8 secs Computing kpt #: 254 total cpu time spent up to now is 279.7 secs Computing kpt #: 255 total cpu time spent up to now is 280.9 secs Computing kpt #: 256 total cpu time spent up to now is 281.9 secs Computing kpt #: 257 total cpu time spent up to now is 283.0 secs Computing kpt #: 258 total cpu time spent up to now is 283.9 secs Computing kpt #: 259 total cpu time spent up to now is 284.9 secs Computing kpt #: 260 total cpu time spent up to now is 285.9 secs Computing kpt #: 261 total cpu time spent up to now is 286.9 secs Computing kpt #: 262 total cpu time spent up to now is 287.9 secs Computing kpt #: 263 total cpu time spent up to now is 288.8 secs Computing kpt #: 264 total cpu time spent up to now is 289.9 secs Computing kpt #: 265 total cpu time spent up to now is 290.8 secs Computing kpt #: 266 total cpu time spent up to now is 291.8 secs Computing kpt #: 267 total cpu time spent up to now is 292.7 secs Computing kpt #: 268 total cpu time spent up to now is 293.6 secs Computing kpt #: 269 total cpu time spent up to now is 294.7 secs Computing kpt #: 270 total cpu time spent up to now is 295.7 secs Computing kpt #: 271 total cpu time spent up to now is 296.9 secs Computing kpt #: 272 total cpu time spent up to now is 297.8 secs Computing kpt #: 273 total cpu time spent up to now is 298.9 secs Computing kpt #: 274 total cpu time spent up to now is 299.8 secs Computing kpt #: 275 total cpu time spent up to now is 301.0 secs Computing kpt #: 276 total cpu time spent up to now is 302.1 secs Computing kpt #: 277 total cpu time spent up to now is 303.2 secs Computing kpt #: 278 total cpu time spent up to now is 304.1 secs Computing kpt #: 279 total cpu time spent up to now is 305.2 secs Computing kpt #: 280 total cpu time spent up to now is 306.1 secs Computing kpt #: 281 total cpu time spent up to now is 307.0 secs Computing kpt #: 282 total cpu time spent up to now is 308.1 secs Computing kpt #: 283 total cpu time spent up to now is 309.1 secs Computing kpt #: 284 total cpu time spent up to now is 310.5 secs Computing kpt #: 285 total cpu time spent up to now is 311.5 secs Computing kpt #: 286 total cpu time spent up to now is 312.6 secs Computing kpt #: 287 total cpu time spent up to now is 313.7 secs Computing kpt #: 288 total cpu time spent up to now is 314.9 secs Computing kpt #: 289 total cpu time spent up to now is 316.0 secs Computing kpt #: 290 total cpu time spent up to now is 317.2 secs Computing kpt #: 291 total cpu time spent up to now is 318.5 secs Computing kpt #: 292 total cpu time spent up to now is 319.7 secs Computing kpt #: 293 total cpu time spent up to now is 321.1 secs Computing kpt #: 294 total cpu time spent up to now is 322.4 secs Computing kpt #: 295 total cpu time spent up to now is 323.8 secs Computing kpt #: 296 total cpu time spent up to now is 325.2 secs Computing kpt #: 297 total cpu time spent up to now is 326.5 secs Computing kpt #: 298 total cpu time spent up to now is 327.6 secs Computing kpt #: 299 total cpu time spent up to now is 328.5 secs Computing kpt #: 300 total cpu time spent up to now is 329.5 secs Computing kpt #: 301 total cpu time spent up to now is 330.5 secs Computing kpt #: 302 total cpu time spent up to now is 331.4 secs Computing kpt #: 303 total cpu time spent up to now is 332.4 secs Computing kpt #: 304 total cpu time spent up to now is 333.4 secs Computing kpt #: 305 total cpu time spent up to now is 334.5 secs Computing kpt #: 306 total cpu time spent up to now is 335.4 secs Computing kpt #: 307 total cpu time spent up to now is 336.4 secs Computing kpt #: 308 total cpu time spent up to now is 337.4 secs Computing kpt #: 309 total cpu time spent up to now is 338.3 secs Computing kpt #: 310 total cpu time spent up to now is 339.2 secs Computing kpt #: 311 total cpu time spent up to now is 340.3 secs Computing kpt #: 312 total cpu time spent up to now is 341.2 secs Computing kpt #: 313 total cpu time spent up to now is 342.3 secs Computing kpt #: 314 total cpu time spent up to now is 343.3 secs Computing kpt #: 315 total cpu time spent up to now is 344.3 secs Computing kpt #: 316 total cpu time spent up to now is 345.4 secs Computing kpt #: 317 total cpu time spent up to now is 346.2 secs Computing kpt #: 318 total cpu time spent up to now is 347.2 secs Computing kpt #: 319 total cpu time spent up to now is 348.1 secs Computing kpt #: 320 total cpu time spent up to now is 349.0 secs Computing kpt #: 321 total cpu time spent up to now is 350.1 secs Computing kpt #: 322 total cpu time spent up to now is 351.0 secs Computing kpt #: 323 total cpu time spent up to now is 352.0 secs Computing kpt #: 324 total cpu time spent up to now is 352.9 secs Computing kpt #: 325 total cpu time spent up to now is 354.0 secs Computing kpt #: 326 total cpu time spent up to now is 354.9 secs Computing kpt #: 327 total cpu time spent up to now is 356.0 secs Computing kpt #: 328 total cpu time spent up to now is 356.9 secs Computing kpt #: 329 total cpu time spent up to now is 357.9 secs Computing kpt #: 330 total cpu time spent up to now is 358.9 secs Computing kpt #: 331 total cpu time spent up to now is 359.9 secs Computing kpt #: 332 total cpu time spent up to now is 360.9 secs Computing kpt #: 333 total cpu time spent up to now is 361.8 secs Computing kpt #: 334 total cpu time spent up to now is 362.9 secs Computing kpt #: 335 total cpu time spent up to now is 363.8 secs ethr = 1.79E-08, avg # of iterations = 15.3 total cpu time spent up to now is 363.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5313 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5925 -13.5925 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6188 -11.6188 -9.2383 -9.2383 -4.6625 -4.6625 -4.5722 -4.5722 -1.9686 -1.9686 -0.1728 -0.1728 1.9087 1.9087 2.3883 2.3883 4.6907 4.6907 5.0056 5.0056 5.1336 5.1336 5.5134 5.5134 5.8930 5.8930 6.0750 6.0750 6.6463 6.6463 7.0480 7.0480 7.1612 7.1612 7.2531 7.2531 8.7853 8.7853 9.3812 9.3812 11.5761 11.5761 12.5460 12.5460 12.5555 12.5555 13.3266 13.3266 k = 0.0000 0.0125-0.0000 ( 5301 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5045 -13.5045 -11.6177 -11.6177 -9.2389 -9.2389 -4.6616 -4.6616 -4.5715 -4.5715 -1.9698 -1.9698 -0.1748 -0.1748 1.9093 1.9093 2.3888 2.3888 4.6864 4.6864 5.0041 5.0041 5.1329 5.1329 5.5148 5.5148 5.8906 5.8906 6.0748 6.0748 6.6461 6.6461 7.0450 7.0450 7.1630 7.1630 7.2515 7.2515 8.7934 8.7934 9.3834 9.3834 11.5760 11.5760 12.5392 12.5392 12.5558 12.5558 13.3313 13.3313 k = 0.0000 0.0250-0.0000 ( 5293 PWs) bands (ev): -16.5642 -16.5642 -16.5445 -16.5445 -16.5237 -16.5237 -16.5212 -16.5212 -13.7460 -13.7460 -13.5923 -13.5923 -13.5718 -13.5718 -13.5578 -13.5578 -13.5436 -13.5436 -13.5049 -13.5049 -11.6144 -11.6144 -9.2408 -9.2408 -4.6589 -4.6589 -4.5692 -4.5692 -1.9734 -1.9734 -0.1811 -0.1811 1.9114 1.9114 2.3903 2.3903 4.6737 4.6737 4.9997 4.9997 5.1310 5.1310 5.5185 5.5185 5.8831 5.8831 6.0744 6.0744 6.6455 6.6455 7.0366 7.0366 7.1676 7.1676 7.2471 7.2471 8.8174 8.8174 9.3898 9.3898 11.5759 11.5759 12.5238 12.5238 12.5520 12.5520 13.3450 13.3450 k = 0.0000 0.0375-0.0000 ( 5303 PWs) bands (ev): -16.5644 -16.5644 -16.5443 -16.5443 -16.5238 -16.5238 -16.5211 -16.5211 -13.7461 -13.7461 -13.5922 -13.5922 -13.5718 -13.5718 -13.5579 -13.5579 -13.5434 -13.5434 -13.5057 -13.5057 -11.6090 -11.6090 -9.2441 -9.2441 -4.6543 -4.6543 -4.5654 -4.5654 -1.9794 -1.9794 -0.1914 -0.1914 1.9148 1.9148 2.3930 2.3930 4.6534 4.6534 4.9923 4.9923 5.1281 5.1281 5.5230 5.5230 5.8699 5.8699 6.0748 6.0748 6.6447 6.6447 7.0245 7.0245 7.1737 7.1737 7.2416 7.2416 8.8557 8.8557 9.4005 9.4005 11.5756 11.5756 12.5025 12.5025 12.5420 12.5420 13.3666 13.3666 k = 0.0000 0.0500-0.0000 ( 5317 PWs) bands (ev): -16.5645 -16.5645 -16.5441 -16.5441 -16.5240 -16.5240 -16.5211 -16.5211 -13.7463 -13.7463 -13.5920 -13.5920 -13.5719 -13.5719 -13.5581 -13.5581 -13.5431 -13.5431 -13.5066 -13.5066 -11.6014 -11.6014 -9.2486 -9.2486 -4.6480 -4.6480 -4.5601 -4.5601 -1.9877 -1.9877 -0.2059 -0.2059 1.9196 1.9196 2.3967 2.3967 4.6265 4.6265 4.9820 4.9820 5.1243 5.1243 5.5261 5.5261 5.8503 5.8503 6.0773 6.0773 6.6436 6.6436 7.0103 7.0103 7.1795 7.1795 7.2372 7.2372 8.9063 8.9063 9.4152 9.4152 11.5751 11.5751 12.4765 12.4765 12.5258 12.5258 13.3933 13.3933 k = 0.0000 0.0625-0.0000 ( 5319 PWs) bands (ev): -16.5647 -16.5647 -16.5438 -16.5438 -16.5241 -16.5241 -16.5210 -16.5210 -13.7465 -13.7465 -13.5918 -13.5918 -13.5720 -13.5720 -13.5582 -13.5582 -13.5427 -13.5427 -13.5078 -13.5078 -11.5918 -11.5918 -9.2545 -9.2545 -4.6399 -4.6399 -4.5534 -4.5534 -1.9982 -1.9982 -0.2245 -0.2245 1.9258 1.9258 2.4015 2.4015 4.5942 4.5942 4.9689 4.9689 5.1196 5.1196 5.5255 5.5255 5.8237 5.8237 6.0831 6.0831 6.6425 6.6425 6.9959 6.9959 7.1838 7.1838 7.2361 7.2361 8.9664 8.9664 9.4338 9.4338 11.5743 11.5743 12.4468 12.4468 12.5037 12.5037 13.4204 13.4204 k = 0.0000 0.0750-0.0000 ( 5327 PWs) bands (ev): -16.5649 -16.5649 -16.5434 -16.5434 -16.5243 -16.5243 -16.5209 -16.5209 -13.7467 -13.7467 -13.5915 -13.5915 -13.5722 -13.5722 -13.5583 -13.5583 -13.5423 -13.5423 -13.5093 -13.5093 -11.5800 -11.5800 -9.2616 -9.2616 -4.6300 -4.6300 -4.5451 -4.5451 -2.0109 -2.0109 -0.2472 -0.2472 1.9333 1.9333 2.4076 2.4076 4.5579 4.5579 4.9530 4.9530 5.1136 5.1136 5.5191 5.5191 5.7902 5.7902 6.0931 6.0931 6.6415 6.6415 6.9825 6.9825 7.1865 7.1865 7.2394 7.2394 9.0334 9.0334 9.4567 9.4567 11.5732 11.5732 12.4143 12.4143 12.4765 12.4765 13.4400 13.4400 k = 0.0000 0.0875-0.0000 ( 5333 PWs) bands (ev): -16.5651 -16.5651 -16.5430 -16.5430 -16.5246 -16.5246 -16.5207 -16.5207 -13.7470 -13.7470 -13.5913 -13.5913 -13.5726 -13.5726 -13.5583 -13.5583 -13.5419 -13.5419 -13.5109 -13.5109 -11.5661 -11.5661 -9.2701 -9.2701 -4.6184 -4.6184 -4.5355 -4.5355 -2.0255 -2.0255 -0.2739 -0.2739 1.9422 1.9422 2.4149 2.4149 4.5186 4.5186 4.9345 4.9345 5.1056 5.1056 5.5057 5.5057 5.7506 5.7506 6.1074 6.1074 6.6408 6.6408 6.9714 6.9714 7.1890 7.1890 7.2464 7.2464 9.1040 9.1040 9.4843 9.4843 11.5715 11.5715 12.3800 12.3800 12.4448 12.4448 13.4448 13.4448 k = 0.0000 0.1000-0.0000 ( 5341 PWs) bands (ev): -16.5653 -16.5653 -16.5426 -16.5426 -16.5249 -16.5249 -16.5206 -16.5206 -13.7472 -13.7472 -13.5910 -13.5910 -13.5731 -13.5731 -13.5581 -13.5581 -13.5415 -13.5415 -13.5126 -13.5126 -11.5502 -11.5502 -9.2800 -9.2800 -4.6050 -4.6050 -4.5244 -4.5244 -2.0421 -2.0421 -0.3047 -0.3047 1.9524 1.9524 2.4234 2.4234 4.4773 4.4773 4.9137 4.9137 5.0947 5.0947 5.4847 5.4847 5.7060 5.7060 6.1260 6.1260 6.6405 6.6405 6.9634 6.9634 7.1928 7.1928 7.2559 7.2559 9.1750 9.1750 9.5179 9.5179 11.5693 11.5693 12.3448 12.3448 12.4098 12.4098 13.4337 13.4337 k = 0.0000 0.1125-0.0000 ( 5339 PWs) bands (ev): -16.5655 -16.5655 -16.5422 -16.5422 -16.5252 -16.5252 -16.5205 -16.5205 -13.7475 -13.7475 -13.5908 -13.5908 -13.5739 -13.5739 -13.5579 -13.5579 -13.5411 -13.5411 -13.5144 -13.5144 -11.5323 -11.5323 -9.2912 -9.2912 -4.5899 -4.5899 -4.5119 -4.5119 -2.0604 -2.0604 -0.3394 -0.3394 1.9639 1.9639 2.4334 2.4334 4.4348 4.4348 4.8905 4.8905 5.0797 5.0797 5.4562 5.4562 5.6581 5.6581 6.1482 6.1482 6.6407 6.6407 6.9590 6.9590 7.1989 7.1989 7.2669 7.2669 9.2427 9.2427 9.5591 9.5591 11.5666 11.5666 12.3092 12.3092 12.3724 12.3724 13.4113 13.4113 k = 0.0000 0.1250-0.0000 ( 5331 PWs) bands (ev): -16.5656 -16.5656 -16.5417 -16.5417 -16.5255 -16.5255 -16.5203 -16.5203 -13.7477 -13.7477 -13.5906 -13.5906 -13.5749 -13.5749 -13.5575 -13.5575 -13.5407 -13.5407 -13.5162 -13.5162 -11.5125 -11.5125 -9.3037 -9.3037 -4.5732 -4.5732 -4.4981 -4.4981 -2.0803 -2.0803 -0.3779 -0.3779 1.9768 1.9768 2.4447 2.4447 4.3917 4.3917 4.8651 4.8651 5.0594 5.0594 5.4213 5.4213 5.6089 5.6089 6.1732 6.1732 6.6416 6.6416 6.9581 6.9581 7.2074 7.2074 7.2790 7.2790 9.3038 9.3038 9.6098 9.6098 11.5633 11.5633 12.2737 12.2737 12.3342 12.3342 13.3824 13.3824 k = 0.0000 0.1375-0.0000 ( 5329 PWs) bands (ev): -16.5658 -16.5658 -16.5412 -16.5412 -16.5259 -16.5259 -16.5201 -16.5201 -13.7479 -13.7479 -13.5905 -13.5905 -13.5761 -13.5761 -13.5570 -13.5570 -13.5403 -13.5403 -13.5179 -13.5179 -11.4907 -11.4907 -9.3177 -9.3177 -4.5548 -4.5548 -4.4829 -4.4829 -2.1016 -2.1016 -0.4202 -0.4202 1.9911 1.9911 2.4575 2.4575 4.3484 4.3484 4.8375 4.8375 5.0323 5.0323 5.3808 5.3808 5.5610 5.5610 6.2000 6.2000 6.6432 6.6432 6.9607 6.9607 7.2182 7.2182 7.2918 7.2918 9.3560 9.3560 9.6708 9.6708 11.5597 11.5597 12.2385 12.2385 12.2966 12.2966 13.3501 13.3501 k = 0.0000 0.1500-0.0000 ( 5337 PWs) bands (ev): -16.5659 -16.5659 -16.5407 -16.5407 -16.5263 -16.5263 -16.5200 -16.5200 -13.7480 -13.7480 -13.5905 -13.5905 -13.5774 -13.5774 -13.5566 -13.5566 -13.5398 -13.5398 -13.5195 -13.5195 -11.4670 -11.4670 -9.3331 -9.3331 -4.5348 -4.5348 -4.4665 -4.4665 -2.1241 -2.1241 -0.4662 -0.4662 2.0066 2.0066 2.4718 2.4718 4.3051 4.3051 4.8076 4.8076 4.9975 4.9975 5.3351 5.3351 5.5173 5.5173 6.2279 6.2279 6.6455 6.6455 6.9662 6.9662 7.2307 7.2307 7.3052 7.3052 9.3997 9.3997 9.7409 9.7409 11.5557 11.5557 12.2036 12.2036 12.2611 12.2611 13.3158 13.3158 k = 0.0000 0.1625-0.0000 ( 5343 PWs) bands (ev): -16.5660 -16.5660 -16.5402 -16.5402 -16.5268 -16.5268 -16.5198 -16.5198 -13.7480 -13.7480 -13.5908 -13.5908 -13.5789 -13.5789 -13.5561 -13.5561 -13.5394 -13.5394 -13.5210 -13.5210 -11.4416 -11.4416 -9.3499 -9.3499 -4.5132 -4.5132 -4.4489 -4.4489 -2.1477 -2.1477 -0.5157 -0.5157 2.0234 2.0234 2.4877 2.4877 4.2620 4.2620 4.7754 4.7754 4.9549 4.9549 5.2842 5.2842 5.4804 5.4804 6.2560 6.2560 6.6486 6.6486 6.9743 6.9743 7.2443 7.2443 7.3192 7.3192 9.4367 9.4367 9.8176 9.8176 11.5515 11.5515 12.1690 12.1690 12.2292 12.2292 13.2802 13.2802 k = 0.0000 0.1750-0.0000 ( 5333 PWs) bands (ev): -16.5661 -16.5661 -16.5397 -16.5397 -16.5273 -16.5273 -16.5197 -16.5197 -13.7480 -13.7480 -13.5914 -13.5914 -13.5803 -13.5803 -13.5558 -13.5558 -13.5389 -13.5389 -13.5222 -13.5222 -11.4144 -11.4144 -9.3681 -9.3681 -4.4902 -4.4902 -4.4302 -4.4302 -2.1721 -2.1721 -0.5685 -0.5685 2.0414 2.0414 2.5051 2.5051 4.2191 4.2191 4.7408 4.7408 4.9053 4.9053 5.2285 5.2285 5.4517 5.4517 6.2836 6.2836 6.6522 6.6522 6.9843 6.9843 7.2583 7.2583 7.3335 7.3335 9.4691 9.4691 9.8980 9.8980 11.5475 11.5475 12.1353 12.1353 12.2014 12.2014 13.2438 13.2438 k = 0.0000 0.1875-0.0000 ( 5327 PWs) bands (ev): -16.5661 -16.5661 -16.5392 -16.5392 -16.5278 -16.5278 -16.5196 -16.5196 -13.7478 -13.7478 -13.5925 -13.5925 -13.5815 -13.5815 -13.5557 -13.5557 -13.5384 -13.5384 -13.5232 -13.5232 -11.3855 -11.3855 -9.3878 -9.3878 -4.4657 -4.4657 -4.4103 -4.4103 -2.1971 -2.1971 -0.6245 -0.6245 2.0606 2.0606 2.5241 2.5241 4.1760 4.1760 4.7036 4.7036 4.8505 4.8505 5.1688 5.1688 5.4311 5.4311 6.3102 6.3102 6.6564 6.6564 6.9959 6.9959 7.2721 7.2721 7.3481 7.3481 9.4990 9.4990 9.9797 9.9797 11.5438 11.5438 12.1034 12.1034 12.1779 12.1779 13.2067 13.2067 k = 0.0000 0.2000-0.0000 ( 5331 PWs) bands (ev): -16.5660 -16.5660 -16.5387 -16.5387 -16.5284 -16.5284 -16.5195 -16.5195 -13.7476 -13.7476 -13.5942 -13.5942 -13.5824 -13.5824 -13.5558 -13.5558 -13.5377 -13.5377 -13.5239 -13.5239 -11.3549 -11.3549 -9.4090 -9.4090 -4.4398 -4.4398 -4.3894 -4.3894 -2.2225 -2.2225 -0.6835 -0.6835 2.0810 2.0810 2.5447 2.5447 4.1325 4.1325 4.6635 4.6635 4.7929 4.7929 5.1063 5.1063 5.4173 5.4173 6.3351 6.3351 6.6612 6.6612 7.0084 7.0084 7.2851 7.2851 7.3629 7.3629 9.5277 9.5277 10.0607 10.0607 11.5409 11.5409 12.0744 12.0744 12.1584 12.1584 13.1688 13.1688 k = 0.0000 0.2125-0.0000 ( 5319 PWs) bands (ev): -16.5659 -16.5659 -16.5382 -16.5382 -16.5289 -16.5289 -16.5194 -16.5194 -13.7472 -13.7472 -13.5965 -13.5965 -13.5829 -13.5829 -13.5561 -13.5561 -13.5369 -13.5369 -13.5244 -13.5244 -11.3228 -11.3228 -9.4316 -9.4316 -4.4127 -4.4127 -4.3676 -4.3676 -2.2481 -2.2481 -0.7452 -0.7452 2.1026 2.1026 2.5668 2.5668 4.0882 4.0882 4.6202 4.6202 4.7350 4.7350 5.0426 5.0426 5.4091 5.4091 6.3579 6.3579 6.6663 6.6663 7.0215 7.0215 7.2970 7.2970 7.3776 7.3776 9.5564 9.5564 10.1395 10.1395 11.5390 11.5390 12.0494 12.0494 12.1428 12.1428 13.1303 13.1303 k = 0.0000 0.2250-0.0000 ( 5316 PWs) bands (ev): -16.5658 -16.5658 -16.5378 -16.5378 -16.5295 -16.5295 -16.5193 -16.5193 -13.7467 -13.7467 -13.5994 -13.5994 -13.5831 -13.5831 -13.5566 -13.5566 -13.5360 -13.5360 -13.5246 -13.5246 -11.2891 -11.2891 -9.4557 -9.4557 -4.3843 -4.3843 -4.3448 -4.3448 -2.2737 -2.2737 -0.8095 -0.8095 2.1252 2.1252 2.5905 2.5905 4.0426 4.0426 4.5732 4.5732 4.6791 4.6791 4.9785 4.9785 5.4054 5.4054 6.3782 6.3782 6.6718 6.6718 7.0347 7.0347 7.3076 7.3076 7.3921 7.3921 9.5858 9.5858 10.2150 10.2150 11.5387 11.5387 12.0289 12.0289 12.1307 12.1307 13.0911 13.0911 k = 0.0000 0.2375-0.0000 ( 5320 PWs) bands (ev): -16.5656 -16.5656 -16.5373 -16.5373 -16.5302 -16.5302 -16.5193 -16.5193 -13.7461 -13.7461 -13.6028 -13.6028 -13.5831 -13.5831 -13.5572 -13.5572 -13.5349 -13.5349 -13.5247 -13.5247 -11.2540 -11.2540 -9.4812 -9.4812 -4.3549 -4.3549 -4.3213 -4.3213 -2.2990 -2.2990 -0.8761 -0.8761 2.1488 2.1488 2.6158 2.6158 3.9951 3.9951 4.5227 4.5227 4.6269 4.6269 4.9152 4.9152 5.4052 5.4052 6.3955 6.3955 6.6776 6.6776 7.0475 7.0475 7.3169 7.3169 7.4060 7.4060 9.6164 9.6164 10.2860 10.2860 11.5404 11.5404 12.0136 12.0136 12.1220 12.1220 13.0513 13.0513 k = 0.0000 0.2500-0.0000 ( 5328 PWs) bands (ev): -16.5653 -16.5653 -16.5368 -16.5368 -16.5308 -16.5308 -16.5193 -16.5193 -13.7453 -13.7453 -13.6065 -13.6065 -13.5830 -13.5830 -13.5580 -13.5580 -13.5338 -13.5338 -13.5246 -13.5246 -11.2174 -11.2174 -9.5083 -9.5083 -4.3246 -4.3246 -4.2970 -4.2970 -2.3239 -2.3239 -0.9447 -0.9447 2.1733 2.1733 2.6425 2.6425 3.9453 3.9453 4.4696 4.4696 4.5788 4.5788 4.8531 4.8531 5.4079 5.4079 6.4095 6.4095 6.6838 6.6838 7.0593 7.0593 7.3252 7.3252 7.4194 7.4194 9.6486 9.6486 10.3517 10.3517 11.5446 11.5446 12.0038 12.0038 12.1166 12.1166 13.0110 13.0110 k = 0.0000 0.2625-0.0000 ( 5324 PWs) bands (ev): -16.5650 -16.5650 -16.5364 -16.5364 -16.5314 -16.5314 -16.5193 -16.5193 -13.7443 -13.7443 -13.6105 -13.6105 -13.5828 -13.5828 -13.5588 -13.5588 -13.5326 -13.5326 -13.5244 -13.5244 -11.1796 -11.1796 -9.5368 -9.5368 -4.2935 -4.2935 -4.2721 -4.2721 -2.3480 -2.3480 -1.0151 -1.0151 2.1988 2.1988 2.6707 2.6707 3.8930 3.8930 4.4154 4.4154 4.5346 4.5346 4.7930 4.7930 5.4132 5.4132 6.4198 6.4198 6.6903 6.6903 7.0697 7.0697 7.3327 7.3327 7.4320 7.4320 9.6826 9.6826 10.4113 10.4113 11.5516 11.5516 11.9996 11.9996 12.1142 12.1142 12.9704 12.9704 k = 0.0000 0.2750-0.0000 ( 5316 PWs) bands (ev): -16.5647 -16.5647 -16.5361 -16.5361 -16.5320 -16.5320 -16.5193 -16.5193 -13.7433 -13.7433 -13.6148 -13.6148 -13.5826 -13.5826 -13.5597 -13.5597 -13.5314 -13.5314 -13.5241 -13.5241 -11.1405 -11.1405 -9.5667 -9.5667 -4.2619 -4.2619 -4.2465 -4.2465 -2.3712 -2.3712 -1.0870 -1.0870 2.2250 2.2250 2.7002 2.7002 3.8382 3.8382 4.3613 4.3613 4.4939 4.4939 4.7350 4.7350 5.4209 5.4209 6.4260 6.4260 6.6971 6.6971 7.0781 7.0781 7.3398 7.3398 7.4439 7.4439 9.7184 9.7184 10.4642 10.4642 11.5616 11.5616 12.0011 12.0011 12.1148 12.1148 12.9296 12.9296 k = 0.0000 0.2875-0.0000 ( 5308 PWs) bands (ev): -16.5642 -16.5642 -16.5359 -16.5359 -16.5325 -16.5325 -16.5194 -16.5194 -13.7420 -13.7420 -13.6192 -13.6192 -13.5823 -13.5823 -13.5606 -13.5606 -13.5301 -13.5301 -13.5237 -13.5237 -11.1002 -11.1002 -9.5981 -9.5981 -4.2301 -4.2301 -4.2201 -4.2201 -2.3932 -2.3932 -1.1601 -1.1601 2.2520 2.2520 2.7311 2.7311 3.7811 3.7811 4.3080 4.3080 4.4563 4.4563 4.6795 4.6795 5.4307 5.4307 6.4281 6.4281 6.7042 6.7042 7.0840 7.0840 7.3470 7.3470 7.4551 7.4551 9.7561 9.7561 10.5100 10.5100 11.5749 11.5749 12.0082 12.0082 12.1181 12.1181 12.8889 12.8889 k = 0.0000 0.3000-0.0000 ( 5316 PWs) bands (ev): -16.5637 -16.5637 -16.5359 -16.5359 -16.5328 -16.5328 -16.5196 -16.5196 -13.7406 -13.7406 -13.6237 -13.6237 -13.5819 -13.5819 -13.5615 -13.5615 -13.5289 -13.5289 -13.5233 -13.5233 -11.0588 -11.0588 -9.6309 -9.6309 -4.1993 -4.1993 -4.1922 -4.1922 -2.4137 -2.4137 -1.2341 -1.2341 2.2796 2.2796 2.7631 2.7631 3.7221 3.7221 4.2558 4.2558 4.4216 4.4216 4.6266 4.6266 5.4426 5.4426 6.4257 6.4257 6.7118 6.7118 7.0869 7.0869 7.3548 7.3548 7.4657 7.4657 9.7954 9.7954 10.5484 10.5484 11.5912 11.5912 12.0206 12.0206 12.1241 12.1241 12.8484 12.8484 k = 0.0000 0.3125-0.0000 ( 5318 PWs) bands (ev): -16.5632 -16.5632 -16.5362 -16.5362 -16.5328 -16.5328 -16.5197 -16.5197 -13.7390 -13.7390 -13.6284 -13.6284 -13.5815 -13.5815 -13.5624 -13.5624 -13.5277 -13.5277 -13.5229 -13.5229 -11.0163 -11.0163 -9.6650 -9.6650 -4.1711 -4.1711 -4.1615 -4.1615 -2.4325 -2.4325 -1.3087 -1.3087 2.3079 2.3079 2.7961 2.7961 3.6619 3.6619 4.2047 4.2047 4.3898 4.3898 4.5766 4.5766 5.4566 5.4566 6.4188 6.4188 6.7197 6.7197 7.0866 7.0866 7.3636 7.3636 7.4758 7.4758 9.8361 9.8361 10.5795 10.5795 11.6102 11.6102 12.0380 12.0380 12.1325 12.1325 12.8086 12.8086 k = 0.0000 0.3250-0.0000 ( 5326 PWs) bands (ev): -16.5626 -16.5626 -16.5367 -16.5367 -16.5326 -16.5326 -16.5199 -16.5199 -13.7373 -13.7373 -13.6331 -13.6331 -13.5811 -13.5811 -13.5633 -13.5633 -13.5265 -13.5265 -13.5224 -13.5224 -10.9729 -10.9729 -9.7006 -9.7006 -4.1442 -4.1442 -4.1297 -4.1297 -2.4492 -2.4492 -1.3837 -1.3837 2.3366 2.3366 2.8300 2.8300 3.6012 3.6012 4.1547 4.1547 4.3605 4.3605 4.5296 4.5296 5.4728 5.4728 6.4075 6.4075 6.7281 6.7281 7.0829 7.0829 7.3734 7.3734 7.4854 7.4854 9.8780 9.8780 10.6035 10.6035 11.6317 11.6317 12.0598 12.0598 12.1431 12.1431 12.7696 12.7696 k = 0.0000 0.3375-0.0000 ( 5316 PWs) bands (ev): -16.5620 -16.5620 -16.5375 -16.5375 -16.5323 -16.5323 -16.5202 -16.5202 -13.7354 -13.7354 -13.6379 -13.6379 -13.5807 -13.5807 -13.5642 -13.5642 -13.5254 -13.5254 -13.5219 -13.5219 -10.9286 -10.9286 -9.7374 -9.7374 -4.1179 -4.1179 -4.0979 -4.0979 -2.4636 -2.4636 -1.4588 -1.4588 2.3658 2.3658 2.8644 2.8644 3.5410 3.5410 4.1055 4.1055 4.3335 4.3335 4.4857 4.4857 5.4912 5.4912 6.3918 6.3918 6.7367 6.7367 7.0761 7.0761 7.3844 7.3844 7.4947 7.4947 9.9207 9.9207 10.6208 10.6208 11.6551 11.6551 12.0854 12.0854 12.1553 12.1553 12.7320 12.7320 k = 0.0000 0.3500-0.0000 ( 5320 PWs) bands (ev): -16.5613 -16.5613 -16.5383 -16.5383 -16.5319 -16.5319 -16.5204 -16.5204 -13.7333 -13.7333 -13.6427 -13.6427 -13.5803 -13.5803 -13.5650 -13.5650 -13.5243 -13.5243 -13.5214 -13.5214 -10.8834 -10.8834 -9.7755 -9.7755 -4.0920 -4.0920 -4.0669 -4.0669 -2.4753 -2.4753 -1.5336 -1.5336 2.3955 2.3955 2.8989 2.8989 3.4820 3.4820 4.0572 4.0572 4.3085 4.3085 4.4451 4.4451 5.5118 5.5118 6.3718 6.3718 6.7457 6.7457 7.0664 7.0664 7.3966 7.3966 7.5034 7.5034 9.9639 9.9639 10.6318 10.6318 11.6799 11.6799 12.1139 12.1139 12.1689 12.1689 12.6961 12.6961 k = 0.0000 0.3625-0.0000 ( 5314 PWs) bands (ev): -16.5606 -16.5606 -16.5392 -16.5392 -16.5314 -16.5314 -16.5207 -16.5207 -13.7311 -13.7311 -13.6475 -13.6475 -13.5798 -13.5798 -13.5658 -13.5658 -13.5234 -13.5234 -13.5209 -13.5209 -10.8375 -10.8375 -9.8148 -9.8148 -4.0666 -4.0666 -4.0369 -4.0369 -2.4839 -2.4839 -1.6078 -1.6078 2.4255 2.4255 2.9329 2.9329 3.4256 3.4256 4.0094 4.0094 4.2853 4.2853 4.4080 4.4080 5.5346 5.5346 6.3479 6.3479 6.7550 6.7550 7.0543 7.0543 7.4095 7.4095 7.5117 7.5117 10.0074 10.0074 10.6371 10.6371 11.7059 11.7059 12.1440 12.1440 12.1833 12.1833 12.6626 12.6626 k = 0.0000 0.3750-0.0000 ( 5316 PWs) bands (ev): -16.5598 -16.5598 -16.5401 -16.5401 -16.5309 -16.5309 -16.5211 -16.5211 -13.7287 -13.7287 -13.6523 -13.6523 -13.5793 -13.5793 -13.5666 -13.5666 -13.5225 -13.5225 -13.5205 -13.5205 -10.7910 -10.7910 -9.8552 -9.8552 -4.0419 -4.0419 -4.0085 -4.0085 -2.4892 -2.4892 -1.6812 -1.6812 2.4559 2.4559 2.9650 2.9650 3.3733 3.3733 3.9622 3.9622 4.2637 4.2637 4.3742 4.3742 5.5598 5.5598 6.3203 6.3203 6.7645 6.7645 7.0404 7.0404 7.4230 7.4230 7.5193 7.5193 10.0508 10.0508 10.6371 10.6371 11.7327 11.7327 12.1725 12.1725 12.1998 12.1998 12.6322 12.6322 k = 0.0000 0.3875-0.0000 ( 5310 PWs) bands (ev): -16.5590 -16.5590 -16.5410 -16.5410 -16.5304 -16.5304 -16.5214 -16.5214 -13.7262 -13.7262 -13.6570 -13.6570 -13.5788 -13.5788 -13.5674 -13.5674 -13.5217 -13.5217 -13.5200 -13.5200 -10.7439 -10.7439 -9.8968 -9.8968 -4.0180 -4.0180 -3.9819 -3.9819 -2.4907 -2.4907 -1.7534 -1.7534 2.4867 2.4867 2.9930 2.9930 3.3276 3.3276 3.9152 3.9152 4.2440 4.2440 4.3439 4.3439 5.5872 5.5872 6.2893 6.2893 6.7744 6.7744 7.0250 7.0250 7.4368 7.4368 7.5262 7.5262 10.0939 10.0939 10.6324 10.6324 11.7603 11.7603 12.1912 12.1912 12.2242 12.2242 12.6056 12.6056 k = 0.0000 0.4000-0.0000 ( 5306 PWs) bands (ev): -16.5581 -16.5581 -16.5420 -16.5420 -16.5299 -16.5299 -16.5218 -16.5218 -13.7235 -13.7235 -13.6617 -13.6617 -13.5783 -13.5783 -13.5682 -13.5682 -13.5210 -13.5210 -13.5196 -13.5196 -10.6963 -10.6963 -9.9394 -9.9394 -3.9951 -3.9951 -3.9577 -3.9577 -2.4882 -2.4882 -1.8240 -1.8240 2.5180 2.5180 3.0128 3.0128 3.2928 3.2928 3.8684 3.8684 4.2262 4.2262 4.3167 4.3167 5.6170 5.6170 6.2553 6.2553 6.7845 6.7845 7.0088 7.0088 7.4507 7.4507 7.5323 7.5323 10.1364 10.1364 10.6234 10.6234 11.7885 11.7885 12.1984 12.1984 12.2562 12.2562 12.5836 12.5836 k = 0.0000 0.4125-0.0000 ( 5312 PWs) bands (ev): -16.5572 -16.5572 -16.5430 -16.5430 -16.5294 -16.5294 -16.5222 -16.5222 -13.7206 -13.7206 -13.6664 -13.6664 -13.5778 -13.5778 -13.5689 -13.5689 -13.5203 -13.5203 -13.5192 -13.5192 -10.6483 -10.6483 -9.9829 -9.9829 -3.9735 -3.9735 -3.9361 -3.9361 -2.4812 -2.4812 -1.8929 -1.8929 2.5497 2.5497 3.0187 3.0187 3.2748 3.2748 3.8216 3.8216 4.2108 4.2108 4.2924 4.2924 5.6490 5.6490 6.2187 6.2187 6.7950 6.7950 6.9920 6.9920 7.4642 7.4642 7.5373 7.5373 10.1782 10.1782 10.6105 10.6105 11.8174 11.8174 12.1975 12.1975 12.2904 12.2904 12.5664 12.5664 k = 0.0000 0.4250-0.0000 ( 5308 PWs) bands (ev): -16.5563 -16.5563 -16.5440 -16.5440 -16.5288 -16.5288 -16.5227 -16.5227 -13.7176 -13.7176 -13.6710 -13.6710 -13.5772 -13.5772 -13.5696 -13.5696 -13.5198 -13.5198 -13.5189 -13.5189 -10.6000 -10.6000 -10.0274 -10.0274 -3.9534 -3.9534 -3.9174 -3.9174 -2.4696 -2.4696 -1.9596 -1.9596 2.5819 2.5819 3.0071 3.0071 3.2772 3.2772 3.7748 3.7748 4.1981 4.1981 4.2707 4.2707 5.6831 5.6831 6.1799 6.1799 6.8057 6.8057 6.9750 6.9750 7.4773 7.4773 7.5412 7.5412 10.2191 10.2191 10.5941 10.5941 11.8470 11.8470 12.1892 12.1892 12.3247 12.3247 12.5537 12.5537 k = 0.0000 0.4375-0.0000 ( 5316 PWs) bands (ev): -16.5553 -16.5553 -16.5451 -16.5451 -16.5283 -16.5283 -16.5231 -16.5231 -13.7144 -13.7144 -13.6755 -13.6755 -13.5767 -13.5767 -13.5703 -13.5703 -13.5193 -13.5193 -13.5186 -13.5186 -10.5514 -10.5514 -10.0726 -10.0726 -3.9350 -3.9350 -3.9021 -3.9021 -2.4530 -2.4530 -2.0237 -2.0237 2.6148 2.6148 2.9812 2.9812 3.2968 3.2968 3.7278 3.7278 4.1884 4.1884 4.2513 4.2513 5.7193 5.7193 6.1393 6.1393 6.8169 6.8169 6.9581 6.9581 7.4896 7.4896 7.5438 7.5438 10.2590 10.2590 10.5746 10.5746 11.8773 11.8773 12.1741 12.1741 12.3582 12.3582 12.5444 12.5444 k = 0.0000 0.4500-0.0000 ( 5314 PWs) bands (ev): -16.5544 -16.5544 -16.5461 -16.5461 -16.5278 -16.5278 -16.5236 -16.5236 -13.7111 -13.7111 -13.6799 -13.6799 -13.5761 -13.5761 -13.5710 -13.5710 -13.5189 -13.5189 -13.5183 -13.5183 -10.5027 -10.5027 -10.1186 -10.1186 -3.9186 -3.9186 -3.8902 -3.8902 -2.4314 -2.4314 -2.0850 -2.0850 2.6485 2.6485 2.9470 2.9470 3.3276 3.3276 3.6807 3.6807 4.1819 4.1819 4.2341 4.2341 5.7573 5.7573 6.0973 6.0973 6.8285 6.8285 6.9415 6.9415 7.5011 7.5011 7.5450 7.5450 10.2977 10.2977 10.5521 10.5521 11.9084 11.9084 12.1532 12.1532 12.3901 12.3901 12.5366 12.5366 k = 0.0000 0.4625-0.0000 ( 5314 PWs) bands (ev): -16.5534 -16.5534 -16.5471 -16.5471 -16.5272 -16.5272 -16.5241 -16.5241 -13.7077 -13.7077 -13.6842 -13.6842 -13.5755 -13.5755 -13.5717 -13.5717 -13.5186 -13.5186 -13.5182 -13.5182 -10.4540 -10.4540 -10.1653 -10.1653 -3.9045 -3.9045 -3.8819 -3.8819 -2.4047 -2.4047 -2.1430 -2.1430 2.6830 2.6830 2.9091 2.9091 3.3649 3.3649 3.6337 3.6337 4.1785 4.1785 4.2189 4.2189 5.7969 5.7969 6.0543 6.0543 6.8406 6.8406 6.9253 6.9253 7.5115 7.5115 7.5448 7.5448 10.3351 10.3351 10.5271 10.5271 11.9401 11.9401 12.1279 12.1279 12.4198 12.4198 12.5287 12.5287 k = 0.0000 0.4750-0.0000 ( 5328 PWs) bands (ev): -16.5524 -16.5524 -16.5482 -16.5482 -16.5267 -16.5267 -16.5246 -16.5246 -13.7041 -13.7041 -13.6884 -13.6884 -13.5749 -13.5749 -13.5724 -13.5724 -13.5183 -13.5183 -13.5180 -13.5180 -10.4052 -10.4052 -10.2125 -10.2125 -3.8929 -3.8929 -3.8772 -3.8772 -2.3728 -2.3728 -2.1975 -2.1975 2.7185 2.7185 2.8700 2.8700 3.4059 3.4059 3.5868 3.5868 4.1784 4.1784 4.2059 4.2059 5.8380 5.8380 6.0107 6.0107 6.8532 6.8532 6.9097 6.9097 7.5206 7.5206 7.5430 7.5430 10.3713 10.3713 10.4998 10.4998 11.9723 11.9723 12.0995 12.0995 12.4467 12.4467 12.5189 12.5189 k = 0.0000 0.4875-0.0000 ( 5334 PWs) bands (ev): -16.5513 -16.5513 -16.5492 -16.5492 -16.5262 -16.5262 -16.5251 -16.5251 -13.7003 -13.7003 -13.6925 -13.6925 -13.5743 -13.5743 -13.5730 -13.5730 -13.5181 -13.5181 -13.5180 -13.5180 -10.3566 -10.3566 -10.2602 -10.2602 -3.8842 -3.8842 -3.8761 -3.8761 -2.3359 -2.3359 -2.2480 -2.2480 2.7550 2.7550 2.8309 2.8309 3.4493 3.4493 3.5402 3.5402 4.1812 4.1812 4.1952 4.1952 5.8802 5.8802 5.9669 5.9669 6.8664 6.8664 6.8946 6.8946 7.5284 7.5284 7.5397 7.5397 10.4059 10.4059 10.4703 10.4703 12.0047 12.0047 12.0689 12.0689 12.4703 12.4703 12.5063 12.5063 k = 0.0000 0.5000-0.0000 ( 5336 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8785 -3.8785 -3.8785 -3.8785 -2.2942 -2.2942 -2.2942 -2.2942 2.7925 2.7925 2.7925 2.7925 3.4943 3.4943 3.4943 3.4943 4.1869 4.1869 4.1869 4.1869 5.9233 5.9233 5.9233 5.9233 6.8802 6.8802 6.8802 6.8802 7.5348 7.5348 7.5348 7.5348 10.4390 10.4390 10.4390 10.4390 12.0371 12.0371 12.0371 12.0371 12.4902 12.4902 12.4902 12.4902 k = 0.0000 0.5000-0.0000 ( 5336 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8785 -3.8785 -3.8785 -3.8785 -2.2942 -2.2942 -2.2942 -2.2942 2.7925 2.7925 2.7925 2.7925 3.4943 3.4943 3.4943 3.4943 4.1869 4.1869 4.1869 4.1869 5.9233 5.9233 5.9233 5.9233 6.8802 6.8802 6.8802 6.8802 7.5348 7.5348 7.5348 7.5348 10.4390 10.4390 10.4390 10.4390 12.0371 12.0371 12.0371 12.0371 12.4902 12.4902 12.4902 12.4902 k = 0.0125 0.5000-0.0000 ( 5328 PWs) bands (ev): -16.5513 -16.5513 -16.5493 -16.5493 -16.5256 -16.5256 -16.5255 -16.5255 -13.6998 -13.6998 -13.6933 -13.6933 -13.5741 -13.5741 -13.5731 -13.5731 -13.5183 -13.5183 -13.5178 -13.5178 -10.3091 -10.3091 -10.3066 -10.3066 -3.8781 -3.8781 -3.8779 -3.8779 -2.2952 -2.2952 -2.2952 -2.2952 2.7557 2.7557 2.8185 2.8185 3.4839 3.4839 3.5174 3.5174 4.1796 4.1796 4.1962 4.1962 5.9220 5.9220 5.9245 5.9245 6.8762 6.8762 6.8792 6.8792 7.5239 7.5239 7.5353 7.5353 10.4007 10.4007 10.4783 10.4783 12.0349 12.0349 12.0412 12.0412 12.4459 12.4459 12.5354 12.5354 k = 0.0250 0.5000-0.0000 ( 5320 PWs) bands (ev): -16.5525 -16.5525 -16.5485 -16.5485 -16.5255 -16.5255 -16.5253 -16.5253 -13.7033 -13.7033 -13.6902 -13.6902 -13.5744 -13.5744 -13.5724 -13.5724 -13.5185 -13.5185 -13.5176 -13.5176 -10.3091 -10.3091 -10.3041 -10.3041 -3.8766 -3.8766 -3.8764 -3.8764 -2.2982 -2.2982 -2.2981 -2.2981 2.7114 2.7114 2.8314 2.8314 3.4889 3.4889 3.5500 3.5500 4.1740 4.1740 4.2078 4.2078 5.9205 5.9205 5.9256 5.9256 6.8672 6.8672 6.8730 6.8730 7.5026 7.5026 7.5254 7.5254 10.3635 10.3635 10.5184 10.5184 12.0323 12.0323 12.0487 12.0487 12.4049 12.4049 12.5795 12.5795 k = 0.0375 0.5000-0.0000 ( 5318 PWs) bands (ev): -16.5537 -16.5537 -16.5479 -16.5479 -16.5252 -16.5252 -16.5250 -16.5250 -13.7067 -13.7067 -13.6873 -13.6873 -13.5744 -13.5744 -13.5716 -13.5716 -13.5187 -13.5187 -13.5174 -13.5174 -10.3082 -10.3082 -10.3008 -10.3008 -3.8742 -3.8742 -3.8738 -3.8738 -2.3031 -2.3031 -2.3029 -2.3029 2.6622 2.6622 2.8307 2.8307 3.5097 3.5097 3.5889 3.5889 4.1702 4.1702 4.2220 4.2220 5.9187 5.9187 5.9265 5.9265 6.8535 6.8535 6.8618 6.8618 7.4716 7.4716 7.5056 7.5056 10.3273 10.3273 10.5589 10.5589 12.0259 12.0259 12.0599 12.0599 12.3709 12.3709 12.6216 12.6216 k = 0.0500 0.5000-0.0000 ( 5322 PWs) bands (ev): -16.5549 -16.5549 -16.5473 -16.5473 -16.5247 -16.5247 -16.5246 -16.5246 -13.7102 -13.7102 -13.6847 -13.6847 -13.5743 -13.5743 -13.5707 -13.5707 -13.5190 -13.5190 -13.5172 -13.5172 -10.3065 -10.3065 -10.2967 -10.2967 -3.8707 -3.8707 -3.8703 -3.8703 -2.3100 -2.3100 -2.3097 -2.3097 2.6104 2.6104 2.8180 2.8180 3.5448 3.5448 3.6312 3.6312 4.1682 4.1682 4.2394 4.2394 5.9166 5.9166 5.9273 5.9273 6.8352 6.8352 6.8457 6.8457 7.4312 7.4312 7.4765 7.4765 10.2921 10.2921 10.5993 10.5993 12.0120 12.0120 12.0749 12.0749 12.3477 12.3477 12.6609 12.6609 k = 0.0625 0.5000-0.0000 ( 5326 PWs) bands (ev): -16.5562 -16.5562 -16.5470 -16.5470 -16.5242 -16.5242 -16.5241 -16.5241 -13.7137 -13.7137 -13.6823 -13.6823 -13.5739 -13.5739 -13.5698 -13.5698 -13.5192 -13.5192 -13.5170 -13.5170 -10.3040 -10.3040 -10.2918 -10.2918 -3.8664 -3.8664 -3.8658 -3.8658 -2.3189 -2.3189 -2.3184 -2.3184 2.5579 2.5579 2.7959 2.7959 3.5908 3.5908 3.6748 3.6748 4.1681 4.1681 4.2603 4.2603 5.9139 5.9139 5.9278 5.9278 6.8128 6.8128 6.8246 6.8246 7.3825 7.3825 7.4389 7.4389 10.2579 10.2579 10.6387 10.6387 11.9880 11.9880 12.0929 12.0929 12.3376 12.3376 12.6972 12.6972 k = 0.0750 0.5000-0.0000 ( 5322 PWs) bands (ev): -16.5574 -16.5574 -16.5468 -16.5468 -16.5238 -16.5238 -16.5234 -16.5234 -13.7171 -13.7171 -13.6803 -13.6803 -13.5732 -13.5732 -13.5688 -13.5688 -13.5195 -13.5195 -13.5168 -13.5168 -10.3006 -10.3006 -10.2862 -10.2862 -3.8610 -3.8610 -3.8603 -3.8603 -2.3296 -2.3296 -2.3289 -2.3289 2.5059 2.5059 2.7677 2.7677 3.6444 3.6444 3.7176 3.7176 4.1704 4.1704 4.2855 4.2855 5.9105 5.9105 5.9278 5.9278 6.7865 6.7865 6.7990 6.7990 7.3263 7.3263 7.3939 7.3939 10.2245 10.2245 10.6763 10.6763 11.9546 11.9546 12.1130 12.1130 12.3402 12.3402 12.7305 12.7305 k = 0.0875 0.5000-0.0000 ( 5332 PWs) bands (ev): -16.5587 -16.5587 -16.5468 -16.5468 -16.5233 -16.5233 -16.5225 -16.5225 -13.7204 -13.7204 -13.6786 -13.6786 -13.5723 -13.5723 -13.5678 -13.5678 -13.5198 -13.5198 -13.5166 -13.5166 -10.2964 -10.2964 -10.2798 -10.2798 -3.8548 -3.8548 -3.8540 -3.8540 -2.3423 -2.3423 -2.3413 -2.3413 2.4552 2.4552 2.7359 2.7359 3.7019 3.7019 3.7581 3.7581 4.1757 4.1757 4.3154 4.3154 5.9061 5.9061 5.9273 5.9273 6.7570 6.7570 6.7689 6.7689 7.2636 7.2636 7.3424 7.3424 10.1921 10.1921 10.7110 10.7110 11.9144 11.9144 12.1336 12.1336 12.3528 12.3528 12.7613 12.7613 k = 0.1000 0.5000-0.0000 ( 5316 PWs) bands (ev): -16.5599 -16.5599 -16.5469 -16.5469 -16.5227 -16.5227 -16.5216 -16.5216 -13.7237 -13.7237 -13.6772 -13.6772 -13.5711 -13.5711 -13.5668 -13.5668 -13.5201 -13.5201 -13.5164 -13.5164 -10.2914 -10.2914 -10.2728 -10.2728 -3.8476 -3.8476 -3.8467 -3.8467 -2.3568 -2.3568 -2.3555 -2.3555 2.4066 2.4066 2.7024 2.7024 3.7601 3.7601 3.7951 3.7951 4.1853 4.1853 4.3504 4.3504 5.9004 5.9004 5.9260 5.9260 6.7248 6.7248 6.7348 6.7348 7.1955 7.1955 7.2857 7.2857 10.1606 10.1606 10.7418 10.7418 11.8708 11.8708 12.1530 12.1530 12.3720 12.3720 12.7901 12.7901 k = 0.1125 0.5000-0.0000 ( 5318 PWs) bands (ev): -16.5611 -16.5611 -16.5471 -16.5471 -16.5221 -16.5221 -16.5205 -16.5205 -13.7268 -13.7268 -13.6763 -13.6763 -13.5696 -13.5696 -13.5657 -13.5657 -13.5204 -13.5204 -13.5162 -13.5162 -10.2856 -10.2856 -10.2651 -10.2651 -3.8396 -3.8396 -3.8387 -3.8387 -2.3732 -2.3732 -2.3714 -2.3714 2.3607 2.3607 2.6687 2.6687 3.8154 3.8154 3.8278 3.8278 4.2010 4.2010 4.3907 4.3907 5.8929 5.8929 5.9235 5.9235 6.6908 6.6908 6.6972 6.6972 7.1229 7.1229 7.2250 7.2250 10.1301 10.1301 10.7673 10.7673 11.8266 11.8266 12.1697 12.1697 12.3954 12.3954 12.8178 12.8178 k = 0.1250 0.5000-0.0000 ( 5326 PWs) bands (ev): -16.5623 -16.5623 -16.5475 -16.5475 -16.5216 -16.5216 -16.5194 -16.5194 -13.7298 -13.7298 -13.6757 -13.6757 -13.5678 -13.5678 -13.5646 -13.5646 -13.5207 -13.5207 -13.5159 -13.5159 -10.2791 -10.2791 -10.2568 -10.2568 -3.8308 -3.8308 -3.8298 -3.8298 -2.3913 -2.3913 -2.3891 -2.3891 2.3178 2.3178 2.6360 2.6360 3.8558 3.8558 3.8643 3.8643 4.2250 4.2250 4.4359 4.4359 5.8832 5.8832 5.9195 5.9195 6.6555 6.6555 6.6564 6.6564 7.0470 7.0470 7.1613 7.1613 10.1006 10.1006 10.7865 10.7865 11.7839 11.7839 12.1818 12.1818 12.4209 12.4209 12.8452 12.8452 k = 0.1375 0.5000-0.0000 ( 5324 PWs) bands (ev): -16.5635 -16.5635 -16.5479 -16.5479 -16.5210 -16.5210 -16.5182 -16.5182 -13.7327 -13.7327 -13.6755 -13.6755 -13.5658 -13.5658 -13.5636 -13.5636 -13.5210 -13.5210 -13.5157 -13.5157 -10.2719 -10.2719 -10.2480 -10.2480 -3.8213 -3.8213 -3.8201 -3.8201 -2.4111 -2.4111 -2.4083 -2.4083 2.2783 2.2783 2.6048 2.6048 3.8790 3.8790 3.9036 3.9036 4.2594 4.2594 4.4858 4.4858 5.8708 5.8708 5.9135 5.9135 6.6131 6.6131 6.6201 6.6201 6.9687 6.9687 7.0958 7.0958 10.0722 10.0722 10.7984 10.7984 11.7443 11.7443 12.1880 12.1880 12.4474 12.4474 12.8732 12.8732 k = 0.1500 0.5000-0.0000 ( 5328 PWs) bands (ev): -16.5646 -16.5646 -16.5484 -16.5484 -16.5203 -16.5203 -16.5170 -16.5170 -13.7354 -13.7354 -13.6756 -13.6756 -13.5636 -13.5636 -13.5625 -13.5625 -13.5214 -13.5214 -13.5154 -13.5154 -10.2640 -10.2640 -10.2387 -10.2387 -3.8110 -3.8110 -3.8098 -3.8098 -2.4325 -2.4325 -2.4291 -2.4291 2.2425 2.2425 2.5759 2.5759 3.8977 3.8977 3.9318 3.9318 4.3049 4.3049 4.5394 4.5394 5.8551 5.8551 5.9049 5.9049 6.5679 6.5679 6.5851 6.5851 6.8891 6.8891 7.0297 7.0297 10.0448 10.0448 10.8021 10.8021 11.7087 11.7087 12.1872 12.1872 12.4739 12.4739 12.9024 12.9024 k = 0.1625 0.5000-0.0000 ( 5320 PWs) bands (ev): -16.5656 -16.5656 -16.5490 -16.5490 -16.5197 -16.5197 -16.5158 -16.5158 -13.7380 -13.7380 -13.6761 -13.6761 -13.5614 -13.5614 -13.5611 -13.5611 -13.5217 -13.5217 -13.5151 -13.5151 -10.2555 -10.2555 -10.2288 -10.2288 -3.8000 -3.8000 -3.7988 -3.7988 -2.4554 -2.4554 -2.4513 -2.4513 2.2104 2.2104 2.5495 2.5495 3.9123 3.9123 3.9495 3.9495 4.3600 4.3600 4.5960 4.5960 5.8355 5.8355 5.8930 5.8930 6.5217 6.5217 6.5514 6.5514 6.8093 6.8093 6.9640 6.9640 10.0186 10.0186 10.7972 10.7972 11.6777 11.6777 12.1791 12.1791 12.5001 12.5001 12.9333 12.9333 k = 0.1750 0.5000-0.0000 ( 5322 PWs) bands (ev): -16.5666 -16.5666 -16.5496 -16.5496 -16.5191 -16.5191 -16.5146 -16.5146 -13.7403 -13.7403 -13.6769 -13.6769 -13.5604 -13.5604 -13.5585 -13.5585 -13.5221 -13.5221 -13.5148 -13.5148 -10.2464 -10.2464 -10.2186 -10.2186 -3.7885 -3.7885 -3.7872 -3.7872 -2.4796 -2.4796 -2.4749 -2.4749 2.1824 2.1824 2.5261 2.5261 3.9231 3.9231 3.9586 3.9586 4.4222 4.4222 4.6547 4.6547 5.8116 5.8116 5.8771 5.8771 6.4751 6.4751 6.5193 6.5193 6.7308 6.7308 6.9000 6.9000 9.9934 9.9934 10.7836 10.7836 11.6516 11.6516 12.1636 12.1636 12.5255 12.5255 12.9658 12.9658 k = 0.1875 0.5000-0.0000 ( 5330 PWs) bands (ev): -16.5675 -16.5675 -16.5502 -16.5502 -16.5184 -16.5184 -16.5134 -16.5134 -13.7425 -13.7425 -13.6780 -13.6780 -13.5593 -13.5593 -13.5558 -13.5558 -13.5225 -13.5225 -13.5145 -13.5145 -10.2367 -10.2367 -10.2080 -10.2080 -3.7765 -3.7765 -3.7751 -3.7751 -2.5051 -2.5051 -2.4996 -2.4996 2.1584 2.1584 2.5058 2.5058 3.9305 3.9305 3.9611 3.9611 4.4889 4.4889 4.7147 4.7147 5.7830 5.7830 5.8563 5.8563 6.4290 6.4290 6.4882 6.4882 6.6556 6.6556 6.8387 6.8387 9.9692 9.9692 10.7615 10.7615 11.6300 11.6300 12.1413 12.1413 12.5500 12.5500 12.9997 12.9997 k = 0.2000 0.5000-0.0000 ( 5322 PWs) bands (ev): -16.5684 -16.5684 -16.5510 -16.5510 -16.5177 -16.5177 -16.5123 -16.5123 -13.7445 -13.7445 -13.6793 -13.6793 -13.5583 -13.5583 -13.5529 -13.5529 -13.5228 -13.5228 -13.5141 -13.5141 -10.2266 -10.2266 -10.1971 -10.1971 -3.7640 -3.7640 -3.7625 -3.7625 -2.5317 -2.5317 -2.5255 -2.5255 2.1385 2.1385 2.4887 2.4887 3.9349 3.9349 3.9585 3.9585 4.5577 4.5577 4.7751 4.7751 5.7496 5.7496 5.8301 5.8301 6.3840 6.3840 6.4557 6.4557 6.5877 6.5877 6.7814 6.7814 9.9458 9.9458 10.7316 10.7316 11.6127 11.6127 12.1131 12.1131 12.5735 12.5735 13.0345 13.0345 k = 0.2125 0.5000-0.0000 ( 5320 PWs) bands (ev): -16.5692 -16.5692 -16.5517 -16.5517 -16.5171 -16.5171 -16.5111 -16.5111 -13.7463 -13.7463 -13.6809 -13.6809 -13.5573 -13.5573 -13.5500 -13.5500 -13.5232 -13.5232 -13.5137 -13.5137 -10.2160 -10.2160 -10.1860 -10.1860 -3.7511 -3.7511 -3.7496 -3.7496 -2.5592 -2.5592 -2.5523 -2.5523 2.1228 2.1228 2.4749 2.4749 3.9365 3.9365 3.9521 3.9521 4.6269 4.6269 4.8352 4.8352 5.7116 5.7116 5.7980 5.7980 6.3403 6.3403 6.4160 6.4160 6.5336 6.5336 6.7291 6.7291 9.9230 9.9230 10.6947 10.6947 11.5988 11.5988 12.0798 12.0798 12.5958 12.5958 13.0697 13.0697 k = 0.2250 0.5000-0.0000 ( 5332 PWs) bands (ev): -16.5699 -16.5699 -16.5525 -16.5525 -16.5164 -16.5164 -16.5101 -16.5101 -13.7479 -13.7479 -13.6827 -13.6827 -13.5562 -13.5562 -13.5471 -13.5471 -13.5236 -13.5236 -13.5133 -13.5133 -10.2051 -10.2051 -10.1747 -10.1747 -3.7379 -3.7379 -3.7364 -3.7364 -2.5875 -2.5875 -2.5798 -2.5798 2.1112 2.1112 2.4645 2.4645 3.9356 3.9356 3.9424 3.9424 4.6950 4.6950 4.8941 4.8941 5.6696 5.6696 5.7600 5.7600 6.2982 6.2982 6.3650 6.3650 6.4985 6.4985 6.6830 6.6830 9.9008 9.9008 10.6517 10.6517 11.5879 11.5879 12.0427 12.0427 12.6169 12.6169 13.1045 13.1045 k = 0.2375 0.5000-0.0000 ( 5336 PWs) bands (ev): -16.5706 -16.5706 -16.5533 -16.5533 -16.5157 -16.5157 -16.5091 -16.5091 -13.7492 -13.7492 -13.6847 -13.6847 -13.5552 -13.5552 -13.5442 -13.5442 -13.5240 -13.5240 -13.5129 -13.5129 -10.1938 -10.1938 -10.1633 -10.1633 -3.7245 -3.7245 -3.7229 -3.7229 -2.6163 -2.6163 -2.6079 -2.6079 2.1037 2.1037 2.4573 2.4573 3.9300 3.9300 3.9325 3.9325 4.7605 4.7605 4.9508 4.9508 5.6244 5.6244 5.7167 5.7167 6.2574 6.2574 6.3066 6.3066 6.4789 6.4789 6.6437 6.6437 9.8789 9.8789 10.6036 10.6036 11.5793 11.5793 12.0027 12.0027 12.6365 12.6365 13.1382 13.1382 k = 0.2500 0.5000-0.0000 ( 5328 PWs) bands (ev): -16.5712 -16.5712 -16.5541 -16.5541 -16.5150 -16.5150 -16.5081 -16.5081 -13.7504 -13.7504 -13.6868 -13.6868 -13.5543 -13.5543 -13.5413 -13.5413 -13.5244 -13.5244 -13.5125 -13.5125 -10.1824 -10.1824 -10.1518 -10.1518 -3.7109 -3.7109 -3.7094 -3.7094 -2.6455 -2.6455 -2.6365 -2.6365 2.1001 2.1001 2.4534 2.4534 3.9154 3.9154 3.9274 3.9274 4.8218 4.8218 5.0041 5.0041 5.5776 5.5776 5.6695 5.6695 6.2178 6.2178 6.2470 6.2470 6.4689 6.4689 6.6118 6.6118 9.8571 9.8571 10.5511 10.5511 11.5725 11.5725 11.9610 11.9610 12.6547 12.6547 13.1700 13.1700 k = 0.2625 0.5000-0.0000 ( 5336 PWs) bands (ev): -16.5717 -16.5717 -16.5549 -16.5549 -16.5144 -16.5144 -16.5072 -16.5072 -13.7514 -13.7514 -13.6891 -13.6891 -13.5533 -13.5533 -13.5386 -13.5386 -13.5247 -13.5247 -13.5120 -13.5120 -10.1707 -10.1707 -10.1404 -10.1404 -3.6973 -3.6973 -3.6958 -3.6958 -2.6748 -2.6748 -2.6652 -2.6652 2.1005 2.1005 2.4526 2.4526 3.8988 3.8988 3.9204 3.9204 4.8766 4.8766 5.0521 5.0521 5.5314 5.5314 5.6205 5.6205 6.1792 6.1792 6.1897 6.1897 6.4650 6.4650 6.5873 6.5873 9.8353 9.8353 10.4952 10.4952 11.5672 11.5672 11.9186 11.9186 12.6713 12.6713 13.1990 13.1990 k = 0.2750 0.5000-0.0000 ( 5332 PWs) bands (ev): -16.5721 -16.5721 -16.5557 -16.5557 -16.5137 -16.5137 -16.5064 -16.5064 -13.7522 -13.7522 -13.6914 -13.6914 -13.5523 -13.5523 -13.5359 -13.5359 -13.5250 -13.5250 -13.5115 -13.5115 -10.1590 -10.1590 -10.1290 -10.1290 -3.6838 -3.6838 -3.6823 -3.6823 -2.7041 -2.7041 -2.6940 -2.6940 2.1046 2.1046 2.4546 2.4546 3.8808 3.8808 3.9118 3.9118 4.9217 4.9217 5.0918 5.0918 5.4892 5.4892 5.5733 5.5733 6.1364 6.1364 6.1417 6.1417 6.4656 6.4656 6.5697 6.5697 9.8133 9.8133 10.4366 10.4366 11.5631 11.5631 11.8763 11.8763 12.6861 12.6861 13.2242 13.2242 k = 0.2875 0.5000-0.0000 ( 5328 PWs) bands (ev): -16.5725 -16.5725 -16.5566 -16.5566 -16.5130 -16.5130 -16.5056 -16.5056 -13.7528 -13.7528 -13.6939 -13.6939 -13.5514 -13.5514 -13.5335 -13.5335 -13.5252 -13.5252 -13.5111 -13.5111 -10.1472 -10.1472 -10.1178 -10.1178 -3.6705 -3.6705 -3.6690 -3.6690 -2.7332 -2.7332 -2.7227 -2.7227 2.1123 2.1123 2.4593 2.4593 3.8616 3.8616 3.9019 3.9019 4.9526 4.9526 5.1186 5.1186 5.4558 5.4558 5.5332 5.5332 6.0877 6.0877 6.1057 6.1057 6.4696 6.4696 6.5583 6.5583 9.7910 9.7910 10.3758 10.3758 11.5600 11.5600 11.8349 11.8349 12.6992 12.6992 13.2447 13.2447 k = 0.3000 0.5000-0.0000 ( 5320 PWs) bands (ev): -16.5728 -16.5728 -16.5574 -16.5574 -16.5123 -16.5123 -16.5050 -16.5050 -13.7532 -13.7532 -13.6964 -13.6964 -13.5505 -13.5505 -13.5315 -13.5315 -13.5251 -13.5251 -13.5106 -13.5106 -10.1355 -10.1355 -10.1069 -10.1069 -3.6573 -3.6573 -3.6559 -3.6559 -2.7617 -2.7617 -2.7509 -2.7509 2.1234 2.1234 2.4663 2.4663 3.8417 3.8417 3.8908 3.8908 4.9643 4.9643 5.1261 5.1261 5.4366 5.4366 5.5070 5.5070 6.0440 6.0440 6.0713 6.0713 6.4765 6.4765 6.5523 6.5523 9.7683 9.7683 10.3137 10.3137 11.5577 11.5577 11.7950 11.7950 12.7104 12.7104 13.2596 13.2596 k = 0.3125 0.5000-0.0000 ( 5308 PWs) bands (ev): -16.5731 -16.5731 -16.5583 -16.5583 -16.5117 -16.5117 -16.5043 -16.5043 -13.7534 -13.7534 -13.6990 -13.6990 -13.5495 -13.5495 -13.5301 -13.5301 -13.5244 -13.5244 -13.5101 -13.5101 -10.1239 -10.1239 -10.0962 -10.0962 -3.6445 -3.6445 -3.6432 -3.6432 -2.7895 -2.7895 -2.7786 -2.7786 2.1377 2.1377 2.4754 2.4754 3.8215 3.8215 3.8791 3.8791 4.9539 4.9539 5.1099 5.1099 5.4349 5.4349 5.4999 5.4999 6.0052 6.0052 6.0389 6.0389 6.4857 6.4857 6.5508 6.5508 9.7453 9.7453 10.2506 10.2506 11.5561 11.5561 11.7574 11.7574 12.7200 12.7200 13.2680 13.2680 k = 0.3250 0.5000-0.0000 ( 5308 PWs) bands (ev): -16.5733 -16.5733 -16.5591 -16.5591 -16.5110 -16.5110 -16.5038 -16.5038 -13.7534 -13.7534 -13.7017 -13.7017 -13.5486 -13.5486 -13.5296 -13.5296 -13.5231 -13.5231 -13.5096 -13.5096 -10.1125 -10.1125 -10.0859 -10.0859 -3.6322 -3.6322 -3.6309 -3.6309 -2.8164 -2.8164 -2.8055 -2.8055 2.1550 2.1550 2.4861 2.4861 3.8016 3.8016 3.8668 3.8668 4.9233 4.9233 5.0719 5.0719 5.4494 5.4494 5.5105 5.5105 5.9712 5.9712 6.0088 6.0088 6.4969 6.4969 6.5531 6.5531 9.7220 9.7220 10.1873 10.1873 11.5551 11.5551 11.7223 11.7223 12.7281 12.7281 13.2696 13.2696 k = 0.3375 0.5000-0.0000 ( 5308 PWs) bands (ev): -16.5734 -16.5734 -16.5600 -16.5600 -16.5103 -16.5103 -16.5033 -16.5033 -13.7532 -13.7532 -13.7044 -13.7044 -13.5477 -13.5477 -13.5296 -13.5296 -13.5214 -13.5214 -13.5091 -13.5091 -10.1015 -10.1015 -10.0761 -10.0761 -3.6204 -3.6204 -3.6192 -3.6192 -2.8422 -2.8422 -2.8314 -2.8314 2.1749 2.1749 2.4980 2.4980 3.7824 3.7824 3.8545 3.8545 4.8780 4.8780 5.0184 5.0184 5.4752 5.4752 5.5327 5.5327 5.9417 5.9417 5.9811 5.9811 6.5097 6.5097 6.5584 6.5584 9.6985 9.6985 10.1242 10.1242 11.5545 11.5545 11.6902 11.6902 12.7349 12.7349 13.2642 13.2642 k = 0.3500 0.5000-0.0000 ( 5308 PWs) bands (ev): -16.5734 -16.5734 -16.5608 -16.5608 -16.5097 -16.5097 -16.5030 -16.5030 -13.7528 -13.7528 -13.7070 -13.7070 -13.5469 -13.5469 -13.5298 -13.5298 -13.5196 -13.5196 -13.5086 -13.5086 -10.0907 -10.0907 -10.0667 -10.0667 -3.6092 -3.6092 -3.6081 -3.6081 -2.8667 -2.8667 -2.8561 -2.8561 2.1973 2.1973 2.5105 2.5105 3.7646 3.7646 3.8424 3.8424 4.8236 4.8236 4.9559 4.9559 5.5072 5.5072 5.5610 5.5610 5.9163 5.9163 5.9559 5.9559 6.5238 6.5238 6.5660 6.5660 9.6751 9.6751 10.0619 10.0619 11.5542 11.5542 11.6613 11.6613 12.7408 12.7408 13.2520 13.2520 k = 0.3625 0.5000-0.0000 ( 5314 PWs) bands (ev): -16.5734 -16.5734 -16.5616 -16.5616 -16.5091 -16.5091 -16.5026 -16.5026 -13.7523 -13.7523 -13.7097 -13.7097 -13.5460 -13.5460 -13.5302 -13.5302 -13.5178 -13.5178 -13.5081 -13.5081 -10.0805 -10.0805 -10.0580 -10.0580 -3.5987 -3.5987 -3.5977 -3.5977 -2.8898 -2.8898 -2.8794 -2.8794 2.2217 2.2217 2.5232 2.5232 3.7487 3.7487 3.8308 3.8308 4.7642 4.7642 4.8885 4.8885 5.5418 5.5418 5.5914 5.5914 5.8947 5.8947 5.9332 5.9332 6.5388 6.5388 6.5755 6.5755 9.6520 9.6520 10.0009 10.0009 11.5541 11.5541 11.6358 11.6358 12.7462 12.7462 13.2336 13.2336 k = 0.3750 0.5000-0.0000 ( 5318 PWs) bands (ev): -16.5733 -16.5733 -16.5625 -16.5625 -16.5084 -16.5084 -16.5024 -16.5024 -13.7516 -13.7516 -13.7124 -13.7124 -13.5451 -13.5451 -13.5307 -13.5307 -13.5161 -13.5161 -13.5077 -13.5077 -10.0707 -10.0707 -10.0498 -10.0498 -3.5890 -3.5890 -3.5881 -3.5881 -2.9111 -2.9111 -2.9013 -2.9013 2.2479 2.2479 2.5353 2.5353 3.7353 3.7353 3.8201 3.8201 4.7028 4.7028 4.8190 4.8190 5.5765 5.5765 5.6217 5.6217 5.8766 5.8766 5.9129 5.9129 6.5544 6.5544 6.5862 6.5862 9.6297 9.6297 9.9419 9.9419 11.5539 11.5539 11.6137 11.6137 12.7515 12.7515 13.2100 13.2100 k = 0.3875 0.5000-0.0000 ( 5314 PWs) bands (ev): -16.5732 -16.5732 -16.5633 -16.5633 -16.5078 -16.5078 -16.5022 -16.5022 -13.7508 -13.7508 -13.7151 -13.7151 -13.5442 -13.5442 -13.5312 -13.5312 -13.5145 -13.5145 -13.5073 -13.5073 -10.0615 -10.0615 -10.0424 -10.0424 -3.5802 -3.5802 -3.5794 -3.5794 -2.9307 -2.9307 -2.9215 -2.9215 2.2755 2.2755 2.5463 2.5463 3.7249 3.7249 3.8105 3.8105 4.6416 4.6416 4.7492 4.7492 5.6100 5.6100 5.6508 5.6508 5.8615 5.8615 5.8949 5.8949 6.5703 6.5703 6.5978 6.5978 9.6085 9.6085 9.8852 9.8852 11.5537 11.5537 11.5949 11.5949 12.7573 12.7573 13.1821 13.1821 k = 0.4000 0.5000-0.0000 ( 5310 PWs) bands (ev): -16.5730 -16.5730 -16.5641 -16.5641 -16.5072 -16.5072 -16.5021 -16.5021 -13.7498 -13.7498 -13.7177 -13.7177 -13.5434 -13.5434 -13.5318 -13.5318 -13.5131 -13.5131 -13.5070 -13.5070 -10.0530 -10.0530 -10.0357 -10.0357 -3.5722 -3.5722 -3.5715 -3.5715 -2.9484 -2.9484 -2.9399 -2.9399 2.3041 2.3041 2.5555 2.5555 3.7178 3.7178 3.8022 3.8022 4.5823 4.5823 4.6807 4.6807 5.6414 5.6414 5.6777 5.6777 5.8490 5.8490 5.8789 5.8789 6.5861 6.5861 6.6097 6.6097 9.5891 9.5891 9.8313 9.8313 11.5532 11.5532 11.5793 11.5793 12.7641 12.7641 13.1511 13.1511 k = 0.4125 0.5000-0.0000 ( 5310 PWs) bands (ev): -16.5728 -16.5728 -16.5649 -16.5649 -16.5066 -16.5066 -16.5021 -16.5021 -13.7486 -13.7486 -13.7204 -13.7204 -13.5426 -13.5426 -13.5324 -13.5324 -13.5118 -13.5118 -13.5066 -13.5066 -10.0451 -10.0451 -10.0298 -10.0298 -3.5651 -3.5651 -3.5646 -3.5646 -2.9641 -2.9641 -2.9564 -2.9564 2.3333 2.3333 2.5624 2.5624 3.7144 3.7144 3.7953 3.7953 4.5261 4.5261 4.6146 4.6146 5.6700 5.6700 5.7021 5.7021 5.8389 5.8389 5.8648 5.8648 6.6015 6.6015 6.6214 6.6214 9.5717 9.5717 9.7809 9.7809 11.5525 11.5525 11.5668 11.5668 12.7722 12.7722 13.1179 13.1179 k = 0.4250 0.5000-0.0000 ( 5302 PWs) bands (ev): -16.5725 -16.5725 -16.5656 -16.5656 -16.5061 -16.5061 -16.5021 -16.5021 -13.7473 -13.7473 -13.7229 -13.7229 -13.5417 -13.5417 -13.5330 -13.5330 -13.5106 -13.5106 -13.5064 -13.5064 -10.0380 -10.0380 -10.0248 -10.0248 -3.5590 -3.5590 -3.5586 -3.5586 -2.9777 -2.9777 -2.9710 -2.9710 2.3626 2.3626 2.5664 2.5664 3.7147 3.7147 3.7898 3.7898 4.4743 4.4743 4.5521 4.5521 5.6956 5.6956 5.7236 5.7236 5.8308 5.8308 5.8525 5.8525 6.6160 6.6160 6.6326 6.6326 9.5572 9.5572 9.7343 9.7343 11.5514 11.5514 11.5570 11.5570 12.7820 12.7820 13.0836 13.0836 k = 0.4375 0.5000-0.0000 ( 5304 PWs) bands (ev): -16.5721 -16.5721 -16.5664 -16.5664 -16.5055 -16.5055 -16.5021 -16.5021 -13.7459 -13.7459 -13.7254 -13.7254 -13.5409 -13.5409 -13.5336 -13.5336 -13.5096 -13.5096 -13.5062 -13.5062 -10.0318 -10.0318 -10.0206 -10.0206 -3.5539 -3.5539 -3.5535 -3.5535 -2.9891 -2.9891 -2.9834 -2.9834 2.3916 2.3916 2.5670 2.5670 3.7184 3.7184 3.7855 3.7855 4.4282 4.4282 4.4945 4.4945 5.7180 5.7180 5.7421 5.7421 5.8244 5.8244 5.8416 5.8416 6.6292 6.6292 6.6428 6.6428 9.5459 9.5459 9.6919 9.6919 11.5499 11.5499 11.5500 11.5500 12.7940 12.7940 13.0489 13.0489 k = 0.4500 0.5000-0.0000 ( 5300 PWs) bands (ev): -16.5717 -16.5717 -16.5671 -16.5671 -16.5050 -16.5050 -16.5023 -16.5023 -13.7443 -13.7443 -13.7279 -13.7279 -13.5401 -13.5401 -13.5343 -13.5343 -13.5087 -13.5087 -13.5061 -13.5061 -10.0264 -10.0264 -10.0174 -10.0174 -3.5497 -3.5497 -3.5494 -3.5494 -2.9984 -2.9984 -2.9938 -2.9938 2.4198 2.4198 2.5641 2.5641 3.7251 3.7251 3.7819 3.7819 4.3890 4.3890 4.4431 4.4431 5.7372 5.7372 5.7575 5.7575 5.8194 5.8194 5.8320 5.8320 6.6409 6.6409 6.6515 6.6515 9.5383 9.5383 9.6541 9.6541 11.5449 11.5449 11.5482 11.5482 12.8084 12.8084 13.0147 13.0147 k = 0.4625 0.5000-0.0000 ( 5304 PWs) bands (ev): -16.5713 -16.5713 -16.5678 -16.5678 -16.5046 -16.5046 -16.5025 -16.5025 -13.7426 -13.7426 -13.7302 -13.7302 -13.5393 -13.5393 -13.5349 -13.5349 -13.5080 -13.5080 -13.5060 -13.5060 -10.0219 -10.0219 -10.0151 -10.0151 -3.5464 -3.5464 -3.5462 -3.5462 -3.0055 -3.0055 -3.0020 -3.0020 2.4468 2.4468 2.5574 2.5574 3.7339 3.7339 3.7784 3.7784 4.3581 4.3581 4.3992 4.3992 5.7533 5.7533 5.7698 5.7698 5.8155 5.8155 5.8237 5.8237 6.6506 6.6506 6.6584 6.6584 9.5350 9.5350 9.6213 9.6213 11.5419 11.5419 11.5463 11.5463 12.8254 12.8254 12.9815 12.9815 k = 0.4750 0.5000-0.0000 ( 5308 PWs) bands (ev): -16.5708 -16.5708 -16.5685 -16.5685 -16.5041 -16.5041 -16.5027 -16.5027 -13.7408 -13.7408 -13.7325 -13.7325 -13.5386 -13.5386 -13.5356 -13.5356 -13.5073 -13.5073 -13.5061 -13.5061 -10.0183 -10.0183 -10.0138 -10.0138 -3.5441 -3.5441 -3.5440 -3.5440 -3.0104 -3.0104 -3.0080 -3.0080 2.4721 2.4721 2.5470 2.5470 3.7438 3.7438 3.7744 3.7744 4.3368 4.3368 4.3645 4.3645 5.7664 5.7664 5.7786 5.7786 5.8123 5.8123 5.8165 5.8165 6.6581 6.6581 6.6633 6.6633 9.5364 9.5364 9.5936 9.5936 11.5405 11.5405 11.5443 11.5443 12.8451 12.8451 12.9498 12.9498 k = 0.4875 0.5000-0.0000 ( 5316 PWs) bands (ev): -16.5703 -16.5703 -16.5691 -16.5691 -16.5037 -16.5037 -16.5030 -16.5030 -13.7389 -13.7389 -13.7348 -13.7348 -13.5378 -13.5378 -13.5363 -13.5363 -13.5069 -13.5069 -13.5062 -13.5062 -10.0157 -10.0157 -10.0134 -10.0134 -3.5427 -3.5427 -3.5427 -3.5427 -3.0131 -3.0131 -3.0119 -3.0119 2.4952 2.4952 2.5330 2.5330 3.7535 3.7535 3.7692 3.7692 4.3262 4.3262 4.3401 4.3401 5.7764 5.7764 5.7833 5.7833 5.8099 5.8099 5.8112 5.8112 6.6632 6.6632 6.6658 6.6658 9.5428 9.5428 9.5713 9.5713 11.5403 11.5403 11.5425 11.5425 12.8675 12.8675 12.9200 12.9200 k = 0.5000 0.5000-0.0000 ( 5296 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5422 -3.5422 -3.5422 -3.5422 -3.0136 -3.0136 -3.0136 -3.0136 2.5156 2.5156 2.5156 2.5156 3.7622 3.7622 3.7622 3.7622 4.3272 4.3272 4.3272 4.3272 5.7826 5.7826 5.7826 5.7826 5.8091 5.8091 5.8091 5.8091 6.6658 6.6658 6.6658 6.6658 9.5544 9.5544 9.5544 9.5544 11.5411 11.5411 11.5411 11.5411 12.8925 12.8925 12.8925 12.8925 k = 0.5000 0.5000-0.0000 ( 5296 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5422 -3.5422 -3.5422 -3.5422 -3.0136 -3.0136 -3.0136 -3.0136 2.5156 2.5156 2.5156 2.5156 3.7622 3.7622 3.7622 3.7622 4.3272 4.3272 4.3272 4.3272 5.7826 5.7826 5.7826 5.7826 5.8091 5.8091 5.8091 5.8091 6.6658 6.6658 6.6658 6.6658 9.5544 9.5544 9.5544 9.5544 11.5411 11.5411 11.5411 11.5411 12.8925 12.8925 12.8925 12.8925 k = 0.4911 0.4911-0.0000 ( 5316 PWs) bands (ev): -16.5703 -16.5703 -16.5691 -16.5691 -16.5037 -16.5037 -16.5030 -16.5030 -13.7389 -13.7389 -13.7347 -13.7347 -13.5378 -13.5378 -13.5363 -13.5363 -13.5069 -13.5069 -13.5062 -13.5062 -10.0161 -10.0161 -10.0130 -10.0130 -3.5430 -3.5430 -3.5424 -3.5424 -3.0140 -3.0140 -3.0110 -3.0110 2.4947 2.4947 2.5334 2.5334 3.7507 3.7507 3.7721 3.7721 4.3242 4.3242 4.3422 4.3422 5.7757 5.7757 5.7841 5.7841 5.8093 5.8093 5.8117 5.8117 6.6620 6.6620 6.6669 6.6669 9.5427 9.5427 9.5715 9.5715 11.5395 11.5395 11.5433 11.5433 12.8672 12.8672 12.9203 12.9203 k = 0.4821 0.4821-0.0000 ( 5310 PWs) bands (ev): -16.5708 -16.5708 -16.5684 -16.5684 -16.5041 -16.5041 -16.5027 -16.5027 -13.7409 -13.7409 -13.7325 -13.7325 -13.5386 -13.5386 -13.5356 -13.5356 -13.5073 -13.5073 -13.5061 -13.5061 -10.0210 -10.0210 -10.0112 -10.0112 -3.5454 -3.5454 -3.5428 -3.5428 -3.0146 -3.0146 -3.0036 -3.0036 2.4702 2.4702 2.5491 2.5491 3.7279 3.7279 3.7915 3.7915 4.3246 4.3246 4.3759 4.3759 5.7625 5.7625 5.7834 5.7834 5.8104 5.8104 5.8174 5.8174 6.6518 6.6518 6.6694 6.6694 9.5363 9.5363 9.5941 9.5941 11.5362 11.5362 11.5487 11.5487 12.8444 12.8444 12.9506 12.9506 k = 0.4732 0.4732-0.0000 ( 5308 PWs) bands (ev): -16.5713 -16.5713 -16.5678 -16.5678 -16.5046 -16.5046 -16.5024 -16.5024 -13.7427 -13.7427 -13.7301 -13.7301 -13.5394 -13.5394 -13.5349 -13.5349 -13.5079 -13.5079 -13.5061 -13.5061 -10.0288 -10.0288 -10.0083 -10.0083 -3.5494 -3.5494 -3.5435 -3.5435 -3.0156 -3.0156 -2.9914 -2.9914 2.4416 2.4416 2.5637 2.5637 3.6955 3.6955 3.8221 3.8221 4.3260 4.3260 4.4263 4.4263 5.7440 5.7440 5.7816 5.7816 5.8120 5.8120 5.8246 5.8246 6.6352 6.6352 6.6734 6.6734 9.5348 9.5348 9.6222 9.6222 11.5308 11.5308 11.5576 11.5576 12.8241 12.8241 12.9832 12.9832 k = 0.4643 0.4643-0.0000 ( 5320 PWs) bands (ev): -16.5718 -16.5718 -16.5671 -16.5671 -16.5051 -16.5051 -16.5022 -16.5022 -13.7445 -13.7445 -13.7277 -13.7277 -13.5401 -13.5401 -13.5343 -13.5343 -13.5087 -13.5087 -13.5062 -13.5062 -10.0397 -10.0397 -10.0043 -10.0043 -3.5550 -3.5550 -3.5447 -3.5447 -3.0168 -3.0168 -2.9744 -2.9744 2.4095 2.4095 2.5782 2.5782 3.6576 3.6576 3.8626 3.8626 4.3281 4.3281 4.4893 4.4893 5.7205 5.7205 5.7790 5.7790 5.8141 5.8141 5.8330 5.8330 6.6126 6.6126 6.6789 6.6789 9.5377 9.5377 9.6554 9.6554 11.5236 11.5236 11.5700 11.5700 12.8061 12.8061 13.0178 13.0178 k = 0.4554 0.4554-0.0000 ( 5316 PWs) bands (ev): -16.5722 -16.5722 -16.5663 -16.5663 -16.5056 -16.5056 -16.5021 -16.5021 -13.7461 -13.7461 -13.7251 -13.7251 -13.5409 -13.5409 -13.5336 -13.5336 -13.5095 -13.5095 -13.5064 -13.5064 -10.0537 -10.0537 -9.9992 -9.9992 -3.5621 -3.5621 -3.5465 -3.5465 -3.0181 -3.0181 -2.9526 -2.9526 2.3744 2.3744 2.5933 2.5933 3.6174 3.6174 3.9112 3.9112 4.3308 4.3308 4.5614 4.5614 5.6923 5.6923 5.7755 5.7755 5.8169 5.8169 5.8431 5.8431 6.5847 6.5847 6.6860 6.6860 9.5444 9.5444 9.6933 9.6933 11.5149 11.5149 11.5859 11.5859 12.7902 12.7902 13.0541 13.0541 k = 0.4464 0.4464-0.0000 ( 5318 PWs) bands (ev): -16.5726 -16.5726 -16.5655 -16.5655 -16.5062 -16.5062 -16.5020 -16.5020 -13.7477 -13.7477 -13.7225 -13.7225 -13.5417 -13.5417 -13.5330 -13.5330 -13.5104 -13.5104 -13.5067 -13.5067 -10.0705 -10.0705 -9.9929 -9.9929 -3.5708 -3.5708 -3.5491 -3.5491 -3.0192 -3.0192 -2.9261 -2.9261 2.3372 2.3372 2.6096 2.6096 3.5773 3.5773 3.9661 3.9661 4.3341 4.3341 4.6402 4.6402 5.6597 5.6597 5.7713 5.7713 5.8204 5.8204 5.8550 5.8550 6.5521 6.5521 6.6946 6.6946 9.5541 9.5541 9.7357 9.7357 11.5049 11.5049 11.6050 11.6050 12.7764 12.7764 13.0914 13.0914 k = 0.4375 0.4375-0.0000 ( 5318 PWs) bands (ev): -16.5729 -16.5729 -16.5647 -16.5647 -16.5068 -16.5068 -16.5019 -16.5019 -13.7491 -13.7491 -13.7197 -13.7197 -13.5426 -13.5426 -13.5324 -13.5324 -13.5114 -13.5114 -13.5071 -13.5071 -10.0901 -10.0901 -9.9856 -9.9856 -3.5811 -3.5811 -3.5527 -3.5527 -3.0199 -3.0199 -2.8952 -2.8952 2.2988 2.2988 2.6273 2.6273 3.5386 3.5386 4.0251 4.0251 4.3382 4.3382 4.7240 4.7240 5.6233 5.6233 5.7662 5.7662 5.8248 5.8248 5.8690 5.8690 6.5158 6.5158 6.7046 6.7046 9.5662 9.5662 9.7819 9.7819 11.4942 11.4942 11.6272 11.6272 12.7646 12.7646 13.1292 13.1292 k = 0.4286 0.4286-0.0000 ( 5318 PWs) bands (ev): -16.5732 -16.5732 -16.5638 -16.5638 -16.5075 -16.5075 -16.5019 -16.5019 -13.7505 -13.7505 -13.7168 -13.7168 -13.5434 -13.5434 -13.5319 -13.5319 -13.5125 -13.5125 -13.5076 -13.5076 -10.1124 -10.1124 -9.9772 -9.9772 -3.5928 -3.5928 -3.5576 -3.5576 -3.0199 -3.0199 -2.8599 -2.8599 2.2599 2.2599 2.6468 2.6468 3.5024 3.5024 4.0859 4.0859 4.3435 4.3435 4.8114 4.8114 5.5838 5.5838 5.7604 5.7604 5.8301 5.8301 5.8853 5.8853 6.4769 6.4769 6.7160 6.7160 9.5797 9.5797 9.8315 9.8315 11.4829 11.4829 11.6522 11.6522 12.7546 12.7546 13.1668 13.1668 k = 0.4196 0.4196-0.0000 ( 5326 PWs) bands (ev): -16.5735 -16.5735 -16.5630 -16.5630 -16.5081 -16.5081 -16.5019 -16.5019 -13.7518 -13.7518 -13.7139 -13.7139 -13.5442 -13.5442 -13.5314 -13.5314 -13.5137 -13.5137 -13.5082 -13.5082 -10.1373 -10.1373 -9.9678 -9.9678 -3.6061 -3.6061 -3.5639 -3.5639 -3.0189 -3.0189 -2.8204 -2.8204 2.2213 2.2213 2.6681 2.6681 3.4695 3.4695 4.1451 4.1451 4.3516 4.3516 4.9013 4.9013 5.5421 5.5421 5.7538 5.7538 5.8364 5.8364 5.9043 5.9043 6.4364 6.4364 6.7288 6.7288 9.5937 9.5937 9.8840 9.8840 11.4714 11.4714 11.6798 11.6798 12.7464 12.7464 13.2032 13.2032 k = 0.4107 0.4107-0.0000 ( 5330 PWs) bands (ev): -16.5738 -16.5738 -16.5621 -16.5621 -16.5089 -16.5089 -16.5019 -16.5019 -13.7529 -13.7529 -13.7108 -13.7108 -13.5450 -13.5450 -13.5309 -13.5309 -13.5150 -13.5150 -13.5088 -13.5088 -10.1646 -10.1646 -9.9573 -9.9573 -3.6208 -3.6208 -3.5720 -3.5720 -3.0167 -3.0167 -2.7768 -2.7768 2.1837 2.1837 2.6914 2.6914 3.4402 3.4402 4.1975 4.1975 4.3656 4.3656 4.9926 4.9926 5.4992 5.4992 5.7464 5.7464 5.8433 5.8433 5.9260 5.9260 6.3958 6.3958 6.7428 6.7428 9.6074 9.6074 9.9389 9.9389 11.4599 11.4599 11.7096 11.7096 12.7402 12.7402 13.2378 13.2378 k = 0.4018 0.4018-0.0000 ( 5330 PWs) bands (ev): -16.5740 -16.5740 -16.5611 -16.5611 -16.5096 -16.5096 -16.5020 -16.5020 -13.7540 -13.7540 -13.7076 -13.7076 -13.5458 -13.5458 -13.5305 -13.5305 -13.5164 -13.5164 -13.5096 -13.5096 -10.1942 -10.1942 -9.9459 -9.9459 -3.6370 -3.6370 -3.5820 -3.5820 -3.0129 -3.0129 -2.7294 -2.7294 2.1474 2.1474 2.7167 2.7167 3.4148 3.4148 4.2355 4.2355 4.3916 4.3916 5.0840 5.0840 5.4565 5.4565 5.7383 5.7383 5.8504 5.8504 5.9510 5.9510 6.3569 6.3569 6.7581 6.7581 9.6201 9.6201 9.9957 9.9957 11.4488 11.4488 11.7410 11.7410 12.7359 12.7359 13.2697 13.2697 k = 0.3929 0.3929-0.0000 ( 5326 PWs) bands (ev): -16.5741 -16.5741 -16.5601 -16.5601 -16.5104 -16.5104 -16.5022 -16.5022 -13.7550 -13.7550 -13.7043 -13.7043 -13.5467 -13.5467 -13.5301 -13.5301 -13.5178 -13.5178 -13.5105 -13.5105 -10.2258 -10.2258 -9.9334 -9.9334 -3.6545 -3.6545 -3.5943 -3.5943 -3.0073 -3.0073 -2.6783 -2.6783 2.1130 2.1130 2.7441 2.7441 3.3938 3.3938 4.2546 4.2546 4.4321 4.4321 5.1736 5.1736 5.4162 5.4162 5.7295 5.7295 5.8566 5.8566 5.9795 5.9795 6.3218 6.3218 6.7746 6.7746 9.6309 9.6309 10.0541 10.0541 11.4381 11.4381 11.7733 11.7733 12.7336 12.7336 13.2980 13.2980 k = 0.3839 0.3839-0.0000 ( 5322 PWs) bands (ev): -16.5743 -16.5743 -16.5592 -16.5592 -16.5112 -16.5112 -16.5024 -16.5024 -13.7559 -13.7559 -13.7009 -13.7009 -13.5475 -13.5475 -13.5299 -13.5299 -13.5192 -13.5192 -13.5114 -13.5114 -10.2595 -10.2595 -9.9201 -9.9201 -3.6733 -3.6733 -3.6087 -3.6087 -2.9997 -2.9997 -2.6238 -2.6238 2.0806 2.0806 2.7735 2.7735 3.3770 3.3770 4.2580 4.2580 4.4821 4.4821 5.2550 5.2550 5.3847 5.3847 5.7200 5.7200 5.8603 5.8603 6.0118 6.0118 6.2933 6.2933 6.7922 6.7922 9.6393 9.6393 10.1136 10.1136 11.4280 11.4280 11.8060 11.8060 12.7336 12.7336 13.3220 13.3220 k = 0.3750 0.3750-0.0000 ( 5322 PWs) bands (ev): -16.5744 -16.5744 -16.5581 -16.5581 -16.5120 -16.5120 -16.5026 -16.5026 -13.7567 -13.7567 -13.6974 -13.6974 -13.5483 -13.5483 -13.5297 -13.5297 -13.5206 -13.5206 -13.5124 -13.5124 -10.2949 -10.2949 -9.9058 -9.9058 -3.6935 -3.6935 -3.6256 -3.6256 -2.9900 -2.9900 -2.5661 -2.5661 2.0505 2.0505 2.8049 2.8049 3.3648 3.3648 4.2508 4.2508 4.5348 4.5348 5.2952 5.2952 5.3953 5.3953 5.7099 5.7099 5.8595 5.8595 6.0483 6.0483 6.2748 6.2748 6.8109 6.8109 9.6447 9.6447 10.1739 10.1739 11.4186 11.4186 11.8382 11.8382 12.7358 12.7358 13.3411 13.3411 k = 0.3661 0.3661-0.0000 ( 5324 PWs) bands (ev): -16.5744 -16.5744 -16.5571 -16.5571 -16.5129 -16.5129 -16.5028 -16.5028 -13.7574 -13.7574 -13.6939 -13.6939 -13.5492 -13.5492 -13.5296 -13.5296 -13.5220 -13.5220 -13.5135 -13.5135 -10.3319 -10.3319 -9.8907 -9.8907 -3.7148 -3.7148 -3.6448 -3.6448 -2.9782 -2.9782 -2.5054 -2.5054 2.0228 2.0228 2.8382 2.8382 3.3571 3.3571 4.2356 4.2356 4.5860 4.5860 5.2791 5.2791 5.4627 5.4627 5.6992 5.6992 5.8525 5.8525 6.0892 6.0892 6.2693 6.2693 6.8306 6.8306 9.6468 9.6468 10.2346 10.2346 11.4098 11.4098 11.8693 11.8693 12.7403 12.7403 13.3549 13.3549 k = 0.3571 0.3571-0.0000 ( 5328 PWs) bands (ev): -16.5745 -16.5745 -16.5560 -16.5560 -16.5138 -16.5138 -16.5031 -16.5031 -13.7581 -13.7581 -13.6902 -13.6902 -13.5500 -13.5500 -13.5298 -13.5298 -13.5233 -13.5233 -13.5146 -13.5146 -10.3704 -10.3704 -9.8748 -9.8748 -3.7372 -3.7372 -3.6663 -3.6663 -2.9641 -2.9641 -2.4419 -2.4419 1.9977 1.9977 2.8736 2.8736 3.3539 3.3539 4.2133 4.2133 4.6337 4.6337 5.2545 5.2545 5.5389 5.5389 5.6880 5.6880 5.8388 5.8388 6.1344 6.1344 6.2790 6.2790 6.8514 6.8514 9.6452 9.6452 10.2953 10.2953 11.4016 11.4016 11.8984 11.8984 12.7469 12.7469 13.3631 13.3631 k = 0.3482 0.3482-0.0000 ( 5328 PWs) bands (ev): -16.5745 -16.5745 -16.5550 -16.5550 -16.5147 -16.5147 -16.5035 -16.5035 -13.7586 -13.7586 -13.6864 -13.6864 -13.5509 -13.5509 -13.5303 -13.5303 -13.5243 -13.5243 -13.5158 -13.5158 -10.4101 -10.4101 -9.8582 -9.8582 -3.7607 -3.7607 -3.6899 -3.6899 -2.9478 -2.9478 -2.3759 -2.3759 1.9751 1.9751 2.9109 2.9109 3.3551 3.3551 4.1842 4.1842 4.6767 4.6767 5.2328 5.2328 5.6105 5.6105 5.6770 5.6770 5.8199 5.8199 6.1837 6.1837 6.3040 6.3040 6.8732 6.8732 9.6400 9.6400 10.3556 10.3556 11.3940 11.3940 11.9253 11.9253 12.7552 12.7552 13.3658 13.3658 k = 0.3393 0.3393-0.0000 ( 5328 PWs) bands (ev): -16.5744 -16.5744 -16.5539 -16.5539 -16.5156 -16.5156 -16.5039 -16.5039 -13.7590 -13.7590 -13.6825 -13.6825 -13.5517 -13.5517 -13.5311 -13.5311 -13.5250 -13.5250 -13.5170 -13.5170 -10.4510 -10.4510 -9.8408 -9.8408 -3.7852 -3.7852 -3.7157 -3.7157 -2.9294 -2.9294 -2.3076 -2.3076 1.9551 1.9551 2.9500 2.9500 3.3606 3.3606 4.1489 4.1489 4.7144 4.7144 5.2163 5.2163 5.6558 5.6558 5.6829 5.6829 5.8005 5.8005 6.2367 6.2367 6.3433 6.3433 6.8960 6.8960 9.6309 9.6309 10.4153 10.4153 11.3867 11.3867 11.9494 11.9494 12.7646 12.7646 13.3632 13.3632 k = 0.3304 0.3304-0.0000 ( 5324 PWs) bands (ev): -16.5744 -16.5744 -16.5528 -16.5528 -16.5165 -16.5165 -16.5043 -16.5043 -13.7594 -13.7594 -13.6785 -13.6785 -13.5526 -13.5526 -13.5322 -13.5322 -13.5255 -13.5255 -13.5183 -13.5183 -10.4928 -10.4928 -9.8227 -9.8227 -3.8106 -3.8106 -3.7433 -3.7433 -2.9090 -2.9090 -2.2372 -2.2372 1.9377 1.9377 2.9910 2.9910 3.3702 3.3702 4.1076 4.1076 4.7468 4.7468 5.2048 5.2048 5.6471 5.6471 5.7202 5.7202 5.7956 5.7956 6.2928 6.2928 6.3945 6.3945 6.9199 6.9199 9.6183 9.6183 10.4737 10.4737 11.3796 11.3796 11.9709 11.9709 12.7742 12.7742 13.3556 13.3556 k = 0.3214 0.3214-0.0000 ( 5318 PWs) bands (ev): -16.5743 -16.5743 -16.5516 -16.5516 -16.5175 -16.5175 -16.5047 -16.5047 -13.7597 -13.7597 -13.6744 -13.6744 -13.5536 -13.5536 -13.5335 -13.5335 -13.5258 -13.5258 -13.5196 -13.5196 -10.5354 -10.5354 -9.8040 -9.8040 -3.8368 -3.8368 -3.7726 -3.7726 -2.8867 -2.8867 -2.1650 -2.1650 1.9228 1.9228 3.0336 3.0336 3.3835 3.3835 4.0614 4.0614 4.7743 4.7743 5.1976 5.1976 5.6341 5.6341 5.7200 5.7200 5.8273 5.8273 6.3510 6.3510 6.4553 6.4553 6.9450 6.9450 9.6023 9.6023 10.5306 10.5306 11.3725 11.3725 11.9901 11.9901 12.7828 12.7828 13.3435 13.3435 k = 0.3125 0.3125-0.0000 ( 5326 PWs) bands (ev): -16.5742 -16.5742 -16.5505 -16.5505 -16.5184 -16.5184 -16.5052 -16.5052 -13.7599 -13.7599 -13.6703 -13.6703 -13.5545 -13.5545 -13.5350 -13.5350 -13.5259 -13.5259 -13.5209 -13.5209 -10.5787 -10.5787 -9.7848 -9.7848 -3.8638 -3.8638 -3.8034 -3.8034 -2.8626 -2.8626 -2.0911 -2.0911 1.9103 1.9103 3.0780 3.0780 3.3999 3.3999 4.0112 4.0112 4.7978 4.7978 5.1932 5.1932 5.6207 5.6207 5.7041 5.7041 5.8725 5.8725 6.4105 6.4105 6.5231 6.5231 6.9714 6.9714 9.5833 9.5833 10.5855 10.5855 11.3649 11.3649 12.0076 12.0076 12.7893 12.7893 13.3274 13.3274 k = 0.3036 0.3036-0.0000 ( 5314 PWs) bands (ev): -16.5741 -16.5741 -16.5494 -16.5494 -16.5194 -16.5194 -16.5057 -16.5057 -13.7600 -13.7600 -13.6661 -13.6661 -13.5555 -13.5555 -13.5365 -13.5365 -13.5261 -13.5261 -13.5222 -13.5222 -10.6225 -10.6225 -9.7650 -9.7650 -3.8913 -3.8913 -3.8354 -3.8354 -2.8369 -2.8369 -2.0159 -2.0159 1.9001 1.9001 3.1239 3.1239 3.4185 3.4185 3.9588 3.9588 4.8181 4.8181 5.1896 5.1896 5.6077 5.6077 5.6890 5.6890 5.9171 5.9171 6.4701 6.4701 6.5952 6.5952 6.9994 6.9994 9.5616 9.5616 10.6380 10.6380 11.3567 11.3567 12.0243 12.0243 12.7922 12.7922 13.3079 13.3079 k = 0.2946 0.2946-0.0000 ( 5320 PWs) bands (ev): -16.5739 -16.5739 -16.5482 -16.5482 -16.5204 -16.5204 -16.5062 -16.5062 -13.7600 -13.7600 -13.6618 -13.6618 -13.5566 -13.5566 -13.5380 -13.5380 -13.5262 -13.5262 -13.5235 -13.5235 -10.6666 -10.6666 -9.7448 -9.7448 -3.9194 -3.9194 -3.8686 -3.8686 -2.8096 -2.8096 -1.9396 -1.9396 1.8921 1.8921 3.1714 3.1714 3.4377 3.4377 3.9065 3.9065 4.8362 4.8362 5.1852 5.1852 5.5953 5.5953 5.6787 5.6787 5.9591 5.9591 6.5287 6.5287 6.6692 6.6692 7.0294 7.0294 9.5379 9.5379 10.6875 10.6875 11.3472 11.3472 12.0409 12.0409 12.7906 12.7906 13.2854 13.2854 k = 0.2857 0.2857-0.0000 ( 5326 PWs) bands (ev): -16.5737 -16.5737 -16.5471 -16.5471 -16.5214 -16.5214 -16.5067 -16.5067 -13.7600 -13.7600 -13.6574 -13.6574 -13.5577 -13.5577 -13.5394 -13.5394 -13.5263 -13.5263 -13.5248 -13.5248 -10.7109 -10.7109 -9.7242 -9.7242 -3.9480 -3.9480 -3.9027 -3.9027 -2.7810 -2.7810 -1.8623 -1.8623 1.8861 1.8861 3.2202 3.2202 3.4546 3.4546 3.8576 3.8576 4.8530 4.8530 5.1786 5.1786 5.5834 5.5834 5.6755 5.6755 5.9985 5.9985 6.5851 6.5851 6.7425 6.7425 7.0620 7.0620 9.5127 9.5127 10.7336 10.7336 11.3361 11.3361 12.0584 12.0584 12.7836 12.7836 13.2605 13.2605 k = 0.2768 0.2768-0.0000 ( 5328 PWs) bands (ev): -16.5735 -16.5735 -16.5459 -16.5459 -16.5224 -16.5224 -16.5073 -16.5073 -13.7598 -13.7598 -13.6530 -13.6530 -13.5588 -13.5588 -13.5409 -13.5409 -13.5266 -13.5266 -13.5260 -13.5260 -10.7553 -10.7553 -9.7033 -9.7033 -3.9769 -3.9769 -3.9374 -3.9374 -2.7512 -2.7512 -1.7844 -1.7844 1.8821 1.8821 3.2704 3.2704 3.4644 3.4644 3.8176 3.8176 4.8690 4.8690 5.1694 5.1694 5.5714 5.5714 5.6804 5.6804 6.0356 6.0356 6.6384 6.6384 6.8127 6.8127 7.0977 7.0977 9.4866 9.4866 10.7756 10.7756 11.3231 11.3231 12.0776 12.0776 12.7709 12.7709 13.2337 13.2337 k = 0.2679 0.2679-0.0000 ( 5330 PWs) bands (ev): -16.5733 -16.5733 -16.5448 -16.5448 -16.5234 -16.5234 -16.5079 -16.5079 -13.7597 -13.7597 -13.6485 -13.6485 -13.5600 -13.5600 -13.5422 -13.5422 -13.5276 -13.5276 -13.5264 -13.5264 -10.7996 -10.7996 -9.6821 -9.6821 -4.0060 -4.0060 -3.9726 -3.9726 -2.7202 -2.7202 -1.7060 -1.7060 1.8799 1.8799 3.3218 3.3218 3.4605 3.4605 3.7937 3.7937 4.8850 4.8850 5.1579 5.1579 5.5588 5.5588 5.6937 5.6937 6.0709 6.0709 6.6876 6.6876 6.8774 6.8774 7.1373 7.1373 9.4606 9.4606 10.8128 10.8128 11.3083 11.3083 12.0987 12.0987 12.7526 12.7526 13.2055 13.2055 k = 0.2589 0.2589-0.0000 ( 5322 PWs) bands (ev): -16.5730 -16.5730 -16.5436 -16.5436 -16.5244 -16.5244 -16.5085 -16.5085 -13.7594 -13.7594 -13.6440 -13.6440 -13.5613 -13.5613 -13.5435 -13.5435 -13.5288 -13.5288 -13.5267 -13.5267 -10.8438 -10.8438 -9.6606 -9.6606 -4.0353 -4.0353 -4.0082 -4.0082 -2.6883 -2.6883 -1.6274 -1.6274 1.8793 1.8793 3.3741 3.3741 3.4379 3.4379 3.7912 3.7912 4.9010 4.9010 5.1451 5.1451 5.5456 5.5456 5.7146 5.7146 6.1044 6.1044 6.7322 6.7322 6.9350 6.9350 7.1807 7.1807 9.4352 9.4352 10.8441 10.8441 11.2923 11.2923 12.1216 12.1216 12.7293 12.7293 13.1767 13.1767 k = 0.2500 0.2500-0.0000 ( 5324 PWs) bands (ev): -16.5727 -16.5727 -16.5425 -16.5425 -16.5254 -16.5254 -16.5091 -16.5091 -13.7591 -13.7591 -13.6395 -13.6395 -13.5626 -13.5626 -13.5447 -13.5447 -13.5299 -13.5299 -13.5269 -13.5269 -10.8876 -10.8876 -9.6390 -9.6390 -4.0647 -4.0647 -4.0438 -4.0438 -2.6555 -2.6555 -1.5487 -1.5487 1.8801 1.8801 3.3961 3.3961 3.4289 3.4289 3.8093 3.8093 4.9174 4.9174 5.1323 5.1323 5.5319 5.5319 5.7418 5.7418 6.1365 6.1365 6.7715 6.7715 6.9847 6.9847 7.2272 7.2272 9.4115 9.4115 10.8678 10.8678 11.2762 11.2762 12.1458 12.1458 12.7022 12.7022 13.1477 13.1477 k = 0.2411 0.2411-0.0000 ( 5316 PWs) bands (ev): -16.5725 -16.5725 -16.5414 -16.5414 -16.5264 -16.5264 -16.5097 -16.5097 -13.7587 -13.7587 -13.6350 -13.6350 -13.5640 -13.5640 -13.5458 -13.5458 -13.5310 -13.5310 -13.5271 -13.5271 -10.9310 -10.9310 -9.6174 -9.6174 -4.0941 -4.0941 -4.0794 -4.0794 -2.6221 -2.6221 -1.4703 -1.4703 1.8823 1.8823 3.3444 3.3444 3.4827 3.4827 3.8425 3.8425 4.9339 4.9339 5.1208 5.1208 5.5180 5.5180 5.7743 5.7743 6.1672 6.1672 6.8053 6.8053 7.0271 7.0271 7.2745 7.2745 9.3903 9.3903 10.8814 10.8814 11.2621 11.2621 12.1700 12.1700 12.6728 12.6728 13.1195 13.1195 k = 0.2321 0.2321-0.0000 ( 5312 PWs) bands (ev): -16.5721 -16.5721 -16.5403 -16.5403 -16.5274 -16.5274 -16.5104 -16.5104 -13.7583 -13.7583 -13.6305 -13.6305 -13.5653 -13.5653 -13.5469 -13.5469 -13.5320 -13.5320 -13.5273 -13.5273 -10.9739 -10.9739 -9.5957 -9.5957 -4.1236 -4.1236 -4.1146 -4.1146 -2.5881 -2.5881 -1.3924 -1.3924 1.8855 1.8855 3.2851 3.2851 3.5378 3.5378 3.8857 3.8857 4.9502 4.9502 5.1123 5.1123 5.5038 5.5038 5.8108 5.8108 6.1964 6.1964 6.8337 6.8337 7.0630 7.0630 7.3203 7.3203 9.3723 9.3723 10.8822 10.8822 11.2528 11.2528 12.1925 12.1925 12.6431 12.6431 13.0929 13.0929 k = 0.2232 0.2232-0.0000 ( 5316 PWs) bands (ev): -16.5718 -16.5718 -16.5392 -16.5392 -16.5284 -16.5284 -16.5110 -16.5110 -13.7578 -13.7578 -13.6260 -13.6260 -13.5667 -13.5667 -13.5480 -13.5480 -13.5330 -13.5330 -13.5275 -13.5275 -11.0162 -11.0162 -9.5741 -9.5741 -4.1542 -4.1542 -4.1482 -4.1482 -2.5538 -2.5538 -1.3151 -1.3151 1.8897 1.8897 3.2223 3.2223 3.5936 3.5936 3.9356 3.9356 4.9659 4.9659 5.1084 5.1084 5.4897 5.4897 5.8504 5.8504 6.2242 6.2242 6.8566 6.8566 7.0937 7.0937 7.3618 7.3618 9.3584 9.3584 10.8677 10.8677 11.2505 11.2505 12.2110 12.2110 12.6153 12.6153 13.0690 13.0690 k = 0.2143 0.2143-0.0000 ( 5310 PWs) bands (ev): -16.5715 -16.5715 -16.5381 -16.5381 -16.5294 -16.5294 -16.5117 -16.5117 -13.7573 -13.7573 -13.6216 -13.6216 -13.5681 -13.5681 -13.5490 -13.5490 -13.5338 -13.5338 -13.5277 -13.5277 -11.0576 -11.0576 -9.5526 -9.5526 -4.1872 -4.1872 -4.1785 -4.1785 -2.5191 -2.5191 -1.2387 -1.2387 1.8948 1.8948 3.1579 3.1579 3.6498 3.6498 3.9900 3.9900 4.9803 4.9803 5.1104 5.1104 5.4757 5.4757 5.8924 5.8924 6.2504 6.2504 6.8745 6.8745 7.1201 7.1201 7.3971 7.3971 9.3489 9.3489 10.8372 10.8372 11.2558 11.2558 12.2235 12.2235 12.5913 12.5913 13.0491 13.0491 k = 0.2054 0.2054-0.0000 ( 5324 PWs) bands (ev): -16.5711 -16.5711 -16.5370 -16.5370 -16.5304 -16.5304 -16.5123 -16.5123 -13.7567 -13.7567 -13.6173 -13.6173 -13.5695 -13.5695 -13.5500 -13.5500 -13.5345 -13.5345 -13.5278 -13.5278 -11.0983 -11.0983 -9.5313 -9.5313 -4.2210 -4.2210 -4.2071 -4.2071 -2.4843 -2.4843 -1.1634 -1.1634 1.9004 1.9004 3.0934 3.0934 3.7065 3.7065 4.0476 4.0476 4.9933 4.9933 5.1192 5.1192 5.4620 5.4620 5.9359 5.9359 6.2748 6.2748 6.8876 6.8876 7.1429 7.1429 7.4247 7.4247 9.3442 9.3442 10.7919 10.7919 11.2676 11.2676 12.2290 12.2290 12.5716 12.5716 13.0345 13.0345 k = 0.1964 0.1964-0.0000 ( 5324 PWs) bands (ev): -16.5708 -16.5708 -16.5360 -16.5360 -16.5313 -16.5313 -16.5130 -16.5130 -13.7561 -13.7561 -13.6131 -13.6131 -13.5708 -13.5708 -13.5509 -13.5509 -13.5351 -13.5351 -13.5280 -13.5280 -11.1380 -11.1380 -9.5102 -9.5102 -4.2545 -4.2545 -4.2348 -4.2348 -2.4495 -2.4495 -1.0894 -1.0894 1.9065 1.9065 3.0295 3.0295 3.7633 3.7633 4.1071 4.1071 5.0059 5.0059 5.1344 5.1344 5.4488 5.4488 5.9802 5.9802 6.2975 6.2975 6.8965 6.8965 7.1625 7.1625 7.4436 7.4436 9.3442 9.3442 10.7339 10.7339 11.2840 11.2840 12.2280 12.2280 12.5553 12.5553 13.0267 13.0267 k = 0.1875 0.1875-0.0000 ( 5327 PWs) bands (ev): -16.5704 -16.5704 -16.5350 -16.5350 -16.5322 -16.5322 -16.5136 -16.5136 -13.7555 -13.7555 -13.6090 -13.6090 -13.5721 -13.5721 -13.5519 -13.5519 -13.5356 -13.5356 -13.5280 -13.5280 -11.1767 -11.1767 -9.4895 -9.4895 -4.2873 -4.2873 -4.2618 -4.2618 -2.4149 -2.4149 -1.0170 -1.0170 1.9129 1.9129 2.9670 2.9670 3.8201 3.8201 4.1675 4.1675 5.0196 5.0196 5.1548 5.1548 5.4363 5.4363 6.0246 6.0246 6.3182 6.3182 6.9018 6.9018 7.1794 7.1794 7.4536 7.4536 9.3483 9.3483 10.6651 10.6651 11.3031 11.3031 12.2227 12.2227 12.5403 12.5403 13.0268 13.0268 k = 0.1786 0.1786-0.0000 ( 5323 PWs) bands (ev): -16.5700 -16.5700 -16.5341 -16.5341 -16.5331 -16.5331 -16.5142 -16.5142 -13.7549 -13.7549 -13.6052 -13.6052 -13.5733 -13.5733 -13.5528 -13.5528 -13.5360 -13.5360 -13.5279 -13.5279 -11.2143 -11.2143 -9.4691 -9.4691 -4.3193 -4.3193 -4.2880 -4.2880 -2.3806 -2.3806 -0.9464 -0.9464 1.9193 1.9193 2.9063 2.9063 3.8768 3.8768 4.2281 4.2281 5.0360 5.0360 5.1786 5.1786 5.4250 5.4250 6.0680 6.0680 6.3371 6.3371 6.9044 6.9044 7.1937 7.1937 7.4548 7.4548 9.3558 9.3558 10.5874 10.5874 11.3236 11.3236 12.2160 12.2160 12.5241 12.5241 13.0352 13.0352 k = 0.1696 0.1696-0.0000 ( 5317 PWs) bands (ev): -16.5696 -16.5696 -16.5343 -16.5343 -16.5329 -16.5329 -16.5148 -16.5148 -13.7542 -13.7542 -13.6016 -13.6016 -13.5743 -13.5743 -13.5537 -13.5537 -13.5363 -13.5363 -13.5277 -13.5277 -11.2506 -11.2506 -9.4492 -9.4492 -4.3503 -4.3503 -4.3135 -4.3135 -2.3468 -2.3468 -0.8777 -0.8777 1.9257 1.9257 2.8479 2.8479 3.9331 3.9331 4.2881 4.2881 5.0566 5.0566 5.2041 5.2041 5.4159 5.4159 6.1094 6.1094 6.3544 6.3544 6.9049 6.9049 7.2058 7.2058 7.4478 7.4478 9.3653 9.3653 10.5023 10.5023 11.3447 11.3447 12.2105 12.2105 12.5056 12.5056 13.0514 13.0514 k = 0.1607 0.1607-0.0000 ( 5333 PWs) bands (ev): -16.5693 -16.5693 -16.5351 -16.5351 -16.5320 -16.5320 -16.5155 -16.5155 -13.7535 -13.7535 -13.5984 -13.5984 -13.5752 -13.5752 -13.5546 -13.5546 -13.5367 -13.5367 -13.5273 -13.5273 -11.2857 -11.2857 -9.4299 -9.4299 -4.3802 -4.3802 -4.3381 -4.3381 -2.3135 -2.3135 -0.8112 -0.8112 1.9318 1.9318 2.7922 2.7922 3.9888 3.9888 4.3467 4.3467 5.0820 5.0820 5.2289 5.2289 5.4103 5.4103 6.1469 6.1469 6.3710 6.3710 6.9043 6.9043 7.2157 7.2157 7.4337 7.4337 9.3755 9.3755 10.4110 10.4110 11.3660 11.3660 12.2082 12.2082 12.4848 12.4848 13.0745 13.0745 k = 0.1518 0.1518-0.0000 ( 5337 PWs) bands (ev): -16.5689 -16.5689 -16.5360 -16.5360 -16.5312 -16.5312 -16.5160 -16.5160 -13.7529 -13.7529 -13.5956 -13.5956 -13.5759 -13.5759 -13.5554 -13.5554 -13.5370 -13.5370 -13.5267 -13.5267 -11.3194 -11.3194 -9.4112 -9.4112 -4.4089 -4.4089 -4.3618 -4.3618 -2.2810 -2.2810 -0.7470 -0.7470 1.9374 1.9374 2.7394 2.7394 4.0438 4.0438 4.4036 4.4036 5.1128 5.1128 5.2500 5.2500 5.4109 5.4109 6.1786 6.1786 6.3881 6.3881 6.9034 6.9034 7.2237 7.2237 7.4137 7.4137 9.3850 9.3850 10.3150 10.3150 11.3873 11.3873 12.2103 12.2103 12.4624 12.4624 13.1030 13.1030 k = 0.1429 0.1429-0.0000 ( 5337 PWs) bands (ev): -16.5685 -16.5685 -16.5368 -16.5368 -16.5303 -16.5303 -16.5166 -16.5166 -13.7522 -13.7522 -13.5932 -13.5932 -13.5763 -13.5763 -13.5562 -13.5562 -13.5373 -13.5373 -13.5259 -13.5259 -11.3516 -11.3516 -9.3931 -9.3931 -4.4365 -4.4365 -4.3844 -4.3844 -2.2494 -2.2494 -0.6855 -0.6855 1.9424 1.9424 2.6900 2.6900 4.0980 4.0980 4.4584 4.4584 5.1487 5.1487 5.2639 5.2639 5.4208 5.4208 6.2020 6.2020 6.4076 6.4076 6.9031 6.9031 7.2299 7.2299 7.3892 7.3892 9.3920 9.3920 10.2156 10.2156 11.4085 11.4085 12.2171 12.2171 12.4400 12.4400 13.1357 13.1357 k = 0.1339 0.1339-0.0000 ( 5335 PWs) bands (ev): -16.5681 -16.5681 -16.5376 -16.5376 -16.5295 -16.5295 -16.5172 -16.5172 -13.7516 -13.7516 -13.5915 -13.5915 -13.5763 -13.5763 -13.5570 -13.5570 -13.5377 -13.5377 -13.5248 -13.5248 -11.3823 -11.3823 -9.3757 -9.3757 -4.4626 -4.4626 -4.4061 -4.4061 -2.2188 -2.2188 -0.6267 -0.6267 1.9465 1.9465 2.6442 2.6442 4.1510 4.1510 4.5110 4.5110 5.1892 5.1892 5.2687 5.2687 5.4414 5.4414 6.2154 6.2154 6.4306 6.4306 6.9039 6.9039 7.2342 7.2342 7.3616 7.3616 9.3953 9.3953 10.1141 10.1141 11.4299 11.4299 12.2287 12.2287 12.4191 12.4191 13.1716 13.1716 k = 0.1250 0.1250-0.0000 ( 5343 PWs) bands (ev): -16.5677 -16.5677 -16.5384 -16.5384 -16.5288 -16.5288 -16.5177 -16.5177 -13.7509 -13.7509 -13.5904 -13.5904 -13.5760 -13.5760 -13.5576 -13.5576 -13.5382 -13.5382 -13.5235 -13.5235 -11.4115 -11.4115 -9.3591 -9.3591 -4.4875 -4.4875 -4.4266 -4.4266 -2.1893 -2.1893 -0.5708 -0.5708 1.9495 1.9495 2.6022 2.6022 4.2028 4.2028 4.5615 4.5615 5.2329 5.2329 5.2662 5.2662 5.4710 5.4710 6.2187 6.2187 6.4571 6.4571 6.9061 6.9061 7.2368 7.2368 7.3326 7.3326 9.3933 9.3933 10.0122 10.0122 11.4511 11.4511 12.2446 12.2446 12.4013 12.4013 13.2097 13.2097 k = 0.1161 0.1161-0.0000 ( 5345 PWs) bands (ev): -16.5673 -16.5673 -16.5392 -16.5392 -16.5280 -16.5280 -16.5182 -16.5182 -13.7503 -13.7503 -13.5898 -13.5898 -13.5754 -13.5754 -13.5581 -13.5581 -13.5386 -13.5386 -13.5219 -13.5219 -11.4389 -11.4389 -9.3434 -9.3434 -4.5108 -4.5108 -4.4459 -4.4459 -2.1612 -2.1612 -0.5181 -0.5181 1.9513 1.9513 2.5642 2.5642 4.2533 4.2533 4.6101 4.6101 5.2570 5.2570 5.2804 5.2804 5.5068 5.5068 6.2132 6.2132 6.4858 6.4858 6.9101 6.9101 7.2378 7.2378 7.3039 7.3039 9.3847 9.3847 9.9119 9.9119 11.4721 11.4721 12.2640 12.2640 12.3881 12.3881 13.2492 13.2492 k = 0.1071 0.1071-0.0000 ( 5339 PWs) bands (ev): -16.5669 -16.5669 -16.5399 -16.5399 -16.5274 -16.5274 -16.5187 -16.5187 -13.7497 -13.7497 -13.5896 -13.5896 -13.5746 -13.5746 -13.5586 -13.5586 -13.5391 -13.5391 -13.5202 -13.5202 -11.4646 -11.4646 -9.3286 -9.3286 -4.5326 -4.5326 -4.4640 -4.4640 -2.1346 -2.1346 -0.4687 -0.4687 1.9517 1.9517 2.5305 2.5305 4.3024 4.3024 4.6572 4.6572 5.2467 5.2467 5.3262 5.3262 5.5464 5.5464 6.2010 6.2010 6.5147 6.5147 6.9156 6.9156 7.2372 7.2372 7.2768 7.2768 9.3678 9.3678 9.8156 9.8156 11.4922 11.4922 12.2859 12.2859 12.3811 12.3811 13.2893 13.2893 k = 0.0982 0.0982-0.0000 ( 5337 PWs) bands (ev): -16.5665 -16.5665 -16.5406 -16.5406 -16.5268 -16.5268 -16.5191 -16.5191 -13.7491 -13.7491 -13.5897 -13.5897 -13.5739 -13.5739 -13.5589 -13.5589 -13.5397 -13.5397 -13.5184 -13.5184 -11.4886 -11.4886 -9.3148 -9.3148 -4.5529 -4.5529 -4.4809 -4.4809 -2.1095 -2.1095 -0.4227 -0.4227 1.9508 1.9508 2.5010 2.5010 4.3500 4.3500 4.7028 4.7028 5.2340 5.2340 5.3710 5.3710 5.5883 5.5883 6.1844 6.1844 6.5423 6.5423 6.9226 6.9226 7.2350 7.2350 7.2531 7.2531 9.3406 9.3406 9.7266 9.7266 11.5110 11.5110 12.3088 12.3088 12.3816 12.3816 13.3291 13.3291 k = 0.0893 0.0893-0.0000 ( 5325 PWs) bands (ev): -16.5662 -16.5662 -16.5412 -16.5412 -16.5262 -16.5262 -16.5195 -16.5195 -13.7486 -13.7486 -13.5900 -13.5900 -13.5732 -13.5732 -13.5590 -13.5590 -13.5402 -13.5402 -13.5165 -13.5165 -11.5106 -11.5106 -9.3019 -9.3019 -4.5716 -4.5716 -4.4964 -4.4964 -2.0862 -2.0862 -0.3802 -0.3802 1.9484 1.9484 2.4757 2.4757 4.3960 4.3960 4.7472 4.7472 5.2201 5.2201 5.4124 5.4124 5.6316 5.6316 6.1651 6.1651 6.5674 6.5674 6.9310 6.9310 7.2301 7.2301 7.2353 7.2353 9.3010 9.3010 9.6485 9.6485 11.5277 11.5277 12.3313 12.3313 12.3909 12.3909 13.3674 13.3674 k = 0.0804 0.0804-0.0000 ( 5333 PWs) bands (ev): -16.5658 -16.5658 -16.5418 -16.5418 -16.5257 -16.5257 -16.5199 -16.5199 -13.7481 -13.7481 -13.5903 -13.5903 -13.5727 -13.5727 -13.5591 -13.5591 -13.5407 -13.5407 -13.5146 -13.5146 -11.5308 -11.5308 -9.2902 -9.2902 -4.5886 -4.5886 -4.5105 -4.5105 -2.0647 -2.0647 -0.3415 -0.3415 1.9449 1.9449 2.4545 2.4545 4.4404 4.4404 4.7902 4.7902 5.2055 5.2055 5.4486 5.4486 5.6750 5.6750 6.1450 6.1450 6.5889 6.5889 6.9407 6.9407 7.2180 7.2180 7.2289 7.2289 9.2482 9.2482 9.5839 9.5839 11.5419 11.5419 12.3530 12.3530 12.4084 12.4084 13.4019 13.4019 k = 0.0714 0.0714-0.0000 ( 5335 PWs) bands (ev): -16.5655 -16.5655 -16.5424 -16.5424 -16.5252 -16.5252 -16.5202 -16.5202 -13.7476 -13.7476 -13.5907 -13.5907 -13.5723 -13.5723 -13.5590 -13.5590 -13.5413 -13.5413 -13.5128 -13.5128 -11.5489 -11.5489 -9.2795 -9.2795 -4.6040 -4.6040 -4.5233 -4.5233 -2.0451 -2.0451 -0.3066 -0.3066 1.9403 1.9403 2.4371 2.4371 4.4829 4.4829 4.8315 4.8315 5.1906 5.1906 5.4784 5.4784 5.7174 5.7174 6.1256 6.1256 6.6066 6.6066 6.9517 6.9517 7.2085 7.2085 7.2244 7.2244 9.1840 9.1840 9.5328 9.5328 11.5533 11.5533 12.3753 12.3753 12.4315 12.4315 13.4291 13.4291 k = 0.0625 0.0625-0.0000 ( 5331 PWs) bands (ev): -16.5652 -16.5652 -16.5429 -16.5429 -16.5248 -16.5248 -16.5205 -16.5205 -13.7472 -13.7472 -13.5911 -13.5911 -13.5721 -13.5721 -13.5588 -13.5588 -13.5418 -13.5418 -13.5110 -13.5110 -11.5651 -11.5651 -9.2700 -9.2700 -4.6176 -4.6176 -4.5347 -4.5347 -2.0276 -2.0276 -0.2755 -0.2755 1.9351 1.9351 2.4232 2.4232 4.5233 4.5233 4.8708 4.8708 5.1759 5.1759 5.5007 5.5007 5.7574 5.7574 6.1083 6.1083 6.6202 6.6202 6.9643 6.9643 7.2021 7.2021 7.2213 7.2213 9.1132 9.1132 9.4931 9.4931 11.5618 11.5618 12.3994 12.3994 12.4570 12.4570 13.4435 13.4435 k = 0.0536 0.0536-0.0000 ( 5325 PWs) bands (ev): -16.5650 -16.5650 -16.5433 -16.5433 -16.5245 -16.5245 -16.5207 -16.5207 -13.7469 -13.7469 -13.5914 -13.5914 -13.5719 -13.5719 -13.5586 -13.5586 -13.5422 -13.5422 -13.5094 -13.5094 -11.5792 -11.5792 -9.2617 -9.2617 -4.6294 -4.6294 -4.5446 -4.5446 -2.0122 -2.0122 -0.2484 -0.2484 1.9295 1.9295 2.4122 2.4122 4.5612 4.5612 4.9072 4.9072 5.1619 5.1619 5.5156 5.5156 5.7937 5.7937 6.0943 6.0943 6.6301 6.6301 6.9783 6.9783 7.1965 7.1965 7.2214 7.2214 9.0408 9.0408 9.4617 9.4617 11.5679 11.5679 12.4253 12.4253 12.4825 12.4825 13.4400 13.4400 k = 0.0446 0.0446-0.0000 ( 5317 PWs) bands (ev): -16.5647 -16.5647 -16.5437 -16.5437 -16.5242 -16.5242 -16.5209 -16.5209 -13.7466 -13.7466 -13.5917 -13.5917 -13.5718 -13.5718 -13.5584 -13.5584 -13.5427 -13.5427 -13.5079 -13.5079 -11.5912 -11.5912 -9.2546 -9.2546 -4.6395 -4.6395 -4.5530 -4.5530 -1.9990 -1.9990 -0.2254 -0.2254 1.9240 1.9240 2.4039 2.4039 4.5961 4.5961 4.9395 4.9395 5.1495 5.1495 5.5233 5.5233 5.8250 5.8250 6.0841 6.0841 6.6369 6.6369 6.9935 6.9935 7.1899 7.1899 7.2255 7.2255 8.9717 8.9717 9.4365 9.4365 11.5718 11.5718 12.4522 12.4522 12.5061 12.5061 13.4207 13.4207 k = 0.0357 0.0357-0.0000 ( 5311 PWs) bands (ev): -16.5645 -16.5645 -16.5440 -16.5440 -16.5240 -16.5240 -16.5210 -16.5210 -13.7463 -13.7463 -13.5920 -13.5920 -13.5718 -13.5718 -13.5582 -13.5582 -13.5430 -13.5430 -13.5067 -13.5067 -11.6011 -11.6011 -9.2487 -9.2487 -4.6477 -4.6477 -4.5599 -4.5599 -1.9882 -1.9882 -0.2065 -0.2065 1.9190 1.9190 2.3977 2.3977 4.6272 4.6272 4.9663 4.9663 5.1399 5.1399 5.5250 5.5250 5.8505 5.8505 6.0779 6.0779 6.6413 6.6413 7.0090 7.0090 7.1824 7.1824 7.2322 7.2322 8.9095 8.9095 9.4165 9.4165 11.5741 11.5741 12.4786 12.4786 12.5263 12.5263 13.3938 13.3938 k = 0.0268 0.0268-0.0000 ( 5303 PWs) bands (ev): -16.5644 -16.5644 -16.5443 -16.5443 -16.5239 -16.5239 -16.5211 -16.5211 -13.7461 -13.7461 -13.5922 -13.5922 -13.5718 -13.5718 -13.5580 -13.5580 -13.5433 -13.5433 -13.5057 -13.5057 -11.6088 -11.6088 -9.2442 -9.2442 -4.6542 -4.6542 -4.5653 -4.5653 -1.9797 -1.9797 -0.1918 -0.1918 1.9147 1.9147 2.3933 2.3933 4.6534 4.6534 4.9860 4.9860 5.1341 5.1341 5.5227 5.5227 5.8698 5.8698 6.0750 6.0750 6.6439 6.6439 7.0238 7.0238 7.1748 7.1748 7.2398 7.2398 8.8575 8.8575 9.4011 9.4011 11.5753 11.5753 12.5030 12.5030 12.5419 12.5419 13.3670 13.3670 k = 0.0179 0.0179-0.0000 ( 5301 PWs) bands (ev): -16.5642 -16.5642 -16.5445 -16.5445 -16.5238 -16.5238 -16.5212 -16.5212 -13.7460 -13.7460 -13.5923 -13.5923 -13.5718 -13.5718 -13.5578 -13.5578 -13.5436 -13.5436 -13.5050 -13.5050 -11.6143 -11.6143 -9.2409 -9.2409 -4.6588 -4.6588 -4.5691 -4.5691 -1.9735 -1.9735 -0.1812 -0.1812 1.9114 1.9114 2.3904 2.3904 4.6736 4.6736 4.9982 4.9982 5.1323 5.1323 5.5185 5.5185 5.8830 5.8830 6.0745 6.0745 6.6454 6.6454 7.0363 7.0363 7.1679 7.1679 7.2467 7.2467 8.8181 8.8181 9.3901 9.3901 11.5758 11.5758 12.5237 12.5237 12.5519 12.5519 13.3453 13.3453 k = 0.0089 0.0089-0.0000 ( 5301 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5045 -13.5045 -11.6176 -11.6176 -9.2389 -9.2389 -4.6616 -4.6616 -4.5715 -4.5715 -1.9699 -1.9699 -0.1749 -0.1749 1.9094 1.9094 2.3888 2.3888 4.6863 4.6863 5.0040 5.0040 5.1330 5.1330 5.5148 5.5148 5.8906 5.8906 6.0748 6.0748 6.6461 6.6461 7.0449 7.0449 7.1630 7.1630 7.2515 7.2515 8.7936 8.7936 9.3834 9.3834 11.5760 11.5760 12.5391 12.5391 12.5558 12.5558 13.3314 13.3314 k = 0.0000 0.0000 0.0000 ( 5313 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5925 -13.5925 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6188 -11.6188 -9.2383 -9.2383 -4.6625 -4.6625 -4.5722 -4.5722 -1.9686 -1.9686 -0.1728 -0.1728 1.9087 1.9087 2.3883 2.3883 4.6907 4.6907 5.0056 5.0056 5.1336 5.1336 5.5134 5.5134 5.8930 5.8930 6.0750 6.0750 6.6463 6.6463 7.0480 7.0480 7.1612 7.1612 7.2531 7.2531 8.7853 8.7853 9.3812 9.3812 11.5761 11.5761 12.5460 12.5460 12.5555 12.5555 13.3266 13.3266 k = 0.0000 0.0000 0.0000 ( 5313 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5925 -13.5925 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6188 -11.6188 -9.2383 -9.2383 -4.6625 -4.6625 -4.5722 -4.5722 -1.9686 -1.9686 -0.1728 -0.1728 1.9087 1.9087 2.3883 2.3883 4.6907 4.6907 5.0056 5.0056 5.1336 5.1336 5.5134 5.5134 5.8930 5.8930 6.0750 6.0750 6.6463 6.6463 7.0480 7.0480 7.1612 7.1612 7.2531 7.2531 8.7853 8.7853 9.3812 9.3812 11.5761 11.5761 12.5460 12.5460 12.5555 12.5555 13.3266 13.3266 k = 0.0000 0.0000 0.0121 ( 5297 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7458 -13.7458 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.6684 -4.6684 -4.5658 -4.5658 -1.9698 -1.9698 -0.1719 -0.1719 1.9087 1.9087 2.3883 2.3883 4.6904 4.6904 5.0056 5.0056 5.1336 5.1336 5.5101 5.5101 5.8934 5.8934 6.0788 6.0788 6.6432 6.6432 7.0527 7.0527 7.1541 7.1541 7.2607 7.2607 8.7848 8.7848 9.3789 9.3789 11.5731 11.5731 12.5434 12.5434 12.5561 12.5561 13.3278 13.3278 k = 0.0000 0.0000 0.0243 ( 5297 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7458 -13.7458 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.6827 -4.6827 -4.5501 -4.5501 -1.9732 -1.9732 -0.1695 -0.1695 1.9087 1.9087 2.3883 2.3883 4.6893 4.6893 5.0056 5.0056 5.1335 5.1335 5.5008 5.5008 5.8945 5.8945 6.0897 6.0897 6.6344 6.6344 7.0661 7.0661 7.1371 7.1371 7.2787 7.2787 8.7835 8.7835 9.3718 9.3718 11.5643 11.5643 12.5356 12.5356 12.5579 12.5579 13.3314 13.3314 k = 0.0000 0.0000 0.0364 ( 5301 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7458 -13.7458 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.7005 -4.7005 -4.5299 -4.5299 -1.9787 -1.9787 -0.1655 -0.1655 1.9088 1.9088 2.3884 2.3884 4.6876 4.6876 5.0055 5.0055 5.1334 5.1334 5.4865 5.4865 5.8961 5.8961 6.1069 6.1069 6.6211 6.6211 7.0871 7.0871 7.1164 7.1164 7.3014 7.3014 8.7814 8.7814 9.3602 9.3602 11.5500 11.5500 12.5231 12.5231 12.5608 12.5608 13.3375 13.3375 k = 0.0000 0.0000 0.0485 ( 5309 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.7195 -4.7195 -4.5077 -4.5077 -1.9862 -1.9862 -0.1601 -0.1601 1.9089 1.9089 2.3885 2.3885 4.6852 4.6852 5.0055 5.0055 5.1333 5.1333 5.4683 5.4683 5.8979 5.8979 6.1293 6.1293 6.6047 6.6047 7.0944 7.0944 7.1141 7.1141 7.3258 7.3258 8.7787 8.7787 9.3443 9.3443 11.5307 11.5307 12.5065 12.5065 12.5647 12.5647 13.3459 13.3459 k = 0.0000 0.0000 0.0606 ( 5305 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.7385 -4.7385 -4.4847 -4.4847 -1.9955 -1.9955 -0.1536 -0.1536 1.9091 1.9091 2.3886 2.3886 4.6822 4.6822 5.0055 5.0055 5.1331 5.1331 5.4476 5.4476 5.8998 5.8998 6.1555 6.1555 6.5864 6.5864 7.0726 7.0726 7.1456 7.1456 7.3508 7.3508 8.7754 8.7754 9.3243 9.3243 11.5070 11.5070 12.4864 12.4864 12.5697 12.5697 13.3567 13.3567 k = 0.0000 0.0000 0.0728 ( 5321 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5212 -16.5212 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.7568 -4.7568 -4.4616 -4.4616 -2.0062 -2.0062 -0.1460 -0.1460 1.9092 1.9092 2.3887 2.3887 4.6787 4.6787 5.0055 5.0055 5.1329 5.1329 5.4257 5.4257 5.9017 5.9017 6.1843 6.1843 6.5675 6.5675 7.0514 7.0514 7.1803 7.1803 7.3756 7.3756 8.7719 8.7719 9.3007 9.3007 11.4797 11.4797 12.4639 12.4639 12.5756 12.5756 13.3697 13.3697 k = 0.0000 0.0000 0.0849 ( 5322 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.7743 -4.7743 -4.4388 -4.4388 -2.0180 -2.0180 -0.1377 -0.1377 1.9094 1.9094 2.3888 2.3888 4.6747 4.6747 5.0055 5.0055 5.1327 5.1327 5.4033 5.4033 5.9035 5.9035 6.2144 6.2144 6.5487 6.5487 7.0312 7.0312 7.2171 7.2171 7.3998 7.3998 8.7684 8.7684 9.2738 9.2738 11.4497 11.4497 12.4396 12.4396 12.5823 12.5823 13.3848 13.3848 k = 0.0000 0.0000 0.0970 ( 5330 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.7907 -4.7907 -4.4168 -4.4168 -2.0306 -2.0306 -0.1289 -0.1289 1.9096 1.9096 2.3889 2.3889 4.6704 4.6704 5.0055 5.0055 5.1325 5.1325 5.3814 5.3814 5.9052 5.9052 6.2449 6.2449 6.5305 6.5305 7.0122 7.0122 7.2550 7.2550 7.4231 7.4231 8.7651 8.7651 9.2442 9.2442 11.4181 11.4181 12.4144 12.4144 12.5895 12.5895 13.4020 13.4020 k = 0.0000 0.0000 0.1091 ( 5338 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.8059 -4.8059 -4.3957 -4.3957 -2.0435 -2.0435 -0.1199 -0.1199 1.9098 1.9098 2.3891 2.3891 4.6659 4.6659 5.0055 5.0055 5.1323 5.1323 5.3606 5.3606 5.9069 5.9069 6.2747 6.2747 6.5135 6.5135 6.9947 6.9947 7.2931 7.2931 7.4451 7.4451 8.7624 8.7624 9.2125 9.2125 11.3858 11.3858 12.3892 12.3892 12.5970 12.5970 13.4211 13.4211 k = 0.0000 0.0000 0.1213 ( 5334 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5438 -13.5438 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.8197 -4.8197 -4.3760 -4.3760 -2.0564 -2.0564 -0.1111 -0.1111 1.9100 1.9100 2.3892 2.3892 4.6613 4.6613 5.0054 5.0054 5.1321 5.1321 5.3411 5.3411 5.9085 5.9085 6.3031 6.3031 6.4980 6.4980 6.9787 6.9787 7.3305 7.3305 7.4656 7.4656 8.7605 8.7605 9.1794 9.1794 11.3537 11.3537 12.3647 12.3647 12.6046 12.6046 13.4418 13.4418 k = 0.0000 0.0000 0.1334 ( 5322 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.8321 -4.8321 -4.3578 -4.3578 -2.0689 -2.0689 -0.1025 -0.1025 1.9101 1.9101 2.3894 2.3894 4.6568 4.6568 5.0054 5.0054 5.1319 5.1319 5.3235 5.3235 5.9099 5.9099 6.3295 6.3295 6.4842 6.4842 6.9643 6.9643 7.3664 7.3664 7.4843 7.4843 8.7597 8.7597 9.1457 9.1457 11.3230 11.3230 12.3415 12.3415 12.6120 12.6120 13.4640 13.4640 k = 0.0000 0.0000 0.1455 ( 5330 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6187 -11.6187 -9.2383 -9.2383 -4.8429 -4.8429 -4.3414 -4.3414 -2.0806 -2.0806 -0.0946 -0.0946 1.9103 1.9103 2.3895 2.3895 4.6525 4.6525 5.0054 5.0054 5.1316 5.1316 5.3079 5.3079 5.9112 5.9112 6.3529 6.3529 6.4726 6.4726 6.9517 6.9517 7.4000 7.4000 7.5010 7.5010 8.7602 8.7602 9.1122 9.1122 11.2944 11.2944 12.3202 12.3202 12.6190 12.6190 13.4872 13.4872 k = 0.0000 0.0000 0.1576 ( 5342 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8522 -4.8522 -4.3271 -4.3271 -2.0912 -2.0912 -0.0874 -0.0874 1.9105 1.9105 2.3896 2.3896 4.6485 4.6485 5.0054 5.0054 5.1315 5.1315 5.2944 5.2944 5.9123 5.9123 6.3728 6.3728 6.4633 6.4633 6.9409 6.9409 7.4304 7.4304 7.5156 7.5156 8.7621 8.7621 9.0799 9.0799 11.2687 11.2687 12.3013 12.3013 12.6254 12.6254 13.5110 13.5110 k = 0.0000 0.0000 0.1698 ( 5350 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8598 -4.8598 -4.3151 -4.3151 -2.1003 -2.1003 -0.0813 -0.0813 1.9106 1.9106 2.3897 2.3897 4.6450 4.6450 5.0054 5.0054 5.1313 5.1313 5.2833 5.2833 5.9133 5.9133 6.3885 6.3885 6.4569 6.4569 6.9320 6.9320 7.4568 7.4568 7.5277 7.5277 8.7653 8.7653 9.0500 9.0500 11.2468 11.2468 12.2853 12.2853 12.6309 12.6309 13.5344 13.5344 k = 0.0000 0.0000 0.1819 ( 5362 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8658 -4.8658 -4.3055 -4.3055 -2.1077 -2.1077 -0.0763 -0.0763 1.9107 1.9107 2.3898 2.3898 4.6422 4.6422 5.0054 5.0054 5.1312 5.1312 5.2746 5.2746 5.9140 5.9140 6.3992 6.3992 6.4537 6.4537 6.9250 6.9250 7.4783 7.4783 7.5373 7.5373 8.7694 8.7694 9.0240 9.0240 11.2291 11.2291 12.2725 12.2725 12.6354 12.6354 13.5564 13.5564 k = 0.0000 0.0000 0.1940 ( 5358 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8701 -4.8701 -4.2986 -4.2986 -2.1132 -2.1132 -0.0727 -0.0727 1.9108 1.9108 2.3899 2.3899 4.6401 4.6401 5.0054 5.0054 5.1311 5.1311 5.2684 5.2684 5.9146 5.9146 6.4052 6.4052 6.4532 6.4532 6.9200 6.9200 7.4942 7.4942 7.5443 7.5443 8.7737 8.7737 9.0033 9.0033 11.2161 11.2161 12.2631 12.2631 12.6387 12.6387 13.5750 13.5750 k = 0.0000 0.0000 0.2061 ( 5362 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8727 -4.8727 -4.2943 -4.2943 -2.1165 -2.1165 -0.0705 -0.0705 1.9109 1.9109 2.3899 2.3899 4.6388 4.6388 5.0054 5.0054 5.1310 5.1310 5.2647 5.2647 5.9149 5.9149 6.4078 6.4078 6.4540 6.4540 6.9170 6.9170 7.5040 7.5040 7.5485 7.5485 8.7770 8.7770 8.9899 8.9899 11.2081 11.2081 12.2574 12.2574 12.6407 12.6407 13.5880 13.5880 k = 0.0000 0.0000 0.2183 ( 5366 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8736 -4.8736 -4.2929 -4.2929 -2.1177 -2.1177 -0.0698 -0.0698 1.9109 1.9109 2.3899 2.3899 4.6383 4.6383 5.0054 5.0054 5.1310 5.1310 5.2634 5.2634 5.9150 5.9150 6.4084 6.4084 6.4545 6.4545 6.9160 6.9160 7.5073 7.5073 7.5499 7.5499 8.7783 8.7783 8.9852 8.9852 11.2055 11.2055 12.2555 12.2555 12.6414 12.6414 13.5927 13.5927 k = 0.0000 0.0000 0.2183 ( 5366 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8736 -4.8736 -4.2929 -4.2929 -2.1177 -2.1177 -0.0698 -0.0698 1.9109 1.9109 2.3899 2.3899 4.6383 4.6383 5.0054 5.0054 5.1310 5.1310 5.2634 5.2634 5.9150 5.9150 6.4084 6.4084 6.4545 6.4545 6.9160 6.9160 7.5073 7.5073 7.5499 7.5499 8.7783 8.7783 8.9852 8.9852 11.2055 11.2055 12.2555 12.2555 12.6414 12.6414 13.5927 13.5927 k = 0.0000 0.0125 0.2183 ( 5362 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5045 -13.5045 -11.6175 -11.6175 -9.2389 -9.2389 -4.8726 -4.8726 -4.2923 -4.2923 -2.1185 -2.1185 -0.0723 -0.0723 1.9113 1.9113 2.3902 2.3902 4.6362 4.6362 5.0034 5.0034 5.1323 5.1323 5.2639 5.2639 5.9132 5.9132 6.4067 6.4067 6.4542 6.4542 6.9132 6.9132 7.5053 7.5053 7.5465 7.5465 8.7839 8.7839 8.9932 8.9932 11.2072 11.2072 12.2553 12.2553 12.6382 12.6382 13.5973 13.5973 k = 0.0000 0.0250 0.2183 ( 5352 PWs) bands (ev): -16.5642 -16.5642 -16.5445 -16.5445 -16.5237 -16.5237 -16.5212 -16.5212 -13.7460 -13.7460 -13.5923 -13.5923 -13.5718 -13.5718 -13.5578 -13.5578 -13.5436 -13.5436 -13.5050 -13.5050 -11.6143 -11.6143 -9.2408 -9.2408 -4.8697 -4.8697 -4.2904 -4.2904 -2.1211 -2.1211 -0.0797 -0.0797 1.9127 1.9127 2.3909 2.3909 4.6298 4.6298 4.9979 4.9979 5.1357 5.1357 5.2655 5.2655 5.9078 5.9078 6.4016 6.4016 6.4535 6.4535 6.9055 6.9055 7.4973 7.4973 7.5386 7.5386 8.8008 8.8008 9.0166 9.0166 11.2124 11.2124 12.2547 12.2547 12.6286 12.6286 13.6112 13.6112 k = 0.0000 0.0375 0.2183 ( 5350 PWs) bands (ev): -16.5644 -16.5644 -16.5443 -16.5443 -16.5238 -16.5238 -16.5212 -16.5212 -13.7461 -13.7461 -13.5922 -13.5922 -13.5718 -13.5718 -13.5580 -13.5580 -13.5433 -13.5433 -13.5057 -13.5057 -11.6089 -11.6089 -9.2441 -9.2441 -4.8649 -4.8649 -4.2872 -4.2872 -2.1254 -2.1254 -0.0921 -0.0921 1.9149 1.9149 2.3923 2.3923 4.6193 4.6193 4.9894 4.9894 5.1401 5.1401 5.2681 5.2681 5.8985 5.8985 6.3933 6.3933 6.4520 6.4520 6.8940 6.8940 7.4795 7.4795 7.5316 7.5316 8.8283 8.8283 9.0539 9.0539 11.2210 11.2210 12.2538 12.2538 12.6127 12.6127 13.6341 13.6341 k = 0.0000 0.0500 0.2183 ( 5352 PWs) bands (ev): -16.5645 -16.5645 -16.5441 -16.5441 -16.5240 -16.5240 -16.5211 -16.5211 -13.7463 -13.7463 -13.5920 -13.5920 -13.5718 -13.5718 -13.5581 -13.5581 -13.5431 -13.5431 -13.5066 -13.5066 -11.6013 -11.6013 -9.2486 -9.2486 -4.8583 -4.8583 -4.2827 -4.2827 -2.1314 -2.1314 -0.1095 -0.1095 1.9181 1.9181 2.3943 2.3943 4.6049 4.6049 4.9788 4.9788 5.1438 5.1438 5.2719 5.2719 5.8850 5.8850 6.3822 6.3822 6.4497 6.4497 6.8806 6.8806 7.4518 7.4518 7.5274 7.5274 8.8653 8.8653 9.1029 9.1029 11.2332 11.2332 12.2528 12.2528 12.5907 12.5907 13.6660 13.6660 k = 0.0000 0.0625 0.2183 ( 5344 PWs) bands (ev): -16.5647 -16.5647 -16.5438 -16.5438 -16.5241 -16.5241 -16.5210 -16.5210 -13.7465 -13.7465 -13.5918 -13.5918 -13.5720 -13.5720 -13.5582 -13.5582 -13.5427 -13.5427 -13.5079 -13.5079 -11.5916 -11.5916 -9.2545 -9.2545 -4.8497 -4.8497 -4.2770 -4.2770 -2.1389 -2.1389 -0.1316 -0.1316 1.9221 1.9221 2.3971 2.3971 4.5869 4.5869 4.9665 4.9665 5.1449 5.1449 5.2774 5.2774 5.8666 5.8666 6.3685 6.3685 6.4467 6.4467 6.8673 6.8673 7.4175 7.4175 7.5247 7.5247 8.9106 8.9106 9.1613 9.1613 11.2490 11.2490 12.2519 12.2519 12.5626 12.5626 13.7065 13.7065 k = 0.0000 0.0750 0.2183 ( 5338 PWs) bands (ev): -16.5649 -16.5649 -16.5434 -16.5434 -16.5243 -16.5243 -16.5209 -16.5209 -13.7467 -13.7467 -13.5915 -13.5915 -13.5722 -13.5722 -13.5583 -13.5583 -13.5423 -13.5423 -13.5093 -13.5093 -11.5798 -11.5798 -9.2616 -9.2616 -4.8392 -4.8392 -4.2701 -4.2701 -2.1480 -2.1480 -0.1585 -0.1585 1.9271 1.9271 2.4009 2.4009 4.5656 4.5656 4.9525 4.9525 5.1412 5.1412 5.2854 5.2854 5.8429 5.8429 6.3527 6.3527 6.4435 6.4435 6.8559 6.8559 7.3800 7.3800 7.5226 7.5226 8.9625 8.9625 9.2272 9.2272 11.2682 11.2682 12.2513 12.2513 12.5288 12.5288 13.7550 13.7550 k = 0.0000 0.0875 0.2183 ( 5338 PWs) bands (ev): -16.5651 -16.5651 -16.5430 -16.5430 -16.5246 -16.5246 -16.5207 -16.5207 -13.7470 -13.7470 -13.5913 -13.5913 -13.5725 -13.5725 -13.5583 -13.5583 -13.5419 -13.5419 -13.5109 -13.5109 -11.5660 -11.5660 -9.2701 -9.2701 -4.8269 -4.8269 -4.2620 -4.2620 -2.1586 -2.1586 -0.1901 -0.1901 1.9331 1.9331 2.4058 2.4058 4.5417 4.5417 4.9368 4.9368 5.1307 5.1307 5.2965 5.2965 5.8134 5.8134 6.3356 6.3356 6.4406 6.4406 6.8477 6.8477 7.3416 7.3416 7.5204 7.5204 9.0196 9.0196 9.2986 9.2986 11.2911 11.2911 12.2511 12.2511 12.4897 12.4897 13.7564 13.7564 k = 0.0000 0.1000 0.2183 ( 5332 PWs) bands (ev): -16.5653 -16.5653 -16.5426 -16.5426 -16.5249 -16.5249 -16.5206 -16.5206 -13.7472 -13.7472 -13.5910 -13.5910 -13.5731 -13.5731 -13.5581 -13.5581 -13.5415 -13.5415 -13.5126 -13.5126 -11.5501 -11.5501 -9.2800 -9.2800 -4.8128 -4.8128 -4.2527 -4.2527 -2.1705 -2.1705 -0.2262 -0.2262 1.9401 1.9401 2.4121 2.4121 4.5154 4.5154 4.9193 4.9193 5.1120 5.1120 5.3109 5.3109 5.7778 5.7778 6.3183 6.3183 6.4386 6.4386 6.8435 6.8435 7.3039 7.3039 7.5180 7.5180 9.0806 9.0806 9.3741 9.3741 11.3174 11.3174 12.2514 12.2514 12.4458 12.4458 13.7092 13.7092 k = 0.0000 0.1125 0.2183 ( 5332 PWs) bands (ev): -16.5655 -16.5655 -16.5422 -16.5422 -16.5252 -16.5252 -16.5205 -16.5205 -13.7475 -13.7475 -13.5908 -13.5908 -13.5739 -13.5739 -13.5579 -13.5579 -13.5411 -13.5411 -13.5144 -13.5144 -11.5322 -11.5322 -9.2912 -9.2912 -4.7968 -4.7968 -4.2424 -4.2424 -2.1837 -2.1837 -0.2666 -0.2666 1.9481 1.9481 2.4198 2.4198 4.4874 4.4874 4.8998 4.8998 5.0846 5.0846 5.3280 5.3280 5.7362 5.7362 6.3018 6.3018 6.4380 6.4380 6.8434 6.8434 7.2682 7.2682 7.5154 7.5154 9.1441 9.1441 9.4524 9.4524 11.3471 11.3471 12.2517 12.2517 12.3982 12.3982 13.6563 13.6563 k = 0.0000 0.1250 0.2183 ( 5332 PWs) bands (ev): -16.5656 -16.5656 -16.5417 -16.5417 -16.5255 -16.5255 -16.5203 -16.5203 -13.7477 -13.7477 -13.5906 -13.5906 -13.5749 -13.5749 -13.5575 -13.5575 -13.5407 -13.5407 -13.5162 -13.5162 -11.5123 -11.5123 -9.3037 -9.3037 -4.7790 -4.7790 -4.2309 -4.2309 -2.1981 -2.1981 -0.3112 -0.3112 1.9572 1.9572 2.4291 2.4291 4.4578 4.4578 4.8783 4.8783 5.0485 5.0485 5.3464 5.3464 5.6892 5.6892 6.2875 6.2875 6.4390 6.4390 6.8475 6.8475 7.2351 7.2351 7.5126 7.5126 9.2093 9.2093 9.5325 9.5325 11.3800 11.3800 12.2509 12.2509 12.3487 12.3487 13.5992 13.5992 k = 0.0000 0.1375 0.2183 ( 5328 PWs) bands (ev): -16.5658 -16.5658 -16.5412 -16.5412 -16.5259 -16.5259 -16.5201 -16.5201 -13.7479 -13.7479 -13.5905 -13.5905 -13.5761 -13.5761 -13.5570 -13.5570 -13.5403 -13.5403 -13.5179 -13.5179 -11.4906 -11.4906 -9.3177 -9.3177 -4.7594 -4.7594 -4.2184 -4.2184 -2.2134 -2.2134 -0.3599 -0.3599 1.9675 1.9675 2.4401 2.4401 4.4271 4.4271 4.8546 4.8546 5.0044 5.0044 5.3641 5.3641 5.6386 5.6386 6.2762 6.2762 6.4418 6.4418 6.8553 6.8553 7.2050 7.2050 7.5099 7.5099 9.2754 9.2754 9.6134 9.6134 11.4159 11.4159 12.2425 12.2425 12.3045 12.3045 13.5391 13.5391 k = 0.0000 0.1500 0.2183 ( 5318 PWs) bands (ev): -16.5659 -16.5659 -16.5407 -16.5407 -16.5264 -16.5264 -16.5200 -16.5200 -13.7480 -13.7480 -13.5905 -13.5905 -13.5775 -13.5775 -13.5566 -13.5566 -13.5398 -13.5398 -13.5196 -13.5196 -11.4669 -11.4669 -9.3331 -9.3331 -4.7381 -4.7381 -4.2050 -4.2050 -2.2297 -2.2297 -0.4123 -0.4123 1.9789 1.9789 2.4530 2.4530 4.3953 4.3953 4.8286 4.8286 4.9531 4.9531 5.3767 5.3767 5.5888 5.5888 6.2684 6.2684 6.4461 6.4461 6.8665 6.8665 7.1779 7.1779 7.5074 7.5074 9.3417 9.3417 9.6943 9.6943 11.4546 11.4546 12.2087 12.2087 12.2843 12.2843 13.4770 13.4770 k = 0.0000 0.1625 0.2183 ( 5314 PWs) bands (ev): -16.5660 -16.5660 -16.5402 -16.5402 -16.5268 -16.5268 -16.5198 -16.5198 -13.7480 -13.7480 -13.5908 -13.5908 -13.5789 -13.5789 -13.5561 -13.5561 -13.5394 -13.5394 -13.5210 -13.5210 -11.4415 -11.4415 -9.3499 -9.3499 -4.7152 -4.7152 -4.1906 -4.1906 -2.2466 -2.2466 -0.4684 -0.4684 1.9917 1.9917 2.4679 2.4679 4.3627 4.3627 4.8001 4.8001 4.8958 4.8958 5.3746 5.3746 5.5496 5.5496 6.2644 6.2644 6.4517 6.4517 6.8807 6.8807 7.1538 7.1538 7.5053 7.5053 9.4078 9.4078 9.7745 9.7745 11.4957 11.4957 12.1556 12.1556 12.2827 12.2827 13.4134 13.4134 k = 0.0000 0.1750 0.2183 ( 5318 PWs) bands (ev): -16.5661 -16.5661 -16.5397 -16.5397 -16.5273 -16.5273 -16.5197 -16.5197 -13.7480 -13.7480 -13.5914 -13.5914 -13.5803 -13.5803 -13.5558 -13.5558 -13.5389 -13.5389 -13.5222 -13.5222 -11.4143 -11.4143 -9.3681 -9.3681 -4.6905 -4.6905 -4.1755 -4.1755 -2.2642 -2.2642 -0.5277 -0.5277 2.0058 2.0058 2.4847 2.4847 4.3292 4.3292 4.7685 4.7685 4.8345 4.8345 5.3451 5.3451 5.5342 5.5342 6.2641 6.2641 6.4579 6.4579 6.8973 6.8973 7.1330 7.1330 7.5040 7.5040 9.4732 9.4732 9.8534 9.8534 11.5389 11.5389 12.0976 12.0976 12.2863 12.2863 13.3490 13.3490 k = 0.0000 0.1875 0.2183 ( 5320 PWs) bands (ev): -16.5661 -16.5661 -16.5392 -16.5392 -16.5278 -16.5278 -16.5196 -16.5196 -13.7478 -13.7478 -13.5924 -13.5924 -13.5815 -13.5815 -13.5557 -13.5557 -13.5384 -13.5384 -13.5232 -13.5232 -11.3853 -11.3853 -9.3878 -9.3878 -4.6643 -4.6643 -4.1595 -4.1595 -2.2821 -2.2821 -0.5902 -0.5902 2.0214 2.0214 2.5035 2.5035 4.2947 4.2947 4.7313 4.7313 4.7729 4.7729 5.2902 5.2902 5.5411 5.5411 6.2672 6.2672 6.4641 6.4641 6.9157 6.9157 7.1155 7.1155 7.5036 7.5036 9.5376 9.5376 9.9303 9.9303 11.5836 11.5836 12.0392 12.0392 12.2915 12.2915 13.2841 13.2841 k = 0.0000 0.2000 0.2183 ( 5322 PWs) bands (ev): -16.5660 -16.5660 -16.5387 -16.5387 -16.5284 -16.5284 -16.5195 -16.5195 -13.7476 -13.7476 -13.5942 -13.5942 -13.5824 -13.5824 -13.5558 -13.5558 -13.5377 -13.5377 -13.5239 -13.5239 -11.3548 -11.3548 -9.4090 -9.4090 -4.6365 -4.6365 -4.1429 -4.1429 -2.3003 -2.3003 -0.6554 -0.6554 2.0384 2.0384 2.5243 2.5243 4.2589 4.2589 4.6804 4.6804 4.7206 4.7206 5.2219 5.2219 5.5592 5.5592 6.2734 6.2734 6.4695 6.4695 6.9351 6.9351 7.1018 7.1018 7.5043 7.5043 9.6007 9.6007 10.0045 10.0045 11.6293 11.6293 11.9827 11.9827 12.2974 12.2974 13.2191 13.2191 k = 0.0000 0.2125 0.2183 ( 5330 PWs) bands (ev): -16.5659 -16.5659 -16.5382 -16.5382 -16.5290 -16.5290 -16.5194 -16.5194 -13.7472 -13.7472 -13.5965 -13.5965 -13.5829 -13.5829 -13.5561 -13.5561 -13.5369 -13.5369 -13.5244 -13.5244 -11.3226 -11.3226 -9.4316 -9.4316 -4.6073 -4.6073 -4.1257 -4.1257 -2.3186 -2.3186 -0.7232 -0.7232 2.0571 2.0571 2.5471 2.5471 4.2216 4.2216 4.6155 4.6155 4.6790 4.6790 5.1474 5.1474 5.5818 5.5818 6.2823 6.2823 6.4735 6.4735 6.9542 6.9542 7.0932 7.0932 7.5062 7.5062 9.6622 9.6622 10.0755 10.0755 11.6747 11.6747 11.9304 11.9304 12.3035 12.3035 13.1542 13.1542 k = 0.0000 0.2250 0.2183 ( 5324 PWs) bands (ev): -16.5658 -16.5658 -16.5378 -16.5378 -16.5296 -16.5296 -16.5193 -16.5193 -13.7467 -13.7467 -13.5994 -13.5994 -13.5831 -13.5831 -13.5566 -13.5566 -13.5360 -13.5360 -13.5246 -13.5246 -11.2890 -11.2890 -9.4557 -9.4557 -4.5766 -4.5766 -4.1080 -4.1080 -2.3368 -2.3368 -0.7933 -0.7933 2.0774 2.0774 2.5718 2.5718 4.1824 4.1824 4.5467 4.5467 4.6395 4.6395 5.0703 5.0703 5.6062 5.6062 6.2936 6.2936 6.4753 6.4753 6.9714 6.9714 7.0909 7.0909 7.5094 7.5094 9.7216 9.7216 10.1425 10.1425 11.7166 11.7166 11.8866 11.8866 12.3092 12.3092 13.0899 13.0899 k = 0.0000 0.2375 0.2183 ( 5328 PWs) bands (ev): -16.5656 -16.5656 -16.5373 -16.5373 -16.5302 -16.5302 -16.5193 -16.5193 -13.7461 -13.7461 -13.6028 -13.6028 -13.5831 -13.5831 -13.5572 -13.5572 -13.5349 -13.5349 -13.5247 -13.5247 -11.2538 -11.2538 -9.4812 -9.4812 -4.5447 -4.5447 -4.0898 -4.0898 -2.3547 -2.3547 -0.8653 -0.8653 2.0993 2.0993 2.5985 2.5985 4.1407 4.1407 4.4778 4.4778 4.5994 4.5994 4.9922 4.9922 5.6314 5.6314 6.3069 6.3069 6.4743 6.4743 6.9850 6.9850 7.0966 7.0966 7.5139 7.5139 9.7787 9.7787 10.2048 10.2048 11.7446 11.7446 11.8626 11.8626 12.3142 12.3142 13.0262 13.0262 k = 0.0000 0.2500 0.2183 ( 5326 PWs) bands (ev): -16.5653 -16.5653 -16.5368 -16.5368 -16.5308 -16.5308 -16.5193 -16.5193 -13.7453 -13.7453 -13.6065 -13.6065 -13.5830 -13.5830 -13.5580 -13.5580 -13.5338 -13.5338 -13.5246 -13.5246 -11.2173 -11.2173 -9.5083 -9.5083 -4.5115 -4.5115 -4.0714 -4.0714 -2.3721 -2.3721 -0.9390 -0.9390 2.1230 2.1230 2.6269 2.6269 4.0959 4.0959 4.4108 4.4108 4.5581 4.5581 4.9146 4.9146 5.6566 5.6566 6.3219 6.3219 6.4703 6.4703 6.9945 6.9945 7.1103 7.1103 7.5194 7.5194 9.8332 9.8332 10.2619 10.2619 11.7424 11.7424 11.8758 11.8758 12.3182 12.3182 12.9637 12.9637 k = 0.0000 0.2625 0.2183 ( 5322 PWs) bands (ev): -16.5650 -16.5650 -16.5364 -16.5364 -16.5315 -16.5315 -16.5193 -16.5193 -13.7443 -13.7443 -13.6105 -13.6105 -13.5828 -13.5828 -13.5588 -13.5588 -13.5326 -13.5326 -13.5244 -13.5244 -11.1795 -11.1795 -9.5368 -9.5368 -4.4772 -4.4772 -4.0528 -4.0528 -2.3889 -2.3889 -1.0141 -1.0141 2.1484 2.1484 2.6571 2.6571 4.0477 4.0477 4.3466 4.3466 4.5155 4.5155 4.8383 4.8383 5.6817 5.6817 6.3382 6.3382 6.4633 6.4633 7.0014 7.0014 7.1303 7.1303 7.5260 7.5260 9.8848 9.8848 10.3130 10.3130 11.7223 11.7223 11.9145 11.9145 12.3208 12.3208 12.9026 12.9026 k = 0.0000 0.2750 0.2183 ( 5308 PWs) bands (ev): -16.5647 -16.5647 -16.5361 -16.5361 -16.5320 -16.5320 -16.5193 -16.5193 -13.7433 -13.7433 -13.6148 -13.6148 -13.5826 -13.5826 -13.5597 -13.5597 -13.5313 -13.5313 -13.5241 -13.5241 -11.1404 -11.1404 -9.5667 -9.5667 -4.4419 -4.4419 -4.0342 -4.0342 -2.4048 -2.4048 -1.0902 -1.0902 2.1756 2.1756 2.6890 2.6890 3.9959 3.9959 4.2860 4.2860 4.4718 4.4718 4.7639 4.7639 5.7063 5.7063 6.3552 6.3552 6.4538 6.4538 7.0074 7.0074 7.1543 7.1543 7.5335 7.5335 9.9332 9.9332 10.3575 10.3575 11.7024 11.7024 11.9612 11.9612 12.3218 12.3218 12.8432 12.8432 k = 0.0000 0.2875 0.2183 ( 5312 PWs) bands (ev): -16.5642 -16.5642 -16.5359 -16.5359 -16.5325 -16.5325 -16.5194 -16.5194 -13.7420 -13.7420 -13.6192 -13.6192 -13.5823 -13.5823 -13.5606 -13.5606 -13.5301 -13.5301 -13.5237 -13.5237 -11.1001 -11.1001 -9.5981 -9.5981 -4.4057 -4.4057 -4.0156 -4.0156 -2.4196 -2.4196 -1.1672 -1.1672 2.2045 2.2045 2.7223 2.7223 3.9406 3.9406 4.2290 4.2290 4.4271 4.4271 4.6921 4.6921 5.7305 5.7305 6.3714 6.3714 6.4435 6.4435 7.0135 7.0135 7.1803 7.1803 7.5414 7.5414 9.9784 9.9784 10.3951 10.3951 11.6886 11.6886 12.0101 12.0101 12.3212 12.3212 12.7860 12.7860 k = 0.0000 0.3000 0.2183 ( 5306 PWs) bands (ev): -16.5637 -16.5637 -16.5359 -16.5359 -16.5328 -16.5328 -16.5196 -16.5196 -13.7406 -13.7406 -13.6237 -13.6237 -13.5819 -13.5819 -13.5615 -13.5615 -13.5289 -13.5289 -13.5233 -13.5233 -11.0587 -11.0587 -9.6309 -9.6309 -4.3689 -4.3689 -3.9973 -3.9973 -2.4333 -2.4333 -1.2446 -1.2446 2.2351 2.2351 2.7571 2.7571 3.8825 3.8825 4.1755 4.1755 4.3818 4.3818 4.6231 4.6231 5.7542 5.7542 6.3819 6.3819 6.4377 6.4377 7.0200 7.0200 7.2073 7.2073 7.5497 7.5497 10.0201 10.0201 10.4257 10.4257 11.6828 11.6828 12.0588 12.0588 12.3189 12.3189 12.7313 12.7313 k = 0.0000 0.3125 0.2183 ( 5310 PWs) bands (ev): -16.5632 -16.5632 -16.5362 -16.5362 -16.5329 -16.5329 -16.5197 -16.5197 -13.7390 -13.7390 -13.6284 -13.6284 -13.5815 -13.5815 -13.5624 -13.5624 -13.5276 -13.5276 -13.5229 -13.5229 -11.0162 -11.0162 -9.6650 -9.6650 -4.3315 -4.3315 -3.9793 -3.9793 -2.4455 -2.4455 -1.3221 -1.3221 2.2674 2.2674 2.7931 2.7931 3.8223 3.8223 4.1248 4.1248 4.3362 4.3362 4.5571 4.5571 5.7773 5.7773 6.3788 6.3788 6.4447 6.4447 7.0268 7.0268 7.2344 7.2344 7.5581 7.5581 10.0583 10.0583 10.4495 10.4495 11.6851 11.6851 12.1056 12.1056 12.3156 12.3156 12.6796 12.6796 k = 0.0000 0.3250 0.2183 ( 5306 PWs) bands (ev): -16.5626 -16.5626 -16.5368 -16.5368 -16.5326 -16.5326 -16.5199 -16.5199 -13.7373 -13.7373 -13.6331 -13.6331 -13.5811 -13.5811 -13.5633 -13.5633 -13.5265 -13.5265 -13.5224 -13.5224 -10.9728 -10.9728 -9.7005 -9.7005 -4.2938 -4.2938 -3.9619 -3.9619 -2.4560 -2.4560 -1.3995 -1.3995 2.3013 2.3013 2.8301 2.8301 3.7611 3.7611 4.0763 4.0763 4.2910 4.2910 4.4942 4.4942 5.7999 5.7999 6.3643 6.3643 6.4629 6.4629 7.0333 7.0333 7.2612 7.2612 7.5662 7.5662 10.0933 10.0933 10.4670 10.4670 11.6950 11.6950 12.1483 12.1483 12.3128 12.3128 12.6315 12.6315 k = 0.0000 0.3375 0.2183 ( 5308 PWs) bands (ev): -16.5620 -16.5620 -16.5375 -16.5375 -16.5323 -16.5323 -16.5202 -16.5202 -13.7354 -13.7354 -13.6379 -13.6379 -13.5807 -13.5807 -13.5642 -13.5642 -13.5254 -13.5254 -13.5219 -13.5219 -10.9285 -10.9285 -9.7374 -9.7374 -4.2559 -4.2559 -3.9451 -3.9451 -2.4646 -2.4646 -1.4764 -1.4764 2.3369 2.3369 2.8680 2.8680 3.6997 3.6997 4.0295 4.0295 4.2467 4.2467 4.4343 4.4343 5.8220 5.8220 6.3450 6.3450 6.4860 6.4860 7.0390 7.0390 7.2874 7.2874 7.5737 7.5737 10.1251 10.1251 10.4790 10.4790 11.7114 11.7114 12.1828 12.1828 12.3140 12.3140 12.5874 12.5874 k = 0.0000 0.3500 0.2183 ( 5306 PWs) bands (ev): -16.5613 -16.5613 -16.5383 -16.5383 -16.5319 -16.5319 -16.5204 -16.5204 -13.7333 -13.7333 -13.6427 -13.6427 -13.5803 -13.5803 -13.5650 -13.5650 -13.5243 -13.5243 -13.5214 -13.5214 -10.8833 -10.8833 -9.7754 -9.7754 -4.2182 -4.2182 -3.9292 -3.9292 -2.4711 -2.4711 -1.5526 -1.5526 2.3739 2.3739 2.9063 2.9063 3.6390 3.6390 3.9839 3.9839 4.2038 4.2038 4.3772 4.3772 5.8435 5.8435 6.3238 6.3238 6.5116 6.5116 7.0434 7.0434 7.3129 7.3129 7.5805 7.5805 10.1541 10.1541 10.4864 10.4864 11.7326 11.7326 12.2027 12.2027 12.3250 12.3250 12.5480 12.5480 k = 0.0000 0.3625 0.2183 ( 5314 PWs) bands (ev): -16.5606 -16.5606 -16.5392 -16.5392 -16.5314 -16.5314 -16.5207 -16.5207 -13.7311 -13.7311 -13.6475 -13.6475 -13.5798 -13.5798 -13.5658 -13.5658 -13.5234 -13.5234 -13.5209 -13.5209 -10.8375 -10.8375 -9.8148 -9.8148 -4.1809 -4.1809 -3.9144 -3.9144 -2.4752 -2.4752 -1.6276 -1.6276 2.4124 2.4124 2.9447 2.9447 3.5798 3.5798 3.9393 3.9393 4.1628 4.1628 4.3228 4.3228 5.8646 5.8646 6.3018 6.3018 6.5390 6.5390 7.0459 7.0459 7.3376 7.3376 7.5862 7.5862 10.1807 10.1807 10.4900 10.4900 11.7570 11.7570 12.2054 12.2054 12.3479 12.3479 12.5143 12.5143 k = 0.0000 0.3750 0.2183 ( 5314 PWs) bands (ev): -16.5598 -16.5598 -16.5401 -16.5401 -16.5309 -16.5309 -16.5211 -16.5211 -13.7287 -13.7287 -13.6523 -13.6523 -13.5793 -13.5793 -13.5666 -13.5666 -13.5225 -13.5225 -13.5205 -13.5205 -10.7909 -10.7909 -9.8552 -9.8552 -4.1442 -4.1442 -3.9008 -3.9008 -2.4766 -2.4766 -1.7013 -1.7013 2.4522 2.4522 2.9826 2.9826 3.5230 3.5230 3.8956 3.8956 4.1242 4.1242 4.2710 4.2710 5.8853 5.8853 6.2795 6.2795 6.5678 6.5678 7.0459 7.0459 7.3615 7.3615 7.5907 7.5907 10.2052 10.2052 10.4905 10.4905 11.7826 11.7826 12.1961 12.1961 12.3769 12.3769 12.4874 12.4874 k = 0.0000 0.3875 0.2183 ( 5310 PWs) bands (ev): -16.5590 -16.5590 -16.5410 -16.5410 -16.5304 -16.5304 -16.5214 -16.5214 -13.7262 -13.7262 -13.6570 -13.6570 -13.5788 -13.5788 -13.5674 -13.5674 -13.5217 -13.5217 -13.5200 -13.5200 -10.7438 -10.7438 -9.8968 -9.8968 -4.1085 -4.1085 -3.8887 -3.8887 -2.4752 -2.4752 -1.7732 -1.7732 2.4932 2.4932 3.0188 3.0188 3.4698 3.4698 3.8529 3.8529 4.0883 4.0883 4.2218 4.2218 5.9055 5.9055 6.2573 6.2573 6.5976 6.5976 7.0432 7.0432 7.3846 7.3846 7.5938 7.5938 10.2280 10.2280 10.4887 10.4887 11.8079 11.8079 12.1799 12.1799 12.4055 12.4055 12.4691 12.4691 k = 0.0000 0.4000 0.2183 ( 5302 PWs) bands (ev): -16.5581 -16.5581 -16.5420 -16.5420 -16.5299 -16.5299 -16.5218 -16.5218 -13.7235 -13.7235 -13.6617 -13.6617 -13.5783 -13.5783 -13.5682 -13.5682 -13.5209 -13.5209 -13.5196 -13.5196 -10.6962 -10.6962 -9.9393 -9.9393 -4.0741 -4.0741 -3.8783 -3.8783 -2.4705 -2.4705 -1.8431 -1.8431 2.5355 2.5355 3.0514 3.0514 3.4221 3.4221 3.8112 3.8112 4.0556 4.0556 4.1753 4.1753 5.9253 5.9253 6.2354 6.2354 6.6284 6.6284 7.0375 7.0375 7.4068 7.4068 7.5953 7.5953 10.2496 10.2496 10.4848 10.4848 11.8315 11.8315 12.1596 12.1596 12.4263 12.4263 12.4644 12.4644 k = 0.0000 0.4125 0.2183 ( 5302 PWs) bands (ev): -16.5572 -16.5572 -16.5430 -16.5430 -16.5294 -16.5294 -16.5222 -16.5222 -13.7206 -13.7206 -13.6664 -13.6664 -13.5778 -13.5778 -13.5689 -13.5689 -13.5203 -13.5203 -13.5192 -13.5192 -10.6482 -10.6482 -9.9829 -9.9829 -4.0413 -4.0413 -3.8698 -3.8698 -2.4624 -2.4624 -1.9106 -1.9106 2.5787 2.5787 3.0770 3.0770 3.3832 3.3832 3.7705 3.7705 4.0263 4.0263 4.1317 4.1317 5.9448 5.9448 6.2138 6.2138 6.6600 6.6600 7.0285 7.0285 7.4282 7.4282 7.5952 7.5952 10.2703 10.2703 10.4791 10.4791 11.8528 11.8528 12.1364 12.1364 12.4341 12.4341 12.4770 12.4770 k = 0.0000 0.4250 0.2183 ( 5310 PWs) bands (ev): -16.5563 -16.5563 -16.5440 -16.5440 -16.5288 -16.5288 -16.5227 -16.5227 -13.7176 -13.7176 -13.6710 -13.6710 -13.5772 -13.5772 -13.5697 -13.5697 -13.5198 -13.5198 -13.5189 -13.5189 -10.5999 -10.5999 -10.0273 -10.0273 -4.0105 -4.0105 -3.8634 -3.8634 -2.4506 -2.4506 -1.9754 -1.9754 2.6229 2.6229 3.0902 3.0902 3.3582 3.3582 3.7307 3.7307 4.0008 4.0008 4.0915 4.0915 5.9640 5.9640 6.1928 6.1928 6.6920 6.6920 7.0161 7.0161 7.4486 7.4486 7.5934 7.5934 10.2904 10.2904 10.4719 10.4719 11.8714 11.8714 12.1114 12.1114 12.4395 12.4395 12.4948 12.4948 k = 0.0000 0.4375 0.2183 ( 5318 PWs) bands (ev): -16.5553 -16.5553 -16.5451 -16.5451 -16.5283 -16.5283 -16.5231 -16.5231 -13.7144 -13.7144 -13.6755 -13.6755 -13.5767 -13.5767 -13.5704 -13.5704 -13.5193 -13.5193 -13.5186 -13.5186 -10.5514 -10.5514 -10.0726 -10.0726 -3.9819 -3.9819 -3.8594 -3.8594 -2.4348 -2.4348 -2.0371 -2.0371 2.6678 2.6678 3.0856 3.0856 3.3525 3.3525 3.6915 3.6915 3.9794 3.9794 4.0551 4.0551 5.9829 5.9829 6.1723 6.1723 6.7245 6.7245 7.0006 7.0006 7.4681 7.4681 7.5900 7.5900 10.3099 10.3099 10.4632 10.4632 11.8880 11.8880 12.0855 12.0855 12.4485 12.4485 12.5101 12.5101 k = 0.0000 0.4500 0.2183 ( 5322 PWs) bands (ev): -16.5544 -16.5544 -16.5461 -16.5461 -16.5278 -16.5278 -16.5236 -16.5236 -13.7111 -13.7111 -13.6799 -13.6799 -13.5761 -13.5761 -13.5711 -13.5711 -13.5189 -13.5189 -13.5183 -13.5183 -10.5027 -10.5027 -10.1186 -10.1186 -3.9559 -3.9559 -3.8580 -3.8580 -2.4148 -2.4148 -2.0955 -2.0955 2.7134 2.7134 3.0634 3.0634 3.3654 3.3654 3.6527 3.6527 3.9626 3.9626 4.0229 4.0229 6.0016 6.0016 6.1522 6.1522 6.7569 6.7569 6.9820 6.9820 7.4865 7.4865 7.5848 7.5848 10.3289 10.3289 10.4529 10.4529 11.9031 11.9031 12.0595 12.0595 12.4610 12.4610 12.5210 12.5210 k = 0.0000 0.4625 0.2183 ( 5322 PWs) bands (ev): -16.5534 -16.5534 -16.5472 -16.5472 -16.5272 -16.5272 -16.5241 -16.5241 -13.7077 -13.7077 -13.6842 -13.6842 -13.5755 -13.5755 -13.5717 -13.5717 -13.5186 -13.5186 -13.5182 -13.5182 -10.4539 -10.4539 -10.1652 -10.1652 -3.9327 -3.9327 -3.8593 -3.8593 -2.3905 -2.3905 -2.1503 -2.1503 2.7596 2.7596 3.0293 3.0293 3.3911 3.3911 3.6142 3.6142 3.9506 3.9506 3.9957 3.9957 6.0202 6.0202 6.1326 6.1326 6.7892 6.7892 6.9604 6.9604 7.5037 7.5037 7.5780 7.5780 10.3474 10.3474 10.4413 10.4413 11.9179 11.9179 12.0343 12.0343 12.4756 12.4756 12.5269 12.5269 k = 0.0000 0.4750 0.2183 ( 5320 PWs) bands (ev): -16.5524 -16.5524 -16.5482 -16.5482 -16.5267 -16.5267 -16.5246 -16.5246 -13.7041 -13.7041 -13.6884 -13.6884 -13.5749 -13.5749 -13.5724 -13.5724 -13.5183 -13.5183 -13.5180 -13.5180 -10.4052 -10.4052 -10.2124 -10.2124 -3.9124 -3.9124 -3.8636 -3.8636 -2.3616 -2.3616 -2.2012 -2.2012 2.8060 2.8060 2.9887 2.9887 3.4238 3.4238 3.5755 3.5755 3.9438 3.9438 3.9737 3.9737 6.0387 6.0387 6.1133 6.1133 6.8210 6.8210 6.9364 6.9364 7.5197 7.5197 7.5694 7.5694 10.3653 10.3653 10.4284 10.4284 11.9332 11.9332 12.0104 12.0104 12.4906 12.4906 12.5278 12.5278 k = 0.0000 0.4875 0.2183 ( 5338 PWs) bands (ev): -16.5513 -16.5513 -16.5492 -16.5492 -16.5262 -16.5262 -16.5251 -16.5251 -13.7003 -13.7003 -13.6925 -13.6925 -13.5743 -13.5743 -13.5730 -13.5730 -13.5181 -13.5181 -13.5180 -13.5180 -10.3566 -10.3566 -10.2601 -10.2601 -3.8954 -3.8954 -3.8710 -3.8710 -2.3282 -2.3282 -2.2479 -2.2479 2.8526 2.8526 2.9446 2.9446 3.4602 3.4602 3.5368 3.5368 3.9425 3.9425 3.9574 3.9574 6.0571 6.0571 6.0944 6.0944 6.8520 6.8520 6.9100 6.9100 7.5344 7.5344 7.5593 7.5593 10.3825 10.3825 10.4142 10.4142 11.9497 11.9497 11.9882 11.9882 12.5045 12.5045 12.5240 12.5240 k = 0.0000 0.5000 0.2183 ( 5340 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8815 -3.8815 -3.8815 -3.8815 -2.2903 -2.2903 -2.2903 -2.2903 2.8990 2.8990 2.8990 2.8990 3.4982 3.4982 3.4982 3.4982 3.9470 3.9470 3.9470 3.9470 6.0757 6.0757 6.0757 6.0757 6.8818 6.8818 6.8818 6.8818 7.5476 7.5476 7.5476 7.5476 10.3989 10.3989 10.3989 10.3989 11.9679 11.9679 11.9679 11.9679 12.5159 12.5159 12.5159 12.5159 k = 0.0000 0.5000 0.2183 ( 5340 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8815 -3.8815 -3.8815 -3.8815 -2.2903 -2.2903 -2.2903 -2.2903 2.8990 2.8990 2.8990 2.8990 3.4982 3.4982 3.4982 3.4982 3.9470 3.9470 3.9470 3.9470 6.0757 6.0757 6.0757 6.0757 6.8818 6.8818 6.8818 6.8818 7.5476 7.5476 7.5476 7.5476 10.3989 10.3989 10.3989 10.3989 11.9679 11.9679 11.9679 11.9679 12.5159 12.5159 12.5159 12.5159 k = 0.0125 0.5000 0.2183 ( 5332 PWs) bands (ev): -16.5513 -16.5513 -16.5493 -16.5493 -16.5256 -16.5256 -16.5255 -16.5255 -13.6998 -13.6998 -13.6933 -13.6933 -13.5741 -13.5741 -13.5731 -13.5731 -13.5182 -13.5182 -13.5178 -13.5178 -10.3090 -10.3090 -10.3065 -10.3065 -3.8811 -3.8811 -3.8810 -3.8810 -2.2913 -2.2913 -2.2913 -2.2913 2.8585 2.8585 2.9283 2.9283 3.4916 3.4916 3.5145 3.5145 3.9338 3.9338 3.9668 3.9668 6.0638 6.0638 6.0839 6.0839 6.8668 6.8668 6.8931 6.8931 7.5307 7.5307 7.5567 7.5567 10.3664 10.3664 10.4288 10.4288 11.9415 11.9415 11.9993 11.9993 12.4387 12.4387 12.5947 12.5947 k = 0.0250 0.5000 0.2183 ( 5332 PWs) bands (ev): -16.5525 -16.5525 -16.5485 -16.5485 -16.5255 -16.5255 -16.5253 -16.5253 -13.7033 -13.7033 -13.6902 -13.6902 -13.5744 -13.5744 -13.5724 -13.5724 -13.5185 -13.5185 -13.5176 -13.5176 -10.3090 -10.3090 -10.3040 -10.3040 -3.8796 -3.8796 -3.8794 -3.8794 -2.2944 -2.2944 -2.2943 -2.2943 2.8105 2.8105 2.9434 2.9434 3.4979 3.4979 3.5367 3.5367 3.9270 3.9270 3.9933 3.9933 6.0481 6.0481 6.0884 6.0884 6.8480 6.8480 6.9010 6.9010 7.5061 7.5061 7.5581 7.5581 10.3313 10.3313 10.4562 10.4562 11.9221 11.9221 12.0313 12.0313 12.3673 12.3673 12.6722 12.6722 k = 0.0375 0.5000 0.2183 ( 5328 PWs) bands (ev): -16.5537 -16.5537 -16.5479 -16.5479 -16.5252 -16.5252 -16.5250 -16.5250 -13.7067 -13.7067 -13.6873 -13.6873 -13.5744 -13.5744 -13.5716 -13.5716 -13.5187 -13.5187 -13.5174 -13.5174 -10.3082 -10.3082 -10.3007 -10.3007 -3.8771 -3.8771 -3.8768 -3.8768 -2.2994 -2.2994 -2.2993 -2.2993 2.7579 2.7579 2.9433 2.9433 3.5181 3.5181 3.5616 3.5616 3.9264 3.9264 4.0268 4.0268 6.0287 6.0287 6.0892 6.0892 6.8254 6.8254 6.9056 6.9056 7.4741 7.4741 7.5523 7.5523 10.2935 10.2935 10.4811 10.4811 11.9109 11.9109 12.0546 12.0546 12.3114 12.3114 12.7467 12.7467 k = 0.0500 0.5000 0.2183 ( 5324 PWs) bands (ev): -16.5549 -16.5549 -16.5473 -16.5473 -16.5247 -16.5247 -16.5247 -16.5247 -13.7102 -13.7102 -13.6847 -13.6847 -13.5743 -13.5743 -13.5708 -13.5708 -13.5190 -13.5190 -13.5172 -13.5172 -10.3065 -10.3065 -10.2966 -10.2966 -3.8736 -3.8736 -3.8732 -3.8732 -2.3065 -2.3065 -2.3062 -2.3062 2.7032 2.7032 2.9297 2.9297 3.5500 3.5500 3.5868 3.5868 3.9326 3.9326 4.0671 4.0671 6.0054 6.0054 6.0862 6.0862 6.7990 6.7990 6.9071 6.9071 7.4350 7.4350 7.5398 7.5398 10.2529 10.2529 10.5033 10.5033 11.9080 11.9080 12.0522 12.0522 12.2878 12.2878 12.8167 12.8167 k = 0.0625 0.5000 0.2183 ( 5316 PWs) bands (ev): -16.5562 -16.5562 -16.5470 -16.5470 -16.5242 -16.5242 -16.5241 -16.5241 -13.7137 -13.7137 -13.6823 -13.6823 -13.5739 -13.5739 -13.5698 -13.5698 -13.5192 -13.5192 -13.5170 -13.5170 -10.3039 -10.3039 -10.2917 -10.2917 -3.8692 -3.8692 -3.8687 -3.8687 -2.3156 -2.3156 -2.3151 -2.3151 2.6480 2.6480 2.9060 2.9060 3.5893 3.5893 3.6112 3.6112 3.9462 3.9462 4.1137 4.1137 5.9783 5.9783 6.0794 6.0794 6.7687 6.7687 6.9058 6.9058 7.3895 7.3895 7.5213 7.5213 10.2101 10.2101 10.5224 10.5224 11.9133 11.9133 12.0168 12.0168 12.3035 12.3035 12.8809 12.8809 k = 0.0750 0.5000 0.2183 ( 5316 PWs) bands (ev): -16.5574 -16.5574 -16.5468 -16.5468 -16.5238 -16.5238 -16.5234 -16.5234 -13.7171 -13.7171 -13.6803 -13.6803 -13.5732 -13.5732 -13.5689 -13.5689 -13.5195 -13.5195 -13.5168 -13.5168 -10.3005 -10.3005 -10.2861 -10.2861 -3.8637 -3.8637 -3.8631 -3.8631 -2.3266 -2.3266 -2.3259 -2.3259 2.5935 2.5935 2.8755 2.8755 3.6314 3.6314 3.6342 3.6342 3.9684 3.9684 4.1660 4.1660 5.9474 5.9474 6.0685 6.0685 6.7349 6.7349 6.9019 6.9019 7.3382 7.3382 7.4976 7.4976 10.1652 10.1652 10.5378 10.5378 11.9260 11.9260 11.9640 11.9640 12.3428 12.3428 12.9383 12.9383 k = 0.0875 0.5000 0.2183 ( 5308 PWs) bands (ev): -16.5587 -16.5587 -16.5468 -16.5468 -16.5233 -16.5233 -16.5225 -16.5225 -13.7204 -13.7204 -13.6786 -13.6786 -13.5723 -13.5723 -13.5678 -13.5678 -13.5198 -13.5198 -13.5166 -13.5166 -10.2963 -10.2963 -10.2798 -10.2798 -3.8574 -3.8574 -3.8567 -3.8567 -2.3396 -2.3396 -2.3386 -2.3386 2.5405 2.5405 2.8412 2.8412 3.6556 3.6556 3.6719 3.6719 4.0005 4.0005 4.2230 4.2230 5.9126 5.9126 6.0535 6.0535 6.6976 6.6976 6.8956 6.8956 7.2820 7.2820 7.4695 7.4695 10.1191 10.1191 10.5489 10.5489 11.9075 11.9075 11.9453 11.9453 12.3915 12.3915 12.9881 12.9881 k = 0.1000 0.5000 0.2183 ( 5316 PWs) bands (ev): -16.5599 -16.5599 -16.5469 -16.5469 -16.5227 -16.5227 -16.5216 -16.5216 -13.7237 -13.7237 -13.6773 -13.6773 -13.5711 -13.5711 -13.5668 -13.5668 -13.5201 -13.5201 -13.5164 -13.5164 -10.2914 -10.2914 -10.2727 -10.2727 -3.8501 -3.8501 -3.8493 -3.8493 -2.3544 -2.3544 -2.3532 -2.3532 2.4898 2.4898 2.8052 2.8052 3.6757 3.6757 3.7080 3.7080 4.0430 4.0430 4.2837 4.2837 5.8742 5.8742 6.0341 6.0341 6.6574 6.6574 6.8867 6.8867 7.2217 7.2217 7.4378 7.4378 10.0723 10.0723 10.5551 10.5551 11.8534 11.8534 11.9698 11.9698 12.4429 12.4429 13.0296 13.0296 k = 0.1125 0.5000 0.2183 ( 5316 PWs) bands (ev): -16.5612 -16.5612 -16.5471 -16.5471 -16.5222 -16.5222 -16.5205 -16.5205 -13.7268 -13.7268 -13.6763 -13.6763 -13.5696 -13.5696 -13.5657 -13.5657 -13.5204 -13.5204 -13.5162 -13.5162 -10.2856 -10.2856 -10.2651 -10.2651 -3.8420 -3.8420 -3.8411 -3.8411 -2.3712 -2.3712 -2.3695 -2.3695 2.4417 2.4417 2.7688 2.7688 3.6946 3.6946 3.7386 3.7386 4.0953 4.0953 4.3474 4.3474 5.8322 5.8322 6.0102 6.0102 6.6146 6.6146 6.8753 6.8753 7.1584 7.1584 7.4033 7.4033 10.0257 10.0257 10.5560 10.5560 11.8046 11.8046 11.9982 11.9982 12.4934 12.4934 13.0626 13.0626 k = 0.1250 0.5000 0.2183 ( 5308 PWs) bands (ev): -16.5623 -16.5623 -16.5475 -16.5475 -16.5216 -16.5216 -16.5194 -16.5194 -13.7298 -13.7298 -13.6757 -13.6757 -13.5678 -13.5678 -13.5647 -13.5647 -13.5207 -13.5207 -13.5159 -13.5159 -10.2791 -10.2791 -10.2568 -10.2568 -3.8330 -3.8330 -3.8321 -3.8321 -2.3897 -2.3897 -2.3875 -2.3875 2.3967 2.3967 2.7332 2.7332 3.7126 3.7126 3.7641 3.7641 4.1556 4.1556 4.4131 4.4131 5.7870 5.7870 5.9817 5.9817 6.5697 6.5697 6.8605 6.8605 7.0936 7.0936 7.3666 7.3666 9.9800 9.9800 10.5512 10.5512 11.7623 11.7623 12.0291 12.0291 12.5411 12.5411 13.0867 13.0867 k = 0.1375 0.5000 0.2183 ( 5312 PWs) bands (ev): -16.5635 -16.5635 -16.5479 -16.5479 -16.5210 -16.5210 -16.5182 -16.5182 -13.7327 -13.7327 -13.6755 -13.6755 -13.5658 -13.5658 -13.5636 -13.5636 -13.5210 -13.5210 -13.5157 -13.5157 -10.2719 -10.2719 -10.2480 -10.2480 -3.8233 -3.8233 -3.8222 -3.8222 -2.4099 -2.4099 -2.4072 -2.4072 2.3551 2.3551 2.6991 2.6991 3.7298 3.7298 3.7856 3.7856 4.2217 4.2217 4.4802 4.4802 5.7388 5.7388 5.9486 5.9486 6.5232 6.5232 6.8410 6.8410 7.0296 7.0296 7.3283 7.3283 9.9359 9.9359 10.5411 10.5411 11.7268 11.7268 12.0613 12.0613 12.5841 12.5841 13.1020 13.1020 k = 0.1500 0.5000 0.2183 ( 5312 PWs) bands (ev): -16.5646 -16.5646 -16.5484 -16.5484 -16.5203 -16.5203 -16.5170 -16.5170 -13.7354 -13.7354 -13.6756 -13.6756 -13.5636 -13.5636 -13.5625 -13.5625 -13.5214 -13.5214 -13.5154 -13.5154 -10.2640 -10.2640 -10.2386 -10.2386 -3.8128 -3.8128 -3.8117 -3.8117 -2.4317 -2.4317 -2.4284 -2.4284 2.3171 2.3171 2.6671 2.6671 3.7465 3.7465 3.8041 3.8041 4.2918 4.2918 4.5479 4.5479 5.6883 5.6883 5.9110 5.9110 6.4755 6.4755 6.8132 6.8132 6.9705 6.9705 7.2891 7.2891 9.8940 9.8940 10.5260 10.5260 11.6978 11.6978 12.0934 12.0934 12.6214 12.6214 13.1089 13.1089 k = 0.1625 0.5000 0.2183 ( 5324 PWs) bands (ev): -16.5656 -16.5656 -16.5490 -16.5490 -16.5197 -16.5197 -16.5158 -16.5158 -13.7380 -13.7380 -13.6761 -13.6761 -13.5614 -13.5614 -13.5611 -13.5611 -13.5217 -13.5217 -13.5151 -13.5151 -10.2555 -10.2555 -10.2288 -10.2288 -3.8017 -3.8017 -3.8005 -3.8005 -2.4550 -2.4550 -2.4510 -2.4510 2.2828 2.2828 2.6375 2.6375 3.7627 3.7627 3.8203 3.8203 4.3640 4.3640 4.6157 4.6157 5.6357 5.6357 5.8691 5.8691 6.4268 6.4268 6.7720 6.7720 6.9221 6.9221 7.2492 7.2492 9.8549 9.8549 10.5068 10.5068 11.6747 11.6747 12.1242 12.1242 12.6522 12.6522 13.1079 13.1079 k = 0.1750 0.5000 0.2183 ( 5316 PWs) bands (ev): -16.5666 -16.5666 -16.5496 -16.5496 -16.5191 -16.5191 -16.5146 -16.5146 -13.7403 -13.7403 -13.6769 -13.6769 -13.5604 -13.5604 -13.5585 -13.5585 -13.5221 -13.5221 -13.5148 -13.5148 -10.2463 -10.2463 -10.2186 -10.2186 -3.7899 -3.7899 -3.7887 -3.7887 -2.4797 -2.4797 -2.4750 -2.4750 2.2524 2.2524 2.6106 2.6106 3.7783 3.7783 3.8349 3.8349 4.4373 4.4373 4.6831 4.6831 5.5819 5.5819 5.8234 5.8234 6.3775 6.3775 6.7156 6.7156 6.8867 6.8867 7.2090 7.2090 9.8189 9.8189 10.4844 10.4844 11.6565 11.6565 12.1527 12.1527 12.6758 12.6758 13.0998 13.0998 k = 0.1875 0.5000 0.2183 ( 5312 PWs) bands (ev): -16.5675 -16.5675 -16.5502 -16.5502 -16.5184 -16.5184 -16.5134 -16.5134 -13.7425 -13.7425 -13.6780 -13.6780 -13.5593 -13.5593 -13.5558 -13.5558 -13.5224 -13.5224 -13.5145 -13.5145 -10.2367 -10.2367 -10.2080 -10.2080 -3.7777 -3.7777 -3.7764 -3.7764 -2.5057 -2.5057 -2.5003 -2.5003 2.2260 2.2260 2.5866 2.5866 3.7934 3.7934 3.8479 3.8479 4.5104 4.5104 4.7495 4.7495 5.5274 5.5274 5.7744 5.7744 6.3277 6.3277 6.6478 6.6478 6.8610 6.8610 7.1690 7.1690 9.7865 9.7865 10.4599 10.4599 11.6423 11.6423 12.1780 12.1780 12.6920 12.6920 13.0854 13.0854 k = 0.2000 0.5000 0.2183 ( 5312 PWs) bands (ev): -16.5684 -16.5684 -16.5510 -16.5510 -16.5177 -16.5177 -16.5123 -16.5123 -13.7445 -13.7445 -13.6793 -13.6793 -13.5583 -13.5583 -13.5529 -13.5529 -13.5228 -13.5228 -13.5141 -13.5141 -10.2266 -10.2266 -10.1971 -10.1971 -3.7649 -3.7649 -3.7636 -3.7636 -2.5327 -2.5327 -2.5266 -2.5266 2.2035 2.2035 2.5657 2.5657 3.8078 3.8078 3.8595 3.8595 4.5826 4.5826 4.8145 4.8145 5.4730 5.4730 5.7229 5.7229 6.2773 6.2773 6.5738 6.5738 6.8404 6.8404 7.1293 7.1293 9.7580 9.7580 10.4344 10.4344 11.6310 11.6310 12.1991 12.1991 12.7008 12.7008 13.0657 13.0657 k = 0.2125 0.5000 0.2183 ( 5332 PWs) bands (ev): -16.5692 -16.5692 -16.5517 -16.5517 -16.5171 -16.5171 -16.5111 -16.5111 -13.7463 -13.7463 -13.6809 -13.6809 -13.5573 -13.5573 -13.5500 -13.5500 -13.5232 -13.5232 -13.5137 -13.5137 -10.2160 -10.2160 -10.1860 -10.1860 -3.7518 -3.7518 -3.7504 -3.7504 -2.5607 -2.5607 -2.5538 -2.5538 2.1851 2.1851 2.5478 2.5478 3.8215 3.8215 3.8696 3.8696 4.6529 4.6529 4.8776 4.8776 5.4195 5.4195 5.6697 5.6697 6.2265 6.2265 6.4967 6.4967 6.8223 6.8223 7.0901 7.0901 9.7335 9.7335 10.4087 10.4087 11.6218 11.6218 12.2153 12.2153 12.7024 12.7024 13.0417 13.0417 k = 0.2250 0.5000 0.2183 ( 5324 PWs) bands (ev): -16.5699 -16.5699 -16.5525 -16.5525 -16.5164 -16.5164 -16.5101 -16.5101 -13.7478 -13.7478 -13.6827 -13.6827 -13.5562 -13.5562 -13.5471 -13.5471 -13.5236 -13.5236 -13.5133 -13.5133 -10.2050 -10.2050 -10.1747 -10.1747 -3.7383 -3.7383 -3.7369 -3.7369 -2.5894 -2.5894 -2.5818 -2.5818 2.1706 2.1706 2.5330 2.5330 3.8344 3.8344 3.8782 3.8782 4.7207 4.7207 4.9382 4.9382 5.3680 5.3680 5.6158 5.6158 6.1753 6.1753 6.4182 6.4182 6.8054 6.8054 7.0516 7.0516 9.7131 9.7131 10.3838 10.3838 11.6139 11.6139 12.2262 12.2262 12.6973 12.6973 13.0143 13.0143 k = 0.2375 0.5000 0.2183 ( 5324 PWs) bands (ev): -16.5706 -16.5706 -16.5532 -16.5532 -16.5157 -16.5157 -16.5091 -16.5091 -13.7492 -13.7492 -13.6847 -13.6847 -13.5552 -13.5552 -13.5442 -13.5442 -13.5240 -13.5240 -13.5129 -13.5129 -10.1938 -10.1938 -10.1632 -10.1632 -3.7246 -3.7246 -3.7232 -3.7232 -2.6187 -2.6187 -2.6104 -2.6104 2.1600 2.1600 2.5212 2.5212 3.8462 3.8462 3.8848 3.8848 4.7849 4.7849 4.9956 4.9956 5.3194 5.3194 5.5623 5.5623 6.1238 6.1238 6.3396 6.3396 6.7890 6.7890 7.0139 7.0139 9.6969 9.6969 10.3601 10.3601 11.6067 11.6067 12.2312 12.2312 12.6860 12.6860 12.9843 12.9843 k = 0.2500 0.5000 0.2183 ( 5328 PWs) bands (ev): -16.5712 -16.5712 -16.5541 -16.5541 -16.5150 -16.5150 -16.5081 -16.5081 -13.7504 -13.7504 -13.6868 -13.6868 -13.5543 -13.5543 -13.5413 -13.5413 -13.5243 -13.5243 -13.5125 -13.5125 -10.1823 -10.1823 -10.1518 -10.1518 -3.7107 -3.7107 -3.7093 -3.7093 -2.6484 -2.6484 -2.6394 -2.6394 2.1532 2.1532 2.5124 2.5124 3.8568 3.8568 3.8895 3.8895 4.8442 4.8442 5.0487 5.0487 5.2753 5.2753 5.5107 5.5107 6.0722 6.0722 6.2619 6.2619 6.7728 6.7728 6.9771 6.9771 9.6850 9.6850 10.3381 10.3381 11.5999 11.5999 12.2304 12.2304 12.6692 12.6692 12.9524 12.9524 k = 0.2625 0.5000 0.2183 ( 5324 PWs) bands (ev): -16.5717 -16.5717 -16.5549 -16.5549 -16.5144 -16.5144 -16.5072 -16.5072 -13.7514 -13.7514 -13.6891 -13.6891 -13.5533 -13.5533 -13.5386 -13.5386 -13.5247 -13.5247 -13.5120 -13.5120 -10.1707 -10.1707 -10.1403 -10.1403 -3.6968 -3.6968 -3.6954 -3.6954 -2.6782 -2.6782 -2.6686 -2.6686 2.1501 2.1501 2.5063 2.5063 3.8662 3.8662 3.8920 3.8920 4.8964 4.8964 5.0956 5.0956 5.2377 5.2377 5.4630 5.4630 6.0209 6.0209 6.1858 6.1858 6.7567 6.7567 6.9413 6.9413 9.6773 9.6773 10.3182 10.3182 11.5932 11.5932 12.2238 12.2238 12.6477 12.6477 12.9188 12.9188 k = 0.2750 0.5000 0.2183 ( 5328 PWs) bands (ev): -16.5721 -16.5721 -16.5557 -16.5557 -16.5137 -16.5137 -16.5064 -16.5064 -13.7522 -13.7522 -13.6914 -13.6914 -13.5523 -13.5523 -13.5359 -13.5359 -13.5250 -13.5250 -13.5115 -13.5115 -10.1589 -10.1589 -10.1290 -10.1290 -3.6830 -3.6830 -3.6816 -3.6816 -2.7079 -2.7079 -2.6978 -2.6978 2.1505 2.1505 2.5027 2.5027 3.8740 3.8740 3.8922 3.8922 4.9380 4.9380 5.1331 5.1331 5.2101 5.2101 5.4227 5.4227 5.9703 5.9703 6.1124 6.1124 6.7404 6.7404 6.9064 6.9064 9.6737 9.6737 10.3005 10.3005 11.5866 11.5866 12.2119 12.2119 12.6221 12.6221 12.8838 12.8838 k = 0.2875 0.5000 0.2183 ( 5332 PWs) bands (ev): -16.5725 -16.5725 -16.5566 -16.5566 -16.5130 -16.5130 -16.5056 -16.5056 -13.7528 -13.7528 -13.6939 -13.6939 -13.5514 -13.5514 -13.5335 -13.5335 -13.5251 -13.5251 -13.5111 -13.5111 -10.1472 -10.1472 -10.1178 -10.1178 -3.6693 -3.6693 -3.6679 -3.6679 -2.7373 -2.7373 -2.7269 -2.7269 2.1543 2.1543 2.5016 2.5016 3.8802 3.8802 3.8899 3.8899 4.9640 4.9640 5.1553 5.1553 5.1973 5.1973 5.3954 5.3954 5.9213 5.9213 6.0427 6.0427 6.7239 6.7239 6.8725 6.8725 9.6741 9.6741 10.2849 10.2849 11.5802 11.5802 12.1951 12.1951 12.5931 12.5931 12.8472 12.8472 k = 0.3000 0.5000 0.2183 ( 5336 PWs) bands (ev): -16.5728 -16.5728 -16.5574 -16.5574 -16.5123 -16.5123 -16.5050 -16.5050 -13.7531 -13.7531 -13.6964 -13.6964 -13.5505 -13.5505 -13.5315 -13.5315 -13.5250 -13.5250 -13.5106 -13.5106 -10.1355 -10.1355 -10.1068 -10.1068 -3.6558 -3.6558 -3.6544 -3.6544 -2.7663 -2.7663 -2.7555 -2.7555 2.1613 2.1613 2.5024 2.5024 3.8847 3.8847 3.8853 3.8853 4.9710 4.9710 5.1561 5.1561 5.2020 5.2020 5.3872 5.3872 5.8746 5.8746 5.9776 5.9776 6.7073 6.7073 6.8395 6.8395 9.6783 9.6783 10.2715 10.2715 11.5742 11.5742 12.1743 12.1743 12.5615 12.5615 12.8091 12.8091 k = 0.3125 0.5000 0.2183 ( 5344 PWs) bands (ev): -16.5731 -16.5731 -16.5583 -16.5583 -16.5117 -16.5117 -16.5043 -16.5043 -13.7533 -13.7533 -13.6990 -13.6990 -13.5495 -13.5495 -13.5301 -13.5301 -13.5244 -13.5244 -13.5101 -13.5101 -10.1239 -10.1239 -10.0962 -10.0962 -3.6426 -3.6426 -3.6413 -3.6413 -2.7945 -2.7945 -2.7836 -2.7836 2.1713 2.1713 2.5050 2.5050 3.8786 3.8786 3.8875 3.8875 4.9621 4.9621 5.1363 5.1363 5.2202 5.2202 5.3965 5.3965 5.8315 5.8315 5.9185 5.9185 6.6904 6.6904 6.8075 6.8075 9.6863 9.6863 10.2599 10.2599 11.5687 11.5687 12.1502 12.1502 12.5278 12.5278 12.7692 12.7692 k = 0.3250 0.5000 0.2183 ( 5348 PWs) bands (ev): -16.5733 -16.5733 -16.5591 -16.5591 -16.5110 -16.5110 -16.5038 -16.5038 -13.7534 -13.7534 -13.7017 -13.7017 -13.5486 -13.5486 -13.5296 -13.5296 -13.5231 -13.5231 -13.5096 -13.5096 -10.1125 -10.1125 -10.0859 -10.0859 -3.6299 -3.6299 -3.6287 -3.6287 -2.8218 -2.8218 -2.8109 -2.8109 2.1840 2.1840 2.5090 2.5090 3.8699 3.8699 3.8885 3.8885 4.9441 4.9441 5.1036 5.1036 5.2444 5.2444 5.4149 5.4149 5.7931 5.7931 5.8666 5.8666 6.6734 6.6734 6.7766 6.7766 9.6978 9.6978 10.2499 10.2499 11.5641 11.5641 12.1236 12.1236 12.4928 12.4928 12.7275 12.7275 k = 0.3375 0.5000 0.2183 ( 5348 PWs) bands (ev): -16.5734 -16.5734 -16.5599 -16.5599 -16.5103 -16.5103 -16.5033 -16.5033 -13.7532 -13.7532 -13.7044 -13.7044 -13.5477 -13.5477 -13.5296 -13.5296 -13.5214 -13.5214 -13.5091 -13.5091 -10.1015 -10.1015 -10.0761 -10.0761 -3.6177 -3.6177 -3.6166 -3.6166 -2.8480 -2.8480 -2.8372 -2.8372 2.1992 2.1992 2.5139 2.5139 3.8599 3.8599 3.8879 3.8879 4.9216 4.9216 5.0646 5.0646 5.2686 5.2686 5.4344 5.4344 5.7612 5.7612 5.8232 5.8232 6.6564 6.6564 6.7466 6.7466 9.7126 9.7126 10.2412 10.2412 11.5607 11.5607 12.0954 12.0954 12.4571 12.4571 12.6840 12.6840 k = 0.3500 0.5000 0.2183 ( 5344 PWs) bands (ev): -16.5734 -16.5734 -16.5608 -16.5608 -16.5097 -16.5097 -16.5030 -16.5030 -13.7528 -13.7528 -13.7070 -13.7070 -13.5468 -13.5468 -13.5298 -13.5298 -13.5196 -13.5196 -13.5086 -13.5086 -10.0907 -10.0907 -10.0667 -10.0667 -3.6061 -3.6061 -3.6051 -3.6051 -2.8729 -2.8729 -2.8623 -2.8623 2.2166 2.2166 2.5194 2.5194 3.8489 3.8489 3.8858 3.8858 4.8969 4.8969 5.0229 5.0229 5.2898 5.2898 5.4503 5.4503 5.7375 5.7375 5.7893 5.7893 6.6394 6.6394 6.7177 6.7177 9.7304 9.7304 10.2333 10.2333 11.5589 11.5589 12.0662 12.0662 12.4212 12.4212 12.6388 12.6388 k = 0.3625 0.5000 0.2183 ( 5344 PWs) bands (ev): -16.5734 -16.5734 -16.5616 -16.5616 -16.5090 -16.5090 -16.5026 -16.5026 -13.7523 -13.7523 -13.7097 -13.7097 -13.5460 -13.5460 -13.5302 -13.5302 -13.5178 -13.5178 -13.5082 -13.5082 -10.0805 -10.0805 -10.0580 -10.0580 -3.5953 -3.5953 -3.5943 -3.5943 -2.8963 -2.8963 -2.8860 -2.8860 2.2359 2.2359 2.5250 2.5250 3.8376 3.8376 3.8823 3.8823 4.8707 4.8707 4.9802 4.9802 5.3064 5.3064 5.4598 5.4598 5.7232 5.7232 5.7652 5.7652 6.6226 6.6226 6.6900 6.6900 9.7510 9.7510 10.2258 10.2258 11.5591 11.5591 12.0367 12.0367 12.3858 12.3858 12.5923 12.5923 k = 0.3750 0.5000 0.2183 ( 5356 PWs) bands (ev): -16.5733 -16.5733 -16.5625 -16.5625 -16.5084 -16.5084 -16.5024 -16.5024 -13.7516 -13.7516 -13.7124 -13.7124 -13.5451 -13.5451 -13.5307 -13.5307 -13.5161 -13.5161 -13.5077 -13.5077 -10.0707 -10.0707 -10.0498 -10.0498 -3.5852 -3.5852 -3.5843 -3.5843 -2.9181 -2.9181 -2.9082 -2.9082 2.2568 2.2568 2.5301 2.5301 3.8267 3.8267 3.8777 3.8777 4.8436 4.8436 4.9374 4.9374 5.3186 5.3186 5.4622 5.4622 5.7183 5.7183 5.7507 5.7507 6.6062 6.6062 6.6636 6.6636 9.7740 9.7740 10.2182 10.2182 11.5617 11.5617 12.0072 12.0072 12.3514 12.3514 12.5448 12.5448 k = 0.3875 0.5000 0.2183 ( 5352 PWs) bands (ev): -16.5732 -16.5732 -16.5633 -16.5633 -16.5078 -16.5078 -16.5022 -16.5022 -13.7508 -13.7508 -13.7151 -13.7151 -13.5442 -13.5442 -13.5312 -13.5312 -13.5145 -13.5145 -13.5073 -13.5073 -10.0615 -10.0615 -10.0424 -10.0424 -3.5759 -3.5759 -3.5752 -3.5752 -2.9380 -2.9380 -2.9288 -2.9288 2.2791 2.2791 2.5344 2.5344 3.8167 3.8167 3.8722 3.8722 4.8157 4.8157 4.8951 4.8951 5.3272 5.3272 5.4588 5.4588 5.7211 5.7211 5.7443 5.7443 6.5903 6.5903 6.6387 6.6387 9.7992 9.7992 10.2100 10.2100 11.5668 11.5668 11.9782 11.9782 12.3186 12.3186 12.4971 12.4971 k = 0.4000 0.5000 0.2183 ( 5360 PWs) bands (ev): -16.5730 -16.5730 -16.5641 -16.5641 -16.5072 -16.5072 -16.5021 -16.5021 -13.7498 -13.7498 -13.7177 -13.7177 -13.5434 -13.5434 -13.5318 -13.5318 -13.5131 -13.5131 -13.5070 -13.5070 -10.0529 -10.0529 -10.0357 -10.0357 -3.5676 -3.5676 -3.5669 -3.5669 -2.9560 -2.9560 -2.9475 -2.9475 2.3023 2.3023 2.5374 2.5374 3.8081 3.8081 3.8660 3.8660 4.7875 4.7875 4.8541 4.8541 5.3336 5.3336 5.4517 5.4517 5.7290 5.7290 5.7441 5.7441 6.5752 6.5752 6.6155 6.6155 9.8261 9.8261 10.2009 10.2009 11.5749 11.5749 11.9498 11.9498 12.2880 12.2880 12.4497 12.4497 k = 0.4125 0.5000 0.2183 ( 5360 PWs) bands (ev): -16.5728 -16.5728 -16.5649 -16.5649 -16.5066 -16.5066 -16.5020 -16.5020 -13.7486 -13.7486 -13.7203 -13.7203 -13.5426 -13.5426 -13.5323 -13.5323 -13.5118 -13.5118 -13.5067 -13.5067 -10.0451 -10.0451 -10.0298 -10.0298 -3.5602 -3.5602 -3.5596 -3.5596 -2.9720 -2.9720 -2.9644 -2.9644 2.3261 2.3261 2.5386 2.5386 3.8013 3.8013 3.8593 3.8593 4.7598 4.7598 4.8149 4.8149 5.3390 5.3390 5.4430 5.4430 5.7393 5.7393 5.7482 5.7482 6.5611 6.5611 6.5941 6.5941 9.8544 9.8544 10.1903 10.1903 11.5859 11.5859 11.9221 11.9221 12.2601 12.2601 12.4034 12.4034 k = 0.4250 0.5000 0.2183 ( 5356 PWs) bands (ev): -16.5725 -16.5725 -16.5656 -16.5656 -16.5061 -16.5061 -16.5021 -16.5021 -13.7473 -13.7473 -13.7229 -13.7229 -13.5417 -13.5417 -13.5330 -13.5330 -13.5106 -13.5106 -13.5064 -13.5064 -10.0380 -10.0380 -10.0248 -10.0248 -3.5537 -3.5537 -3.5533 -3.5533 -2.9859 -2.9859 -2.9792 -2.9792 2.3502 2.3502 2.5378 2.5378 3.7967 3.7967 3.8524 3.8524 4.7333 4.7333 4.7783 4.7783 5.3443 5.3443 5.4338 5.4338 5.7503 5.7503 5.7547 5.7547 6.5483 6.5483 6.5748 6.5748 9.8838 9.8838 10.1780 10.1780 11.6000 11.6000 11.8951 11.8951 12.2355 12.2355 12.3593 12.3593 k = 0.4375 0.5000 0.2183 ( 5352 PWs) bands (ev): -16.5721 -16.5721 -16.5664 -16.5664 -16.5055 -16.5055 -16.5021 -16.5021 -13.7459 -13.7459 -13.7254 -13.7254 -13.5409 -13.5409 -13.5336 -13.5336 -13.5096 -13.5096 -13.5062 -13.5062 -10.0318 -10.0318 -10.0206 -10.0206 -3.5483 -3.5483 -3.5479 -3.5479 -2.9976 -2.9976 -2.9919 -2.9919 2.3741 2.3741 2.5346 2.5346 3.7943 3.7943 3.8452 3.8452 4.7091 4.7091 4.7450 4.7450 5.3501 5.3501 5.4249 5.4249 5.7608 5.7608 5.7621 5.7621 6.5370 6.5370 6.5578 6.5578 9.9137 9.9137 10.1636 10.1636 11.6171 11.6171 11.8685 11.8685 12.2148 12.2148 12.3181 12.3181 k = 0.4500 0.5000 0.2183 ( 5340 PWs) bands (ev): -16.5717 -16.5717 -16.5671 -16.5671 -16.5050 -16.5050 -16.5023 -16.5023 -13.7443 -13.7443 -13.7279 -13.7279 -13.5401 -13.5401 -13.5342 -13.5342 -13.5087 -13.5087 -13.5061 -13.5061 -10.0264 -10.0264 -10.0174 -10.0174 -3.5438 -3.5438 -3.5436 -3.5436 -3.0071 -3.0071 -3.0025 -3.0025 2.3976 2.3976 2.5288 2.5288 3.7941 3.7941 3.8380 3.8380 4.6882 4.6882 4.7159 4.7159 5.3565 5.3565 5.4165 5.4165 5.7695 5.7695 5.7698 5.7698 6.5276 6.5276 6.5434 6.5434 9.9439 9.9439 10.1470 10.1470 11.6370 11.6370 11.8422 11.8422 12.1985 12.1985 12.2810 12.2810 k = 0.4625 0.5000 0.2183 ( 5344 PWs) bands (ev): -16.5713 -16.5713 -16.5678 -16.5678 -16.5045 -16.5045 -16.5025 -16.5025 -13.7426 -13.7426 -13.7302 -13.7302 -13.5393 -13.5393 -13.5349 -13.5349 -13.5080 -13.5080 -13.5061 -13.5061 -10.0219 -10.0219 -10.0151 -10.0151 -3.5404 -3.5404 -3.5402 -3.5402 -3.0144 -3.0144 -3.0109 -3.0109 2.4203 2.4203 2.5204 2.5204 3.7959 3.7959 3.8307 3.8307 4.6714 4.6714 4.6917 4.6917 5.3635 5.3635 5.4085 5.4085 5.7761 5.7761 5.7771 5.7771 6.5203 6.5203 6.5316 6.5316 9.9738 9.9738 10.1281 10.1281 11.6593 11.6593 11.8158 11.8158 12.1873 12.1873 12.2488 12.2488 k = 0.4750 0.5000 0.2183 ( 5348 PWs) bands (ev): -16.5708 -16.5708 -16.5685 -16.5685 -16.5041 -16.5041 -16.5027 -16.5027 -13.7408 -13.7408 -13.7325 -13.7325 -13.5386 -13.5386 -13.5356 -13.5356 -13.5074 -13.5074 -13.5061 -13.5061 -10.0183 -10.0183 -10.0137 -10.0137 -3.5380 -3.5380 -3.5378 -3.5378 -3.0194 -3.0194 -3.0170 -3.0170 2.4418 2.4418 2.5094 2.5094 3.7994 3.7994 3.8236 3.8236 4.6597 4.6597 4.6730 4.6730 5.3707 5.3707 5.4008 5.4008 5.7812 5.7812 5.7823 5.7823 6.5153 6.5153 6.5226 6.5226 10.0032 10.0032 10.1070 10.1070 11.6835 11.6835 11.7893 11.7893 12.1816 12.1816 12.2223 12.2223 k = 0.4875 0.5000 0.2183 ( 5336 PWs) bands (ev): -16.5703 -16.5703 -16.5691 -16.5691 -16.5037 -16.5037 -16.5030 -16.5030 -13.7389 -13.7389 -13.7347 -13.7347 -13.5378 -13.5378 -13.5363 -13.5363 -13.5069 -13.5069 -13.5062 -13.5062 -10.0157 -10.0157 -10.0134 -10.0134 -3.5365 -3.5365 -3.5364 -3.5364 -3.0222 -3.0222 -3.0210 -3.0210 2.4617 2.4617 2.4958 2.4958 3.8042 3.8042 3.8166 3.8166 4.6537 4.6537 4.6602 4.6602 5.3782 5.3782 5.3933 5.3933 5.7846 5.7846 5.7853 5.7853 6.5129 6.5129 6.5165 6.5165 10.0315 10.0315 10.0837 10.0837 11.7092 11.7092 11.7625 11.7625 12.1819 12.1819 12.2022 12.2022 k = 0.5000 0.5000 0.2183 ( 5336 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5360 -3.5360 -3.5360 -3.5360 -3.0227 -3.0227 -3.0227 -3.0227 2.4798 2.4798 2.4798 2.4798 3.8101 3.8101 3.8101 3.8101 4.6538 4.6538 4.6538 4.6538 5.3858 5.3858 5.3858 5.3858 5.7860 5.7860 5.7860 5.7860 6.5133 6.5133 6.5133 6.5133 10.0584 10.0584 10.0584 10.0584 11.7357 11.7357 11.7357 11.7357 12.1887 12.1887 12.1887 12.1887 k = 0.5000 0.5000 0.2183 ( 5336 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5360 -3.5360 -3.5360 -3.5360 -3.0227 -3.0227 -3.0227 -3.0227 2.4798 2.4798 2.4798 2.4798 3.8101 3.8101 3.8101 3.8101 4.6538 4.6538 4.6538 4.6538 5.3858 5.3858 5.3858 5.3858 5.7860 5.7860 5.7860 5.7860 6.5133 6.5133 6.5133 6.5133 10.0584 10.0584 10.0584 10.0584 11.7357 11.7357 11.7357 11.7357 12.1887 12.1887 12.1887 12.1887 k = 0.4911 0.4911 0.2183 ( 5336 PWs) bands (ev): -16.5703 -16.5703 -16.5691 -16.5691 -16.5037 -16.5037 -16.5030 -16.5030 -13.7389 -13.7389 -13.7347 -13.7347 -13.5378 -13.5378 -13.5363 -13.5363 -13.5069 -13.5069 -13.5062 -13.5062 -10.0161 -10.0161 -10.0130 -10.0130 -3.5365 -3.5365 -3.5364 -3.5364 -3.0230 -3.0230 -3.0201 -3.0201 2.4614 2.4614 2.4961 2.4961 3.8021 3.8021 3.8188 3.8188 4.6522 4.6522 4.6618 4.6618 5.3780 5.3780 5.3935 5.3935 5.7842 5.7842 5.7857 5.7857 6.5129 6.5129 6.5165 6.5165 10.0309 10.0309 10.0842 10.0842 11.7089 11.7089 11.7628 11.7628 12.1817 12.1817 12.2026 12.2026 k = 0.4821 0.4821 0.2183 ( 5348 PWs) bands (ev): -16.5708 -16.5708 -16.5684 -16.5684 -16.5041 -16.5041 -16.5027 -16.5027 -13.7409 -13.7409 -13.7325 -13.7325 -13.5386 -13.5386 -13.5356 -13.5356 -13.5074 -13.5074 -13.5061 -13.5061 -10.0209 -10.0209 -10.0112 -10.0112 -3.5381 -3.5381 -3.5378 -3.5378 -3.0235 -3.0235 -3.0127 -3.0127 2.4402 2.4402 2.5110 2.5110 3.7866 3.7866 3.8367 3.8367 4.6512 4.6512 4.6815 4.6815 5.3695 5.3695 5.4020 5.4020 5.7789 5.7789 5.7845 5.7845 6.5154 6.5154 6.5228 6.5228 10.0007 10.0007 10.1094 10.1094 11.6825 11.6825 11.7901 11.7901 12.1801 12.1801 12.2244 12.2244 k = 0.4732 0.4732 0.2183 ( 5336 PWs) bands (ev): -16.5713 -16.5713 -16.5678 -16.5678 -16.5046 -16.5046 -16.5024 -16.5024 -13.7427 -13.7427 -13.7301 -13.7301 -13.5393 -13.5393 -13.5349 -13.5349 -13.5079 -13.5079 -13.5061 -13.5061 -10.0288 -10.0288 -10.0083 -10.0083 -3.5408 -3.5408 -3.5402 -3.5402 -3.0242 -3.0242 -3.0005 -3.0005 2.4162 2.4162 2.5252 2.5252 3.7633 3.7633 3.8650 3.8650 4.6496 4.6496 4.7122 4.7122 5.3597 5.3597 5.4120 5.4120 5.7705 5.7705 5.7825 5.7825 6.5203 6.5203 6.5322 6.5322 9.9669 9.9669 10.1353 10.1353 11.6567 11.6567 11.8174 11.8174 12.1828 12.1828 12.2547 12.2547 k = 0.4643 0.4643 0.2183 ( 5336 PWs) bands (ev): -16.5718 -16.5718 -16.5670 -16.5670 -16.5051 -16.5051 -16.5022 -16.5022 -13.7444 -13.7444 -13.7277 -13.7277 -13.5401 -13.5401 -13.5342 -13.5342 -13.5087 -13.5087 -13.5062 -13.5062 -10.0397 -10.0397 -10.0043 -10.0043 -3.5447 -3.5447 -3.5435 -3.5435 -3.0250 -3.0250 -2.9834 -2.9834 2.3893 2.3893 2.5397 2.5397 3.7339 3.7339 3.9028 3.9028 4.6474 4.6474 4.7517 4.7517 5.3481 5.3481 5.4241 5.4241 5.7595 5.7595 5.7798 5.7798 6.5275 6.5275 6.5446 6.5446 9.9292 9.9292 10.1628 10.1628 11.6316 11.6316 11.8444 11.8444 12.1894 12.1894 12.2933 12.2933 k = 0.4554 0.4554 0.2183 ( 5344 PWs) bands (ev): -16.5722 -16.5722 -16.5663 -16.5663 -16.5056 -16.5056 -16.5021 -16.5021 -13.7461 -13.7461 -13.7251 -13.7251 -13.5409 -13.5409 -13.5336 -13.5336 -13.5095 -13.5095 -13.5064 -13.5064 -10.0536 -10.0536 -9.9992 -9.9992 -3.5501 -3.5501 -3.5477 -3.5477 -3.0256 -3.0256 -2.9616 -2.9616 2.3600 2.3600 2.5549 2.5549 3.7004 3.7004 3.9488 3.9488 4.6445 4.6445 4.7978 4.7978 5.3345 5.3345 5.4388 5.4388 5.7467 5.7467 5.7762 5.7762 6.5368 6.5368 6.5602 6.5602 9.8878 9.8878 10.1925 10.1925 11.6070 11.6070 11.8710 11.8710 12.1996 12.1996 12.3393 12.3393 k = 0.4464 0.4464 0.2183 ( 5350 PWs) bands (ev): -16.5726 -16.5726 -16.5655 -16.5655 -16.5062 -16.5062 -16.5020 -16.5020 -13.7477 -13.7477 -13.7225 -13.7225 -13.5417 -13.5417 -13.5330 -13.5330 -13.5104 -13.5104 -13.5067 -13.5067 -10.0705 -10.0705 -9.9929 -9.9929 -3.5570 -3.5570 -3.5529 -3.5529 -3.0259 -3.0259 -2.9351 -2.9351 2.3289 2.3289 2.5713 2.5713 3.6645 3.6645 4.0012 4.0012 4.6407 4.6407 4.8482 4.8482 5.3190 5.3190 5.4563 5.4563 5.7331 5.7331 5.7720 5.7720 6.5479 6.5479 6.5787 6.5787 9.8431 9.8431 10.2248 10.2248 11.5829 11.5829 11.8968 11.8968 12.2135 12.2135 12.3916 12.3916 k = 0.4375 0.4375 0.2183 ( 5344 PWs) bands (ev): -16.5729 -16.5729 -16.5647 -16.5647 -16.5068 -16.5068 -16.5019 -16.5019 -13.7491 -13.7491 -13.7197 -13.7197 -13.5425 -13.5425 -13.5324 -13.5324 -13.5114 -13.5114 -13.5071 -13.5071 -10.0901 -10.0901 -9.9856 -9.9856 -3.5658 -3.5658 -3.5591 -3.5591 -3.0256 -3.0256 -2.9042 -2.9042 2.2967 2.2967 2.5892 2.5892 3.6279 3.6279 4.0585 4.0585 4.6362 4.6362 4.9011 4.9011 5.3017 5.3017 5.4771 5.4771 5.7197 5.7197 5.7669 5.7669 6.5605 6.5605 6.6002 6.6002 9.7957 9.7957 10.2599 10.2599 11.5592 11.5592 11.9213 11.9213 12.2315 12.2315 12.4491 12.4491 k = 0.4286 0.4286 0.2183 ( 5348 PWs) bands (ev): -16.5732 -16.5732 -16.5638 -16.5638 -16.5075 -16.5075 -16.5019 -16.5019 -13.7505 -13.7505 -13.7168 -13.7168 -13.5434 -13.5434 -13.5318 -13.5318 -13.5125 -13.5125 -13.5076 -13.5076 -10.1124 -10.1124 -9.9772 -9.9772 -3.5766 -3.5766 -3.5662 -3.5662 -3.0243 -3.0243 -2.8689 -2.8689 2.2639 2.2639 2.6088 2.6088 3.5916 3.5916 4.1186 4.1186 4.6309 4.6309 4.9548 4.9548 5.2829 5.2829 5.5013 5.5013 5.7077 5.7077 5.7612 5.7612 6.5744 6.5744 6.6243 6.6243 9.7465 9.7465 10.2977 10.2977 11.5357 11.5357 11.9440 11.9440 12.2538 12.2538 12.5105 12.5105 k = 0.4196 0.4196 0.2183 ( 5344 PWs) bands (ev): -16.5735 -16.5735 -16.5630 -16.5630 -16.5081 -16.5081 -16.5019 -16.5019 -13.7517 -13.7517 -13.7139 -13.7139 -13.5442 -13.5442 -13.5313 -13.5313 -13.5137 -13.5137 -13.5082 -13.5082 -10.1373 -10.1373 -9.9678 -9.9678 -3.5895 -3.5895 -3.5742 -3.5742 -3.0218 -3.0218 -2.8294 -2.8294 2.2311 2.2311 2.6304 2.6304 3.5567 3.5567 4.1794 4.1794 4.6249 4.6249 5.0078 5.0078 5.2635 5.2635 5.5290 5.5290 5.6983 5.6983 5.7549 5.7549 6.5893 6.5893 6.6510 6.6510 9.6964 9.6964 10.3381 10.3381 11.5123 11.5123 11.9647 11.9647 12.2803 12.2803 12.5747 12.5747 k = 0.4107 0.4107 0.2183 ( 5340 PWs) bands (ev): -16.5737 -16.5737 -16.5620 -16.5620 -16.5089 -16.5089 -16.5019 -16.5019 -13.7529 -13.7529 -13.7108 -13.7108 -13.5450 -13.5450 -13.5309 -13.5309 -13.5150 -13.5150 -13.5089 -13.5089 -10.1646 -10.1646 -9.9573 -9.9573 -3.6048 -3.6048 -3.5833 -3.5833 -3.0179 -3.0179 -2.7859 -2.7859 2.1988 2.1988 2.6539 2.6539 3.5238 3.5238 4.2383 4.2383 4.6187 4.6187 5.0588 5.0588 5.2446 5.2446 5.5602 5.5602 5.6926 5.6926 5.7481 5.7481 6.6052 6.6052 6.6798 6.6798 9.6463 9.6463 10.3808 10.3808 11.4889 11.4889 11.9831 11.9831 12.3109 12.3109 12.6405 12.6405 k = 0.4018 0.4018 0.2183 ( 5344 PWs) bands (ev): -16.5740 -16.5740 -16.5611 -16.5611 -16.5096 -16.5096 -16.5020 -16.5020 -13.7540 -13.7540 -13.7076 -13.7076 -13.5458 -13.5458 -13.5305 -13.5305 -13.5164 -13.5164 -13.5096 -13.5096 -10.1941 -10.1941 -9.9458 -9.9458 -3.6226 -3.6226 -3.5932 -3.5932 -3.0124 -3.0124 -2.7385 -2.7385 2.1673 2.1673 2.6794 2.6794 3.4935 3.4935 4.2919 4.2919 4.6131 4.6131 5.1065 5.1065 5.2286 5.2286 5.5940 5.5940 5.6918 5.6918 5.7409 5.7409 6.6220 6.6220 6.7106 6.7106 9.5971 9.5971 10.4255 10.4255 11.4654 11.4654 11.9992 11.9992 12.3450 12.3450 12.7072 12.7072 k = 0.3929 0.3929 0.2183 ( 5346 PWs) bands (ev): -16.5741 -16.5741 -16.5601 -16.5601 -16.5104 -16.5104 -16.5022 -16.5022 -13.7550 -13.7550 -13.7043 -13.7043 -13.5467 -13.5467 -13.5301 -13.5301 -13.5178 -13.5178 -13.5105 -13.5105 -10.2258 -10.2258 -9.9334 -9.9334 -3.6429 -3.6429 -3.6042 -3.6042 -3.0051 -3.0051 -2.6875 -2.6875 2.1370 2.1370 2.7069 2.7069 3.4662 3.4662 4.3360 4.3360 4.6098 4.6098 5.1478 5.1478 5.2200 5.2200 5.6288 5.6288 5.6971 5.6971 5.7345 5.7345 6.6395 6.6395 6.7428 6.7428 9.5497 9.5497 10.4717 10.4717 11.4417 11.4417 12.0134 12.0134 12.3818 12.3818 12.7738 12.7738 k = 0.3839 0.3839 0.2183 ( 5342 PWs) bands (ev): -16.5743 -16.5743 -16.5592 -16.5592 -16.5112 -16.5112 -16.5024 -16.5024 -13.7559 -13.7559 -13.7009 -13.7009 -13.5475 -13.5475 -13.5298 -13.5298 -13.5192 -13.5192 -13.5114 -13.5114 -10.2594 -10.2594 -9.9201 -9.9201 -3.6657 -3.6657 -3.6160 -3.6160 -2.9959 -2.9959 -2.6331 -2.6331 2.1081 2.1081 2.7365 2.7365 3.4424 3.4424 4.3652 4.3652 4.6111 4.6111 5.1745 5.1745 5.2295 5.2295 5.6606 5.6606 5.7064 5.7064 5.7346 5.7346 6.6578 6.6578 6.7759 6.7759 9.5050 9.5050 10.5190 10.5190 11.4179 11.4179 12.0259 12.0259 12.4201 12.4201 12.8398 12.8398 k = 0.3750 0.3750 0.2183 ( 5330 PWs) bands (ev): -16.5744 -16.5744 -16.5581 -16.5581 -16.5120 -16.5120 -16.5026 -16.5026 -13.7567 -13.7567 -13.6975 -13.6975 -13.5483 -13.5483 -13.5297 -13.5297 -13.5206 -13.5206 -13.5124 -13.5124 -10.2948 -10.2948 -9.9058 -9.9058 -3.6909 -3.6909 -3.6288 -3.6288 -2.9848 -2.9848 -2.5754 -2.5754 2.0807 2.0807 2.7682 2.7682 3.4223 3.4223 4.3757 4.3757 4.6183 4.6183 5.1866 5.1866 5.2594 5.2594 5.6859 5.6859 5.7059 5.7059 5.7582 5.7582 6.6769 6.6769 6.8094 6.8094 9.4638 9.4638 10.5668 10.5668 11.3940 11.3940 12.0371 12.0371 12.4588 12.4588 12.9044 12.9044 k = 0.3661 0.3661 0.2183 ( 5334 PWs) bands (ev): -16.5744 -16.5744 -16.5571 -16.5571 -16.5129 -16.5129 -16.5028 -16.5028 -13.7574 -13.7574 -13.6939 -13.6939 -13.5492 -13.5492 -13.5296 -13.5296 -13.5220 -13.5220 -13.5135 -13.5135 -10.3319 -10.3319 -9.8907 -9.8907 -3.7185 -3.7185 -3.6425 -3.6425 -2.9718 -2.9718 -2.5148 -2.5148 2.0550 2.0550 2.8019 2.8019 3.4060 3.4060 4.3671 4.3671 4.6301 4.6301 5.2004 5.2004 5.2953 5.2953 5.6969 5.6969 5.7095 5.7095 5.7984 5.7984 6.6971 6.6971 6.8427 6.8427 9.4268 9.4268 10.6148 10.6148 11.3701 11.3701 12.0472 12.0472 12.4966 12.4966 12.9672 12.9672 k = 0.3571 0.3571 0.2183 ( 5340 PWs) bands (ev): -16.5745 -16.5745 -16.5560 -16.5560 -16.5138 -16.5138 -16.5031 -16.5031 -13.7580 -13.7580 -13.6902 -13.6902 -13.5500 -13.5500 -13.5298 -13.5298 -13.5233 -13.5233 -13.5146 -13.5146 -10.3703 -10.3703 -9.8748 -9.8748 -3.7482 -3.7482 -3.6571 -3.6571 -2.9568 -2.9568 -2.4513 -2.4513 2.0309 2.0309 2.8375 2.8375 3.3938 3.3938 4.3424 4.3424 4.6432 4.6432 5.2220 5.2220 5.3317 5.3317 5.6874 5.6874 5.7333 5.7333 5.8447 5.8447 6.7183 6.7183 6.8749 6.8749 9.3947 9.3947 10.6623 10.6623 11.3465 11.3465 12.0568 12.0568 12.5323 12.5323 13.0277 13.0277 k = 0.3482 0.3482 0.2183 ( 5340 PWs) bands (ev): -16.5745 -16.5745 -16.5550 -16.5550 -16.5147 -16.5147 -16.5035 -16.5035 -13.7586 -13.7586 -13.6864 -13.6864 -13.5509 -13.5509 -13.5303 -13.5303 -13.5243 -13.5243 -13.5158 -13.5158 -10.4101 -10.4101 -9.8582 -9.8582 -3.7800 -3.7800 -3.6725 -3.6725 -2.9401 -2.9401 -2.3853 -2.3853 2.0087 2.0087 2.8751 2.8751 3.3857 3.3857 4.3055 4.3055 4.6552 4.6552 5.2515 5.2515 5.3677 5.3677 5.6766 5.6766 5.7604 5.7604 5.8936 5.8936 6.7409 6.7409 6.9055 6.9055 9.3682 9.3682 10.7087 10.7087 11.3235 11.3235 12.0660 12.0660 12.5646 12.5646 13.0854 13.0854 k = 0.3393 0.3393 0.2183 ( 5346 PWs) bands (ev): -16.5744 -16.5744 -16.5539 -16.5539 -16.5156 -16.5156 -16.5039 -16.5039 -13.7590 -13.7590 -13.6825 -13.6825 -13.5517 -13.5517 -13.5311 -13.5311 -13.5250 -13.5250 -13.5170 -13.5170 -10.4509 -10.4509 -9.8408 -9.8408 -3.8135 -3.8135 -3.6888 -3.6888 -2.9217 -2.9217 -2.3170 -2.3170 1.9881 1.9881 2.9146 2.9146 3.3817 3.3817 4.2592 4.2592 4.6656 4.6656 5.2870 5.2870 5.4031 5.4031 5.6653 5.6653 5.7909 5.7909 5.9436 5.9436 6.7649 6.7649 6.9339 6.9339 9.3476 9.3476 10.7535 10.7535 11.3013 11.3013 12.0753 12.0753 12.5926 12.5926 13.1395 13.1395 k = 0.3304 0.3304 0.2183 ( 5346 PWs) bands (ev): -16.5744 -16.5744 -16.5528 -16.5528 -16.5165 -16.5165 -16.5043 -16.5043 -13.7594 -13.7594 -13.6785 -13.6785 -13.5526 -13.5526 -13.5322 -13.5322 -13.5255 -13.5255 -13.5183 -13.5183 -10.4928 -10.4928 -9.8227 -9.8227 -3.8487 -3.8487 -3.7059 -3.7059 -2.9016 -2.9016 -2.2465 -2.2465 1.9693 1.9693 2.9560 2.9560 3.3817 3.3817 4.2058 4.2058 4.6752 4.6752 5.3257 5.3257 5.4385 5.4385 5.6536 5.6536 5.8241 5.8241 5.9939 5.9939 6.7904 6.7904 6.9595 6.9595 9.3332 9.3332 10.7961 10.7961 11.2802 11.2802 12.0848 12.0848 12.6155 12.6155 13.1891 13.1891 k = 0.3214 0.3214 0.2183 ( 5344 PWs) bands (ev): -16.5743 -16.5743 -16.5516 -16.5516 -16.5175 -16.5175 -16.5047 -16.5047 -13.7597 -13.7597 -13.6745 -13.6745 -13.5536 -13.5536 -13.5335 -13.5335 -13.5258 -13.5258 -13.5196 -13.5196 -10.5354 -10.5354 -9.8040 -9.8040 -3.8852 -3.8852 -3.7237 -3.7237 -2.8801 -2.8801 -2.1742 -2.1742 1.9522 1.9522 2.9991 2.9991 3.3857 3.3857 4.1472 4.1472 4.6850 4.6850 5.3653 5.3653 5.4741 5.4741 5.6418 5.6418 5.8595 5.8595 6.0439 6.0439 6.8171 6.8171 6.9821 6.9821 9.3251 9.3251 10.8360 10.8360 11.2607 11.2607 12.0948 12.0948 12.6326 12.6326 13.2331 13.2331 k = 0.3125 0.3125 0.2183 ( 5340 PWs) bands (ev): -16.5742 -16.5742 -16.5505 -16.5505 -16.5184 -16.5184 -16.5052 -16.5052 -13.7599 -13.7599 -13.6703 -13.6703 -13.5545 -13.5545 -13.5350 -13.5350 -13.5259 -13.5259 -13.5209 -13.5209 -10.5786 -10.5786 -9.7848 -9.7848 -3.9229 -3.9229 -3.7423 -3.7423 -2.8572 -2.8572 -2.1001 -2.1001 1.9367 1.9367 3.0440 3.0440 3.3931 3.3931 4.0851 4.0851 4.6957 4.6957 5.4037 5.4037 5.5102 5.5102 5.6303 5.6303 5.8962 5.8962 6.0936 6.0936 6.8447 6.8447 7.0019 7.0019 9.3232 9.3232 10.8727 10.8727 11.2428 11.2428 12.1058 12.1058 12.6439 12.6439 13.2697 13.2697 k = 0.3036 0.3036 0.2183 ( 5328 PWs) bands (ev): -16.5741 -16.5741 -16.5494 -16.5494 -16.5194 -16.5194 -16.5057 -16.5057 -13.7600 -13.7600 -13.6661 -13.6661 -13.5555 -13.5555 -13.5365 -13.5365 -13.5261 -13.5261 -13.5222 -13.5222 -10.6224 -10.6224 -9.7650 -9.7650 -3.9615 -3.9615 -3.7614 -3.7614 -2.8331 -2.8331 -2.0246 -2.0246 1.9228 1.9228 3.0905 3.0905 3.4036 3.4036 4.0212 4.0212 4.7082 4.7082 5.4392 5.4392 5.5460 5.5460 5.6206 5.6206 5.9330 5.9330 6.1427 6.1427 6.8720 6.8720 7.0195 7.0195 9.3270 9.3270 10.9062 10.9062 11.2265 11.2265 12.1179 12.1179 12.6495 12.6495 13.2973 13.2973 k = 0.2946 0.2946 0.2183 ( 5332 PWs) bands (ev): -16.5739 -16.5739 -16.5482 -16.5482 -16.5204 -16.5204 -16.5062 -16.5062 -13.7600 -13.7600 -13.6618 -13.6618 -13.5566 -13.5566 -13.5380 -13.5380 -13.5262 -13.5262 -13.5236 -13.5236 -10.6665 -10.6665 -9.7448 -9.7448 -4.0010 -4.0010 -3.7812 -3.7812 -2.8078 -2.8078 -1.9479 -1.9479 1.9104 1.9104 3.1385 3.1385 3.4160 3.4160 3.9573 3.9573 4.7228 4.7228 5.4709 5.4709 5.5747 5.5747 5.6197 5.6197 5.9690 5.9690 6.1912 6.1912 6.8972 6.8972 7.0364 7.0364 9.3360 9.3360 10.9363 10.9363 11.2117 11.2117 12.1313 12.1313 12.6498 12.6498 13.3138 13.3138 k = 0.2857 0.2857 0.2183 ( 5338 PWs) bands (ev): -16.5737 -16.5737 -16.5471 -16.5471 -16.5214 -16.5214 -16.5067 -16.5067 -13.7600 -13.7600 -13.6574 -13.6574 -13.5577 -13.5577 -13.5395 -13.5395 -13.5263 -13.5263 -13.5249 -13.5249 -10.7108 -10.7108 -9.7242 -9.7242 -4.0410 -4.0410 -3.8015 -3.8015 -2.7815 -2.7815 -1.8702 -1.8702 1.8996 1.8996 3.1880 3.1880 3.4287 3.4287 3.8959 3.8959 4.7401 4.7401 5.4978 5.4978 5.5799 5.5799 5.6447 5.6447 6.0036 6.0036 6.2392 6.2392 6.9179 6.9179 7.0548 7.0548 9.3495 9.3495 10.9635 10.9635 11.1977 11.1977 12.1462 12.1462 12.6457 12.6457 13.3177 13.3177 k = 0.2768 0.2768 0.2183 ( 5318 PWs) bands (ev): -16.5735 -16.5735 -16.5459 -16.5459 -16.5224 -16.5224 -16.5073 -16.5073 -13.7598 -13.7598 -13.6530 -13.6530 -13.5588 -13.5588 -13.5409 -13.5409 -13.5266 -13.5266 -13.5260 -13.5260 -10.7552 -10.7552 -9.7033 -9.7033 -4.0813 -4.0813 -3.8223 -3.8223 -2.7544 -2.7544 -1.7916 -1.7916 1.8901 1.8901 3.2390 3.2390 3.4384 3.4384 3.8408 3.8408 4.7601 4.7601 5.5181 5.5181 5.5750 5.5750 5.6837 5.6837 6.0361 6.0361 6.2868 6.2868 6.9318 6.9318 7.0766 7.0766 9.3666 9.3666 10.9879 10.9879 11.1841 11.1841 12.1625 12.1625 12.6381 12.6381 13.3081 13.3081 k = 0.2679 0.2679 0.2183 ( 5326 PWs) bands (ev): -16.5733 -16.5733 -16.5448 -16.5448 -16.5234 -16.5234 -16.5079 -16.5079 -13.7597 -13.7597 -13.6485 -13.6485 -13.5600 -13.5600 -13.5422 -13.5422 -13.5276 -13.5276 -13.5264 -13.5264 -10.7995 -10.7995 -9.6821 -9.6821 -4.1219 -4.1219 -3.8434 -3.8434 -2.7266 -2.7266 -1.7124 -1.7124 1.8821 1.8821 3.2911 3.2911 3.4400 3.4400 3.7975 3.7975 4.7831 4.7831 5.5270 5.5270 5.5751 5.5751 5.7261 5.7261 6.0664 6.0664 6.3337 6.3337 6.9381 6.9381 7.1021 7.1021 9.3863 9.3863 11.0091 11.0091 11.1710 11.1710 12.1801 12.1801 12.6282 12.6282 13.2851 13.2851 k = 0.2589 0.2589 0.2183 ( 5330 PWs) bands (ev): -16.5730 -16.5730 -16.5436 -16.5436 -16.5244 -16.5244 -16.5085 -16.5085 -13.7594 -13.7594 -13.6440 -13.6440 -13.5613 -13.5613 -13.5435 -13.5435 -13.5288 -13.5288 -13.5266 -13.5266 -10.8437 -10.8437 -9.6606 -9.6606 -4.1625 -4.1625 -3.8649 -3.8649 -2.6981 -2.6981 -1.6328 -1.6328 1.8755 1.8755 3.3445 3.3445 3.4272 3.4272 3.7728 3.7728 4.8091 4.8091 5.5228 5.5228 5.5839 5.5839 5.7698 5.7698 6.0944 6.0944 6.3799 6.3799 6.9382 6.9382 7.1300 7.1300 9.4078 9.4078 11.0246 11.0246 11.1606 11.1606 12.1983 12.1983 12.6173 12.6173 13.2499 13.2499 k = 0.2500 0.2500 0.2183 ( 5326 PWs) bands (ev): -16.5727 -16.5727 -16.5425 -16.5425 -16.5254 -16.5254 -16.5091 -16.5091 -13.7591 -13.7591 -13.6395 -13.6395 -13.5626 -13.5626 -13.5447 -13.5447 -13.5299 -13.5299 -13.5268 -13.5268 -10.8875 -10.8875 -9.6390 -9.6390 -4.2031 -4.2031 -3.8867 -3.8867 -2.6692 -2.6692 -1.5530 -1.5530 1.8701 1.8701 3.3959 3.3959 3.3993 3.3993 3.7706 3.7706 4.8381 4.8381 5.5121 5.5121 5.5953 5.5953 5.8141 5.8141 6.1202 6.1202 6.4249 6.4249 6.9339 6.9339 7.1583 7.1583 9.4300 9.4300 11.0280 11.0280 11.1590 11.1590 12.2163 12.2163 12.6064 12.6064 13.2046 13.2046 k = 0.2411 0.2411 0.2183 ( 5308 PWs) bands (ev): -16.5724 -16.5724 -16.5414 -16.5414 -16.5264 -16.5264 -16.5097 -16.5097 -13.7587 -13.7587 -13.6350 -13.6350 -13.5640 -13.5640 -13.5458 -13.5458 -13.5310 -13.5310 -13.5270 -13.5270 -10.9309 -10.9309 -9.6174 -9.6174 -4.2433 -4.2433 -3.9085 -3.9085 -2.6399 -2.6399 -1.4731 -1.4731 1.8661 1.8661 3.3498 3.3498 3.4545 3.4545 3.7885 3.7885 4.8702 4.8702 5.4989 5.4989 5.6053 5.6053 5.8587 5.8587 6.1442 6.1442 6.4683 6.4683 6.9273 6.9273 7.1850 7.1850 9.4524 9.4524 11.0128 11.0128 11.1721 11.1721 12.2332 12.2332 12.5964 12.5964 13.1523 13.1523 k = 0.2321 0.2321 0.2183 ( 5316 PWs) bands (ev): -16.5721 -16.5721 -16.5403 -16.5403 -16.5274 -16.5274 -16.5104 -16.5104 -13.7583 -13.7583 -13.6305 -13.6305 -13.5653 -13.5653 -13.5469 -13.5469 -13.5321 -13.5321 -13.5273 -13.5273 -10.9738 -10.9738 -9.5957 -9.5957 -4.2831 -4.2831 -3.9305 -3.9305 -2.6103 -2.6103 -1.3935 -1.3935 1.8633 1.8633 3.2933 3.2933 3.5109 3.5109 3.8211 3.8211 4.9051 4.9051 5.4846 5.4846 5.6126 5.6126 5.9034 5.9034 6.1667 6.1667 6.5093 6.5093 6.9204 6.9204 7.2090 7.2090 9.4740 9.4740 10.9802 10.9802 11.1985 11.1985 12.2476 12.2476 12.5873 12.5873 13.0970 13.0970 k = 0.2232 0.2232 0.2183 ( 5320 PWs) bands (ev): -16.5718 -16.5718 -16.5392 -16.5392 -16.5284 -16.5284 -16.5110 -16.5110 -13.7578 -13.7578 -13.6260 -13.6260 -13.5667 -13.5667 -13.5480 -13.5480 -13.5330 -13.5330 -13.5275 -13.5275 -11.0160 -11.0160 -9.5741 -9.5741 -4.3224 -4.3224 -3.9525 -3.9525 -2.5807 -2.5807 -1.3143 -1.3143 1.8618 1.8618 3.2313 3.2313 3.5680 3.5680 3.8639 3.8639 4.9428 4.9428 5.4697 5.4697 5.6168 5.6168 5.9479 5.9479 6.1877 6.1877 6.5468 6.5468 6.9151 6.9151 7.2292 7.2292 9.4943 9.4943 10.9346 10.9346 11.2332 11.2332 12.2584 12.2584 12.5775 12.5775 13.0439 13.0439 k = 0.2143 0.2143 0.2183 ( 5312 PWs) bands (ev): -16.5715 -16.5715 -16.5381 -16.5381 -16.5294 -16.5294 -16.5117 -16.5117 -13.7573 -13.7573 -13.6216 -13.6216 -13.5681 -13.5681 -13.5490 -13.5490 -13.5338 -13.5338 -13.5277 -13.5277 -11.0575 -11.0575 -9.5526 -9.5526 -4.3610 -4.3610 -3.9744 -3.9744 -2.5511 -2.5511 -1.2356 -1.2356 1.8615 1.8615 3.1667 3.1667 3.6259 3.6259 3.9140 3.9140 4.9830 4.9830 5.4545 5.4545 5.6179 5.6179 5.9920 5.9920 6.2074 6.2074 6.5797 6.5797 6.9137 6.9137 7.2453 7.2453 9.5125 9.5125 10.8787 10.8787 11.2732 11.2732 12.2651 12.2651 12.5639 12.5640 12.9993 12.9993 k = 0.2054 0.2054 0.2183 ( 5322 PWs) bands (ev): -16.5711 -16.5711 -16.5370 -16.5370 -16.5304 -16.5304 -16.5123 -16.5123 -13.7567 -13.7567 -13.6173 -13.6173 -13.5695 -13.5695 -13.5500 -13.5500 -13.5345 -13.5345 -13.5278 -13.5278 -11.0982 -11.0982 -9.5313 -9.5313 -4.3988 -4.3988 -3.9961 -3.9961 -2.5217 -2.5217 -1.1578 -1.1578 1.8623 1.8623 3.1015 3.1015 3.6843 3.6843 3.9695 3.9695 5.0255 5.0255 5.4390 5.4390 5.6158 5.6158 6.0355 6.0355 6.2258 6.2258 6.6065 6.6065 6.9180 6.9180 7.2571 7.2571 9.5280 9.5280 10.8138 10.8138 11.3163 11.3163 12.2674 12.2674 12.5420 12.5420 12.9699 12.9699 k = 0.1964 0.1964 0.2183 ( 5320 PWs) bands (ev): -16.5708 -16.5708 -16.5360 -16.5360 -16.5313 -16.5313 -16.5130 -16.5130 -13.7561 -13.7561 -13.6131 -13.6131 -13.5708 -13.5708 -13.5509 -13.5509 -13.5351 -13.5351 -13.5280 -13.5280 -11.1379 -11.1379 -9.5102 -9.5102 -4.4357 -4.4357 -4.0176 -4.0176 -2.4925 -2.4925 -1.0809 -1.0809 1.8642 1.8642 3.0366 3.0366 3.7431 3.7431 4.0292 4.0292 5.0699 5.0699 5.4233 5.4233 5.6108 5.6108 6.0781 6.0781 6.2427 6.2427 6.6265 6.6265 6.9297 6.9297 7.2648 7.2648 9.5400 9.5400 10.7411 10.7411 11.3608 11.3608 12.2655 12.2655 12.5092 12.5092 12.9603 12.9603 k = 0.1875 0.1875 0.2183 ( 5318 PWs) bands (ev): -16.5704 -16.5704 -16.5350 -16.5350 -16.5323 -16.5323 -16.5136 -16.5136 -13.7555 -13.7555 -13.6090 -13.6090 -13.5721 -13.5721 -13.5519 -13.5519 -13.5356 -13.5356 -13.5280 -13.5280 -11.1766 -11.1766 -9.4895 -9.4895 -4.4716 -4.4716 -4.0388 -4.0388 -2.4637 -2.4637 -1.0052 -1.0052 1.8672 1.8672 2.9728 2.9728 3.8022 3.8022 4.0921 4.0921 5.1157 5.1157 5.4076 5.4076 5.6033 5.6033 6.1195 6.1195 6.2582 6.2582 6.6398 6.6398 6.9490 6.9490 7.2691 7.2691 9.5479 9.5479 10.6616 10.6616 11.4050 11.4050 12.2594 12.2594 12.4675 12.4675 12.9704 12.9704 k = 0.1786 0.1786 0.2183 ( 5316 PWs) bands (ev): -16.5700 -16.5700 -16.5342 -16.5342 -16.5331 -16.5331 -16.5142 -16.5142 -13.7549 -13.7549 -13.6052 -13.6052 -13.5733 -13.5733 -13.5528 -13.5528 -13.5360 -13.5360 -13.5279 -13.5279 -11.2142 -11.2142 -9.4691 -9.4691 -4.5064 -4.5064 -4.0596 -4.0596 -2.4354 -2.4354 -0.9309 -0.9309 1.8711 1.8711 2.9109 2.9109 3.8614 3.8614 4.1576 4.1576 5.1623 5.1623 5.3920 5.3920 5.5938 5.5938 6.1592 6.1592 6.2720 6.2720 6.6478 6.6478 6.9752 6.9752 7.2706 7.2706 9.5508 9.5508 10.5760 10.5760 11.4468 11.4468 12.2489 12.2489 12.4232 12.4232 12.9966 12.9966 k = 0.1696 0.1696 0.2183 ( 5330 PWs) bands (ev): -16.5696 -16.5696 -16.5343 -16.5343 -16.5329 -16.5329 -16.5148 -16.5148 -13.7542 -13.7542 -13.6016 -13.6016 -13.5743 -13.5743 -13.5537 -13.5537 -13.5363 -13.5363 -13.5277 -13.5277 -11.2505 -11.2505 -9.4492 -9.4492 -4.5400 -4.5400 -4.0799 -4.0799 -2.4077 -2.4077 -0.8583 -0.8583 1.8759 1.8759 2.8511 2.8511 3.9205 3.9205 4.2248 4.2248 5.2084 5.2084 5.3768 5.3768 5.5831 5.5831 6.1968 6.1968 6.2842 6.2842 6.6525 6.6525 7.0065 7.0065 7.2704 7.2704 9.5480 9.5480 10.4854 10.4854 11.4837 11.4837 12.2336 12.2336 12.3832 12.3832 13.0348 13.0348 k = 0.1607 0.1607 0.2183 ( 5330 PWs) bands (ev): -16.5692 -16.5692 -16.5351 -16.5351 -16.5321 -16.5321 -16.5155 -16.5155 -13.7535 -13.7535 -13.5984 -13.5984 -13.5752 -13.5752 -13.5546 -13.5546 -13.5367 -13.5367 -13.5274 -13.5274 -11.2856 -11.2856 -9.4299 -9.4299 -4.5724 -4.5724 -4.0996 -4.0996 -2.3808 -2.3808 -0.7874 -0.7874 1.8813 1.8813 2.7940 2.7940 3.9793 3.9793 4.2932 4.2932 5.2518 5.2518 5.3630 5.3630 5.5722 5.5722 6.2311 6.2311 6.2954 6.2954 6.6558 6.6558 7.0412 7.0412 7.2695 7.2695 9.5388 9.5388 10.3906 10.3906 11.5130 11.5130 12.2149 12.2149 12.3526 12.3526 13.0816 13.0816 k = 0.1518 0.1518 0.2183 ( 5322 PWs) bands (ev): -16.5689 -16.5689 -16.5360 -16.5360 -16.5312 -16.5312 -16.5160 -16.5160 -13.7529 -13.7529 -13.5956 -13.5956 -13.5759 -13.5759 -13.5554 -13.5554 -13.5370 -13.5370 -13.5267 -13.5267 -11.3193 -11.3193 -9.4111 -9.4111 -4.6034 -4.6034 -4.1187 -4.1187 -2.3548 -2.3548 -0.7186 -0.7186 1.8873 1.8873 2.7398 2.7398 4.0376 4.0376 4.3621 4.3621 5.2866 5.2866 5.3547 5.3547 5.5631 5.5631 6.2604 6.2604 6.3072 6.3072 6.6593 6.6593 7.0781 7.0781 7.2690 7.2690 9.5228 9.5228 10.2925 10.2925 11.5315 11.5315 12.1971 12.1971 12.3323 12.3323 13.1347 13.1347 k = 0.1429 0.1429 0.2183 ( 5302 PWs) bands (ev): -16.5685 -16.5685 -16.5368 -16.5368 -16.5303 -16.5303 -16.5166 -16.5166 -13.7522 -13.7522 -13.5933 -13.5933 -13.5763 -13.5763 -13.5562 -13.5562 -13.5373 -13.5373 -13.5259 -13.5259 -11.3515 -11.3515 -9.3931 -9.3931 -4.6330 -4.6330 -4.1371 -4.1371 -2.3296 -2.3296 -0.6520 -0.6520 1.8935 1.8935 2.6890 2.6890 4.0951 4.0951 4.4307 4.4307 5.2991 5.2991 5.3624 5.3624 5.5590 5.5590 6.2813 6.2813 6.3226 6.3226 6.6641 6.6641 7.1159 7.1159 7.2700 7.2700 9.4995 9.4995 10.1921 10.1921 11.5371 11.5371 12.1862 12.1862 12.3201 12.3201 13.1924 13.1924 k = 0.1339 0.1339 0.2183 ( 5320 PWs) bands (ev): -16.5681 -16.5681 -16.5376 -16.5376 -16.5295 -16.5295 -16.5172 -16.5172 -13.7515 -13.7515 -13.5915 -13.5915 -13.5763 -13.5763 -13.5570 -13.5570 -13.5377 -13.5377 -13.5248 -13.5248 -11.3822 -11.3822 -9.3757 -9.3757 -4.6611 -4.6611 -4.1547 -4.1547 -2.3056 -2.3056 -0.5880 -0.5880 1.8999 1.8999 2.6417 2.6417 4.1515 4.1515 4.4985 4.4985 5.2909 5.2909 5.3796 5.3796 5.5644 5.5644 6.2932 6.2932 6.3424 6.3424 6.6710 6.6710 7.1537 7.1537 7.2736 7.2736 9.4687 9.4687 10.0901 10.0901 11.5292 11.5292 12.1857 12.1857 12.3140 12.3140 13.2534 13.2534 k = 0.1250 0.1250 0.2183 ( 5320 PWs) bands (ev): -16.5677 -16.5677 -16.5384 -16.5384 -16.5288 -16.5288 -16.5177 -16.5177 -13.7509 -13.7509 -13.5904 -13.5904 -13.5760 -13.5760 -13.5576 -13.5576 -13.5382 -13.5382 -13.5235 -13.5235 -11.4113 -11.4113 -9.3591 -9.3591 -4.6876 -4.6876 -4.1715 -4.1715 -2.2826 -2.2826 -0.5266 -0.5266 1.9061 1.9061 2.5983 2.5983 4.2065 4.2065 4.5645 4.5645 5.2763 5.2763 5.3887 5.3887 5.5828 5.5828 6.3002 6.3002 6.3626 6.3626 6.6805 6.6805 7.1908 7.1908 7.2806 7.2806 9.4307 9.4307 9.9875 9.9875 11.5098 11.5098 12.1946 12.1946 12.3137 12.3137 13.3168 13.3168 k = 0.1161 0.1161 0.2183 ( 5328 PWs) bands (ev): -16.5673 -16.5673 -16.5392 -16.5392 -16.5281 -16.5281 -16.5182 -16.5182 -13.7503 -13.7503 -13.5898 -13.5898 -13.5754 -13.5754 -13.5581 -13.5581 -13.5386 -13.5386 -13.5220 -13.5220 -11.4388 -11.4388 -9.3434 -9.3434 -4.7125 -4.7125 -4.1874 -4.1874 -2.2609 -2.2609 -0.4682 -0.4682 1.9118 1.9118 2.5591 2.5591 4.2598 4.2598 4.6281 4.6281 5.2598 5.2598 5.3866 5.3866 5.6126 5.6126 6.3054 6.3054 6.3806 6.3806 6.6928 6.6928 7.2262 7.2262 7.2919 7.2919 9.3858 9.3858 9.8851 9.8851 11.4820 11.4820 12.2087 12.2087 12.3205 12.3205 13.3817 13.3817 k = 0.1071 0.1071 0.2183 ( 5328 PWs) bands (ev): -16.5669 -16.5669 -16.5399 -16.5399 -16.5274 -16.5274 -16.5187 -16.5187 -13.7497 -13.7497 -13.5896 -13.5896 -13.5747 -13.5747 -13.5586 -13.5586 -13.5391 -13.5391 -13.5203 -13.5203 -11.4645 -11.4645 -9.3286 -9.3286 -4.7358 -4.7358 -4.2024 -4.2024 -2.2405 -2.2405 -0.4129 -0.4129 1.9168 1.9168 2.5242 2.5242 4.3111 4.3111 4.6883 4.6883 5.2428 5.2428 5.3771 5.3771 5.6487 5.6487 6.3105 6.3105 6.3955 6.3955 6.7079 6.7079 7.2590 7.2591 7.3084 7.3084 9.3347 9.3347 9.7837 9.7837 11.4495 11.4495 12.2225 12.2225 12.3362 12.3362 13.4472 13.4472 k = 0.0982 0.0982 0.2183 ( 5328 PWs) bands (ev): -16.5665 -16.5665 -16.5406 -16.5406 -16.5268 -16.5268 -16.5191 -16.5191 -13.7491 -13.7491 -13.5897 -13.5897 -13.5739 -13.5739 -13.5589 -13.5589 -13.5397 -13.5397 -13.5184 -13.5184 -11.4884 -11.4884 -9.3148 -9.3148 -4.7574 -4.7574 -4.2163 -4.2163 -2.2215 -2.2215 -0.3610 -0.3610 1.9207 1.9207 2.4938 2.4938 4.3601 4.3601 4.7443 4.7443 5.2259 5.2259 5.3636 5.3636 5.6870 5.6870 6.3162 6.3162 6.4075 6.4075 6.7255 6.7255 7.2887 7.2887 7.3304 7.3304 9.2783 9.2783 9.6841 9.6841 11.4152 11.4152 12.2325 12.2325 12.3614 12.3614 13.5123 13.5123 k = 0.0893 0.0893 0.2183 ( 5336 PWs) bands (ev): -16.5662 -16.5662 -16.5412 -16.5412 -16.5262 -16.5262 -16.5195 -16.5195 -13.7486 -13.7486 -13.5900 -13.5900 -13.5732 -13.5732 -13.5590 -13.5590 -13.5402 -13.5402 -13.5165 -13.5165 -11.5105 -11.5105 -9.3019 -9.3019 -4.7773 -4.7773 -4.2293 -4.2293 -2.2039 -2.2039 -0.3127 -0.3127 1.9235 1.9235 2.4680 2.4680 4.4063 4.4063 4.7954 4.7954 5.2096 5.2096 5.3485 5.3485 5.7248 5.7248 6.3231 6.3231 6.4169 6.4169 6.7453 6.7453 7.3161 7.3161 7.3563 7.3563 9.2178 9.2178 9.5870 9.5870 11.3812 11.3812 12.2386 12.2386 12.3935 12.3935 13.5761 13.5761 k = 0.0804 0.0804 0.2183 ( 5336 PWs) bands (ev): -16.5658 -16.5658 -16.5418 -16.5418 -16.5257 -16.5257 -16.5199 -16.5199 -13.7481 -13.7481 -13.5903 -13.5903 -13.5727 -13.5727 -13.5591 -13.5591 -13.5407 -13.5407 -13.5146 -13.5146 -11.5306 -11.5306 -9.2902 -9.2902 -4.7954 -4.7954 -4.2411 -4.2411 -2.1879 -2.1879 -0.2682 -0.2682 1.9250 1.9250 2.4467 2.4467 4.4492 4.4492 4.8408 4.8408 5.1947 5.1947 5.3331 5.3331 5.7605 5.7605 6.3313 6.3313 6.4244 6.4244 6.7666 6.7666 7.3431 7.3431 7.3835 7.3835 9.1549 9.1549 9.4932 9.4932 11.3488 11.3488 12.2424 12.2424 12.4293 12.4293 13.6373 13.6373 k = 0.0714 0.0714 0.2183 ( 5350 PWs) bands (ev): -16.5655 -16.5655 -16.5424 -16.5424 -16.5252 -16.5252 -16.5202 -16.5202 -13.7476 -13.7476 -13.5907 -13.5907 -13.5723 -13.5723 -13.5590 -13.5590 -13.5413 -13.5413 -13.5128 -13.5128 -11.5488 -11.5488 -9.2795 -9.2795 -4.8116 -4.8116 -4.2518 -4.2518 -2.1734 -2.1734 -0.2278 -0.2278 1.9251 1.9251 2.4297 2.4297 4.4886 4.4886 4.8799 4.8799 5.1814 5.1814 5.3182 5.3182 5.7932 5.7932 6.3409 6.3409 6.4308 6.4308 6.7889 6.7889 7.3707 7.3707 7.4101 7.4101 9.0913 9.0913 9.4036 9.4036 11.3191 11.3191 12.2450 12.2450 12.4659 12.4659 13.6943 13.6943 k = 0.0625 0.0625 0.2183 ( 5346 PWs) bands (ev): -16.5652 -16.5652 -16.5429 -16.5429 -16.5248 -16.5248 -16.5205 -16.5205 -13.7472 -13.7472 -13.5911 -13.5911 -13.5720 -13.5720 -13.5589 -13.5589 -13.5418 -13.5418 -13.5110 -13.5110 -11.5650 -11.5650 -9.2700 -9.2700 -4.8260 -4.8260 -4.2613 -4.2613 -2.1605 -2.1605 -0.1916 -0.1916 1.9241 1.9241 2.4166 2.4166 4.5239 4.5239 4.9126 4.9126 5.1702 5.1702 5.3044 5.3044 5.8223 5.8223 6.3514 6.3514 6.4363 6.4363 6.8116 6.8116 7.3989 7.3989 7.4353 7.4353 9.0287 9.0287 9.3189 9.3189 11.2925 11.2925 12.2471 12.2471 12.5017 12.5017 13.7454 13.7454 k = 0.0536 0.0536 0.2183 ( 5342 PWs) bands (ev): -16.5650 -16.5650 -16.5433 -16.5433 -16.5245 -16.5245 -16.5207 -16.5207 -13.7469 -13.7469 -13.5914 -13.5914 -13.5719 -13.5719 -13.5587 -13.5587 -13.5422 -13.5422 -13.5094 -13.5094 -11.5791 -11.5791 -9.2617 -9.2617 -4.8386 -4.8386 -4.2696 -4.2696 -2.1492 -2.1492 -0.1598 -0.1598 1.9222 1.9222 2.4069 2.4069 4.5548 4.5548 4.9390 4.9390 5.1610 5.1610 5.2923 5.2923 5.8475 5.8475 6.3626 6.3626 6.4413 6.4413 6.8341 6.8341 7.4266 7.4266 7.4585 7.4585 8.9694 8.9694 9.2405 9.2405 11.2694 11.2694 12.2490 12.2490 12.5352 12.5352 13.7597 13.7597 k = 0.0446 0.0446 0.2183 ( 5336 PWs) bands (ev): -16.5647 -16.5647 -16.5437 -16.5437 -16.5242 -16.5242 -16.5209 -16.5209 -13.7466 -13.7466 -13.5917 -13.5917 -13.5718 -13.5718 -13.5584 -13.5584 -13.5427 -13.5427 -13.5079 -13.5079 -11.5911 -11.5911 -9.2546 -9.2546 -4.8492 -4.8492 -4.2767 -4.2767 -2.1396 -2.1396 -0.1326 -0.1326 1.9198 1.9198 2.4001 2.4001 4.5809 4.5809 4.9598 4.9598 5.1534 5.1534 5.2822 5.2822 5.8686 5.8686 6.3738 6.3738 6.4456 6.4456 6.8555 6.8555 7.4522 7.4522 7.4801 7.4801 8.9152 8.9152 9.1694 9.1694 11.2498 11.2498 12.2507 12.2507 12.5655 12.5655 13.7096 13.7096 k = 0.0357 0.0357 0.2183 ( 5340 PWs) bands (ev): -16.5645 -16.5645 -16.5440 -16.5440 -16.5240 -16.5240 -16.5210 -16.5210 -13.7463 -13.7463 -13.5920 -13.5920 -13.5718 -13.5718 -13.5582 -13.5582 -13.5430 -13.5430 -13.5067 -13.5067 -11.6010 -11.6010 -9.2487 -9.2487 -4.8580 -4.8580 -4.2825 -4.2825 -2.1318 -2.1318 -0.1102 -0.1102 1.9171 1.9171 2.3956 2.3956 4.6020 4.6020 4.9760 4.9760 5.1469 5.1469 5.2745 5.2745 5.8856 5.8856 6.3845 6.3845 6.4491 6.4491 6.8752 6.8752 7.4734 7.4734 7.5008 7.5008 8.8680 8.8680 9.1073 9.1073 11.2338 11.2338 12.2523 12.2523 12.5916 12.5916 13.6678 13.6678 k = 0.0268 0.0268 0.2183 ( 5348 PWs) bands (ev): -16.5644 -16.5644 -16.5443 -16.5443 -16.5238 -16.5238 -16.5211 -16.5211 -13.7461 -13.7461 -13.5922 -13.5922 -13.5718 -13.5718 -13.5580 -13.5580 -13.5433 -13.5433 -13.5057 -13.5057 -11.6087 -11.6087 -9.2442 -9.2442 -4.8648 -4.8648 -4.2871 -4.2871 -2.1256 -2.1256 -0.0926 -0.0926 1.9146 1.9146 2.3927 2.3927 4.6182 4.6182 4.9884 4.9884 5.1410 5.1410 5.2691 5.2691 5.8986 5.8986 6.3940 6.3940 6.4518 6.4518 6.8920 6.8920 7.4890 7.4890 7.5200 7.5200 8.8296 8.8296 9.0560 9.0560 11.2213 11.2213 12.2536 12.2536 12.6128 12.6128 13.6351 13.6351 k = 0.0179 0.0179 0.2183 ( 5352 PWs) bands (ev): -16.5643 -16.5643 -16.5445 -16.5445 -16.5237 -16.5237 -16.5212 -16.5212 -13.7460 -13.7460 -13.5923 -13.5923 -13.5718 -13.5718 -13.5578 -13.5578 -13.5436 -13.5436 -13.5050 -13.5050 -11.6142 -11.6142 -9.2409 -9.2409 -4.8696 -4.8696 -4.2903 -4.2903 -2.1212 -2.1212 -0.0799 -0.0799 1.9126 1.9126 2.3910 2.3910 4.6295 4.6295 4.9976 4.9976 5.1359 5.1359 5.2657 5.2657 5.9078 5.9078 6.4016 6.4016 6.4534 6.4534 6.9049 6.9049 7.4994 7.4994 7.5359 7.5359 8.8013 8.8013 9.0174 9.0174 11.2125 11.2125 12.2546 12.2546 12.6285 12.6285 13.6116 13.6116 k = 0.0089 0.0089 0.2183 ( 5362 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5045 -13.5045 -11.6175 -11.6175 -9.2389 -9.2389 -4.8726 -4.8726 -4.2923 -4.2923 -2.1186 -2.1186 -0.0723 -0.0723 1.9113 1.9113 2.3902 2.3902 4.6361 4.6361 5.0034 5.0034 5.1323 5.1323 5.2640 5.2640 5.9132 5.9132 6.4067 6.4067 6.4542 6.4542 6.9132 6.9132 7.5054 7.5054 7.5463 7.5463 8.7841 8.7841 8.9934 8.9934 11.2072 11.2072 12.2553 12.2553 12.6381 12.6381 13.5974 13.5974 k = 0.0000 0.0000 0.2183 ( 5366 PWs) bands (ev): -16.5642 -16.5642 -16.5446 -16.5446 -16.5237 -16.5237 -16.5213 -16.5213 -13.7459 -13.7459 -13.5924 -13.5924 -13.5718 -13.5718 -13.5577 -13.5577 -13.5437 -13.5437 -13.5044 -13.5044 -11.6186 -11.6186 -9.2383 -9.2383 -4.8736 -4.8736 -4.2929 -4.2929 -2.1177 -2.1177 -0.0698 -0.0698 1.9109 1.9109 2.3899 2.3899 4.6383 4.6383 5.0054 5.0054 5.1310 5.1310 5.2634 5.2634 5.9150 5.9150 6.4084 6.4084 6.4545 6.4545 6.9160 6.9160 7.5073 7.5073 7.5499 7.5499 8.7783 8.7783 8.9852 8.9852 11.2055 11.2055 12.2555 12.2555 12.6414 12.6414 13.5927 13.5927 k = 0.0000 0.5000-0.0000 ( 5336 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8785 -3.8785 -3.8785 -3.8785 -2.2942 -2.2942 -2.2942 -2.2942 2.7925 2.7925 2.7925 2.7925 3.4943 3.4943 3.4943 3.4943 4.1869 4.1869 4.1869 4.1869 5.9233 5.9233 5.9233 5.9233 6.8802 6.8802 6.8802 6.8802 7.5348 7.5348 7.5348 7.5348 10.4390 10.4390 10.4390 10.4390 12.0371 12.0371 12.0371 12.0371 12.4902 12.4902 12.4902 12.4902 k = 0.0000 0.5000 0.0121 ( 5334 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8785 -3.8785 -3.8785 -3.8785 -2.2942 -2.2942 -2.2942 -2.2942 2.7932 2.7932 2.7932 2.7932 3.4943 3.4943 3.4943 3.4943 4.1851 4.1851 4.1851 4.1851 5.9246 5.9246 5.9246 5.9246 6.8802 6.8802 6.8802 6.8802 7.5349 7.5349 7.5349 7.5349 10.4387 10.4387 10.4387 10.4387 12.0365 12.0365 12.0365 12.0365 12.4906 12.4906 12.4906 12.4906 k = 0.0000 0.5000 0.0243 ( 5328 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8786 -3.8786 -3.8786 -3.8786 -2.2941 -2.2941 -2.2941 -2.2941 2.7953 2.7953 2.7953 2.7953 3.4943 3.4943 3.4943 3.4943 4.1797 4.1797 4.1797 4.1797 5.9283 5.9283 5.9283 5.9283 6.8802 6.8802 6.8802 6.8802 7.5351 7.5351 7.5351 7.5351 10.4378 10.4378 10.4378 10.4378 12.0345 12.0345 12.0345 12.0345 12.4918 12.4918 12.4918 12.4918 k = 0.0000 0.5000 0.0364 ( 5326 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8787 -3.8787 -3.8787 -3.8787 -2.2940 -2.2940 -2.2940 -2.2940 2.7987 2.7987 2.7987 2.7987 3.4944 3.4944 3.4944 3.4944 4.1709 4.1709 4.1709 4.1709 5.9345 5.9345 5.9345 5.9345 6.8803 6.8803 6.8803 6.8803 7.5356 7.5356 7.5356 7.5356 10.4364 10.4364 10.4364 10.4364 12.0315 12.0315 12.0315 12.0315 12.4937 12.4937 12.4937 12.4937 k = 0.0000 0.5000 0.0485 ( 5330 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8789 -3.8789 -3.8789 -3.8789 -2.2938 -2.2938 -2.2938 -2.2938 2.8035 2.8035 2.8035 2.8035 3.4946 3.4946 3.4946 3.4946 4.1590 4.1590 4.1590 4.1590 5.9427 5.9427 5.9427 5.9427 6.8804 6.8804 6.8804 6.8804 7.5362 7.5362 7.5362 7.5362 10.4344 10.4344 10.4344 10.4344 12.0274 12.0274 12.0274 12.0274 12.4960 12.4960 12.4960 12.4960 k = 0.0000 0.5000 0.0606 ( 5330 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8791 -3.8791 -3.8791 -3.8791 -2.2935 -2.2935 -2.2935 -2.2935 2.8094 2.8094 2.8094 2.8094 3.4947 3.4947 3.4947 3.4947 4.1443 4.1443 4.1443 4.1443 5.9527 5.9527 5.9527 5.9527 6.8804 6.8804 6.8804 6.8804 7.5369 7.5369 7.5369 7.5369 10.4320 10.4320 10.4320 10.4320 12.0225 12.0225 12.0225 12.0225 12.4988 12.4988 12.4988 12.4988 k = 0.0000 0.5000 0.0728 ( 5330 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8793 -3.8793 -3.8793 -3.8793 -2.2932 -2.2932 -2.2932 -2.2932 2.8164 2.8164 2.8164 2.8164 3.4949 3.4949 3.4949 3.4949 4.1273 4.1273 4.1273 4.1273 5.9641 5.9641 5.9641 5.9641 6.8805 6.8805 6.8805 6.8805 7.5378 7.5378 7.5378 7.5378 10.4292 10.4292 10.4292 10.4292 12.0170 12.0170 12.0170 12.0170 12.5016 12.5016 12.5016 12.5016 k = 0.0000 0.5000 0.0849 ( 5322 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8795 -3.8795 -3.8795 -3.8795 -2.2929 -2.2929 -2.2929 -2.2929 2.8243 2.8243 2.8243 2.8243 3.4952 3.4952 3.4952 3.4952 4.1086 4.1086 4.1086 4.1086 5.9766 5.9766 5.9766 5.9766 6.8806 6.8806 6.8806 6.8806 7.5387 7.5387 7.5387 7.5387 10.4261 10.4261 10.4261 10.4261 12.0111 12.0111 12.0111 12.0111 12.5044 12.5044 12.5044 12.5044 k = 0.0000 0.5000 0.0970 ( 5332 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8798 -3.8798 -3.8798 -3.8798 -2.2926 -2.2926 -2.2926 -2.2926 2.8328 2.8328 2.8328 2.8328 3.4955 3.4955 3.4955 3.4955 4.0886 4.0886 4.0886 4.0886 5.9897 5.9897 5.9897 5.9897 6.8808 6.8808 6.8808 6.8808 7.5398 7.5398 7.5398 7.5398 10.4227 10.4227 10.4227 10.4227 12.0050 12.0050 12.0050 12.0050 12.5070 12.5070 12.5070 12.5070 k = 0.0000 0.5000 0.1091 ( 5324 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8800 -3.8800 -3.8800 -3.8800 -2.2923 -2.2923 -2.2923 -2.2923 2.8419 2.8419 2.8419 2.8419 3.4958 3.4958 3.4958 3.4958 4.0679 4.0679 4.0679 4.0679 6.0030 6.0030 6.0030 6.0030 6.8809 6.8809 6.8809 6.8809 7.5409 7.5409 7.5409 7.5409 10.4192 10.4192 10.4192 10.4192 11.9990 11.9990 11.9990 11.9990 12.5093 12.5093 12.5093 12.5093 k = 0.0000 0.5000 0.1213 ( 5330 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8803 -3.8803 -3.8803 -3.8803 -2.2919 -2.2919 -2.2919 -2.2919 2.8512 2.8512 2.8512 2.8512 3.4961 3.4961 3.4961 3.4961 4.0472 4.0472 4.0472 4.0472 6.0161 6.0161 6.0161 6.0161 6.8810 6.8810 6.8810 6.8810 7.5420 7.5420 7.5420 7.5420 10.4157 10.4157 10.4157 10.4157 11.9932 11.9932 11.9932 11.9932 12.5112 12.5112 12.5112 12.5112 k = 0.0000 0.5000 0.1334 ( 5326 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8805 -3.8805 -3.8805 -3.8805 -2.2916 -2.2916 -2.2916 -2.2916 2.8604 2.8604 2.8604 2.8604 3.4964 3.4964 3.4965 3.4965 4.0271 4.0271 4.0271 4.0271 6.0286 6.0286 6.0286 6.0286 6.8812 6.8812 6.8812 6.8812 7.5431 7.5431 7.5431 7.5431 10.4123 10.4123 10.4123 10.4123 11.9878 11.9878 11.9878 11.9878 12.5128 12.5128 12.5128 12.5128 k = 0.0000 0.5000 0.1455 ( 5332 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8808 -3.8808 -3.8808 -3.8808 -2.2913 -2.2913 -2.2913 -2.2913 2.8693 2.8693 2.8693 2.8693 3.4968 3.4968 3.4968 3.4968 4.0081 4.0081 4.0081 4.0081 6.0401 6.0401 6.0401 6.0401 6.8813 6.8813 6.8813 6.8813 7.5442 7.5442 7.5442 7.5442 10.4091 10.4091 10.4091 10.4091 11.9828 11.9828 11.9828 11.9828 12.5139 12.5139 12.5139 12.5139 k = 0.0000 0.5000 0.1576 ( 5324 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8810 -3.8810 -3.8810 -3.8810 -2.2910 -2.2910 -2.2910 -2.2910 2.8775 2.8775 2.8775 2.8775 3.4972 3.4972 3.4972 3.4972 3.9908 3.9908 3.9908 3.9908 6.0504 6.0504 6.0504 6.0504 6.8814 6.8814 6.8814 6.8814 7.5451 7.5451 7.5451 7.5451 10.4062 10.4062 10.4062 10.4062 11.9784 11.9784 11.9784 11.9784 12.5148 12.5148 12.5148 12.5148 k = 0.0000 0.5000 0.1698 ( 5320 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8812 -3.8812 -3.8812 -3.8812 -2.2908 -2.2908 -2.2908 -2.2908 2.8848 2.8848 2.8848 2.8848 3.4975 3.4975 3.4975 3.4975 3.9758 3.9758 3.9758 3.9758 6.0592 6.0592 6.0592 6.0592 6.8816 6.8816 6.8816 6.8816 7.5460 7.5460 7.5460 7.5460 10.4037 10.4037 10.4037 10.4037 11.9747 11.9747 11.9747 11.9747 12.5153 12.5153 12.5153 12.5153 k = 0.0000 0.5000 0.1819 ( 5308 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8813 -3.8813 -3.8813 -3.8813 -2.2906 -2.2906 -2.2906 -2.2906 2.8908 2.8908 2.8908 2.8908 3.4978 3.4978 3.4978 3.4978 3.9636 3.9636 3.9636 3.9636 6.0663 6.0663 6.0663 6.0663 6.8816 6.8816 6.8816 6.8816 7.5467 7.5467 7.5467 7.5467 10.4016 10.4016 10.4016 10.4016 11.9718 11.9718 11.9718 11.9718 12.5156 12.5156 12.5156 12.5156 k = 0.0000 0.5000 0.1940 ( 5336 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8814 -3.8814 -3.8814 -3.8814 -2.2904 -2.2904 -2.2904 -2.2904 2.8953 2.8953 2.8953 2.8953 3.4980 3.4980 3.4980 3.4980 3.9545 3.9545 3.9545 3.9545 6.0715 6.0715 6.0715 6.0715 6.8817 6.8817 6.8817 6.8817 7.5472 7.5472 7.5472 7.5472 10.4001 10.4001 10.4001 10.4001 11.9697 11.9697 11.9697 11.9697 12.5158 12.5158 12.5158 12.5158 k = 0.0000 0.5000 0.2061 ( 5336 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8815 -3.8815 -3.8815 -3.8815 -2.2903 -2.2903 -2.2903 -2.2903 2.8980 2.8980 2.8980 2.8980 3.4982 3.4982 3.4982 3.4982 3.9489 3.9489 3.9489 3.9489 6.0746 6.0746 6.0746 6.0746 6.8818 6.8818 6.8818 6.8818 7.5475 7.5475 7.5475 7.5475 10.3992 10.3992 10.3992 10.3992 11.9684 11.9684 11.9684 11.9684 12.5159 12.5159 12.5159 12.5159 k = 0.0000 0.5000 0.2183 ( 5340 PWs) bands (ev): -16.5503 -16.5503 -16.5503 -16.5503 -16.5256 -16.5256 -16.5256 -16.5256 -13.6965 -13.6965 -13.6965 -13.6965 -13.5737 -13.5737 -13.5737 -13.5737 -13.5180 -13.5180 -13.5180 -13.5180 -10.3082 -10.3082 -10.3082 -10.3082 -3.8815 -3.8815 -3.8815 -3.8815 -2.2903 -2.2903 -2.2903 -2.2903 2.8990 2.8990 2.8990 2.8990 3.4982 3.4982 3.4982 3.4982 3.9470 3.9470 3.9470 3.9470 6.0757 6.0757 6.0757 6.0757 6.8818 6.8818 6.8818 6.8818 7.5476 7.5476 7.5476 7.5476 10.3989 10.3989 10.3989 10.3989 11.9679 11.9679 11.9679 11.9679 12.5159 12.5159 12.5159 12.5159 k = 0.5000 0.5000-0.0000 ( 5296 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5422 -3.5422 -3.5422 -3.5422 -3.0136 -3.0136 -3.0136 -3.0136 2.5156 2.5156 2.5156 2.5156 3.7622 3.7622 3.7622 3.7622 4.3272 4.3272 4.3272 4.3272 5.7826 5.7826 5.7826 5.7826 5.8091 5.8091 5.8091 5.8091 6.6658 6.6658 6.6658 6.6658 9.5544 9.5544 9.5544 9.5544 11.5411 11.5411 11.5411 11.5411 12.8925 12.8925 12.8925 12.8925 k = 0.5000 0.5000 0.0121 ( 5320 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5422 -3.5422 -3.5422 -3.5422 -3.0137 -3.0137 -3.0137 -3.0137 2.5153 2.5153 2.5153 2.5153 3.7625 3.7625 3.7625 3.7625 4.3291 4.3291 4.3291 4.3291 5.7822 5.7822 5.7822 5.7822 5.8067 5.8067 5.8067 5.8067 6.6646 6.6646 6.6646 6.6646 9.5578 9.5578 9.5578 9.5578 11.5423 11.5423 11.5423 11.5423 12.8876 12.8876 12.8876 12.8876 k = 0.5000 0.5000 0.0243 ( 5312 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5421 -3.5421 -3.5421 -3.5421 -3.0139 -3.0139 -3.0139 -3.0139 2.5145 2.5145 2.5145 2.5145 3.7635 3.7635 3.7635 3.7635 4.3348 4.3348 4.3348 4.3348 5.7806 5.7806 5.7806 5.7806 5.8004 5.8004 5.8004 5.8004 6.6611 6.6611 6.6611 6.6611 9.5681 9.5681 9.5681 9.5681 11.5459 11.5459 11.5459 11.5459 12.8731 12.8731 12.8731 12.8731 k = 0.5000 0.5000 0.0364 ( 5316 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5418 -3.5418 -3.5418 -3.5418 -3.0142 -3.0142 -3.0142 -3.0142 2.5131 2.5131 2.5131 2.5131 3.7651 3.7651 3.7651 3.7651 4.3442 4.3442 4.3442 4.3442 5.7750 5.7750 5.7750 5.7750 5.7929 5.7929 5.7929 5.7929 6.6553 6.6553 6.6553 6.6553 9.5849 9.5849 9.5849 9.5849 11.5518 11.5518 11.5518 11.5518 12.8494 12.8494 12.8494 12.8494 k = 0.5000 0.5000 0.0485 ( 5328 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5415 -3.5415 -3.5415 -3.5415 -3.0147 -3.0147 -3.0147 -3.0147 2.5112 2.5112 2.5112 2.5112 3.7673 3.7673 3.7673 3.7673 4.3572 4.3572 4.3572 4.3572 5.7611 5.7611 5.7611 5.7611 5.7890 5.7890 5.7890 5.7890 6.6475 6.6475 6.6475 6.6475 9.6079 9.6079 9.6079 9.6079 11.5598 11.5598 11.5598 11.5598 12.8172 12.8172 12.8172 12.8172 k = 0.5000 0.5000 0.0606 ( 5320 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5411 -3.5411 -3.5411 -3.5411 -3.0152 -3.0152 -3.0152 -3.0152 2.5090 2.5090 2.5090 2.5090 3.7701 3.7701 3.7701 3.7701 4.3734 4.3734 4.3734 4.3734 5.7402 5.7402 5.7402 5.7402 5.7875 5.7875 5.7875 5.7875 6.6379 6.6379 6.6379 6.6379 9.6365 9.6365 9.6365 9.6365 11.5698 11.5698 11.5698 11.5698 12.7775 12.7775 12.7775 12.7775 k = 0.5000 0.5000 0.0728 ( 5320 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5407 -3.5407 -3.5407 -3.5407 -3.0159 -3.0159 -3.0159 -3.0159 2.5063 2.5063 2.5063 2.5063 3.7733 3.7733 3.7733 3.7733 4.3928 4.3928 4.3928 4.3928 5.7146 5.7146 5.7146 5.7146 5.7869 5.7869 5.7869 5.7869 6.6269 6.6269 6.6269 6.6269 9.6700 9.6700 9.6700 9.6700 11.5815 11.5815 11.5815 11.5815 12.7311 12.7311 12.7311 12.7311 k = 0.5000 0.5000 0.0849 ( 5316 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5402 -3.5402 -3.5402 -3.5402 -3.0166 -3.0166 -3.0166 -3.0166 2.5035 2.5035 2.5035 2.5035 3.7770 3.7770 3.7770 3.7770 4.4149 4.4149 4.4149 4.4149 5.6852 5.6852 5.6852 5.6852 5.7866 5.7866 5.7866 5.7866 6.6147 6.6147 6.6147 6.6147 9.7075 9.7075 9.7075 9.7075 11.5946 11.5946 11.5946 11.5946 12.6794 12.6794 12.6794 12.6794 k = 0.5000 0.5000 0.0970 ( 5316 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5397 -3.5397 -3.5397 -3.5397 -3.0173 -3.0173 -3.0173 -3.0173 2.5004 2.5004 2.5004 2.5004 3.7809 3.7809 3.7809 3.7809 4.4393 4.4393 4.4393 4.4393 5.6530 5.6530 5.6530 5.6530 5.7864 5.7864 5.7864 5.7864 6.6018 6.6018 6.6018 6.6018 9.7482 9.7482 9.7482 9.7482 11.6090 11.6090 11.6090 11.6090 12.6237 12.6237 12.6237 12.6237 k = 0.5000 0.5000 0.1091 ( 5328 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5391 -3.5391 -3.5391 -3.5391 -3.0181 -3.0181 -3.0181 -3.0181 2.4973 2.4973 2.4973 2.4973 3.7851 3.7851 3.7851 3.7851 4.4656 4.4656 4.4656 4.4656 5.6187 5.6187 5.6187 5.6187 5.7863 5.7863 5.7863 5.7863 6.5886 6.5886 6.5886 6.5886 9.7909 9.7909 9.7909 9.7909 11.6242 11.6242 11.6242 11.6242 12.5654 12.5654 12.5654 12.5654 k = 0.5000 0.5000 0.1213 ( 5320 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5386 -3.5386 -3.5386 -3.5386 -3.0189 -3.0189 -3.0189 -3.0189 2.4942 2.4942 2.4942 2.4942 3.7893 3.7893 3.7893 3.7893 4.4933 4.4933 4.4933 4.4933 5.5831 5.5831 5.5831 5.5831 5.7862 5.7862 5.7862 5.7862 6.5754 6.5754 6.5754 6.5754 9.8345 9.8345 9.8345 9.8345 11.6399 11.6399 11.6399 11.6399 12.5058 12.5058 12.5058 12.5058 k = 0.5000 0.5000 0.1334 ( 5328 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5381 -3.5381 -3.5381 -3.5381 -3.0197 -3.0197 -3.0197 -3.0197 2.4912 2.4912 2.4912 2.4912 3.7934 3.7934 3.7934 3.7934 4.5216 4.5216 4.5216 4.5216 5.5472 5.5472 5.5472 5.5472 5.7862 5.7862 5.7862 5.7862 6.5626 6.5626 6.5626 6.5626 9.8777 9.8777 9.8777 9.8777 11.6560 11.6560 11.6560 11.6560 12.4466 12.4466 12.4466 12.4466 k = 0.5000 0.5000 0.1455 ( 5344 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5376 -3.5376 -3.5376 -3.5376 -3.0204 -3.0204 -3.0204 -3.0204 2.4885 2.4885 2.4885 2.4885 3.7973 3.7973 3.7973 3.7973 4.5497 4.5497 4.5497 4.5497 5.5119 5.5119 5.5119 5.5119 5.7861 5.7861 5.7861 5.7861 6.5507 6.5507 6.5507 6.5507 9.9193 9.9193 9.9193 9.9193 11.6721 11.6721 11.6721 11.6721 12.3893 12.3893 12.3893 12.3893 k = 0.5000 0.5000 0.1576 ( 5344 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5371 -3.5371 -3.5371 -3.5371 -3.0211 -3.0211 -3.0211 -3.0211 2.4860 2.4860 2.4860 2.4860 3.8009 3.8009 3.8009 3.8009 4.5768 4.5768 4.5768 4.5768 5.4785 5.4785 5.4785 5.4785 5.7861 5.7861 5.7861 5.7861 6.5400 6.5400 6.5400 6.5400 9.9577 9.9577 9.9577 9.9577 11.6878 11.6878 11.6878 11.6878 12.3356 12.3356 12.3356 12.3356 k = 0.5000 0.5000 0.1698 ( 5336 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5367 -3.5367 -3.5367 -3.5367 -3.0216 -3.0216 -3.0216 -3.0216 2.4838 2.4838 2.4838 2.4838 3.8041 3.8041 3.8041 3.8041 4.6016 4.6016 4.6016 4.6016 5.4482 5.4482 5.4482 5.4482 5.7861 5.7861 5.7861 5.7861 6.5308 6.5308 6.5308 6.5308 9.9917 9.9917 9.9917 9.9917 11.7025 11.7025 11.7025 11.7025 12.2874 12.2874 12.2874 12.2874 k = 0.5000 0.5000 0.1819 ( 5352 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5364 -3.5364 -3.5364 -3.5364 -3.0221 -3.0221 -3.0221 -3.0221 2.4821 2.4821 2.4821 2.4821 3.8066 3.8066 3.8066 3.8066 4.6230 4.6230 4.6230 4.6230 5.4224 5.4224 5.4224 5.4224 5.7860 5.7860 5.7860 5.7860 6.5233 6.5233 6.5233 6.5233 10.0198 10.0198 10.0198 10.0198 11.7156 11.7156 11.7156 11.7156 12.2466 12.2466 12.2466 12.2466 k = 0.5000 0.5000 0.1940 ( 5352 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5362 -3.5362 -3.5362 -3.5362 -3.0224 -3.0224 -3.0224 -3.0224 2.4809 2.4809 2.4809 2.4809 3.8085 3.8085 3.8085 3.8085 4.6396 4.6396 4.6396 4.6396 5.4026 5.4026 5.4026 5.4026 5.7860 5.7860 5.7860 5.7860 6.5178 6.5178 6.5178 6.5178 10.0409 10.0409 10.0409 10.0409 11.7262 11.7262 11.7262 11.7262 12.2153 12.2153 12.2153 12.2153 k = 0.5000 0.5000 0.2061 ( 5336 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5360 -3.5360 -3.5360 -3.5360 -3.0226 -3.0226 -3.0226 -3.0226 2.4801 2.4801 2.4801 2.4801 3.8097 3.8097 3.8097 3.8097 4.6502 4.6502 4.6502 4.6502 5.3901 5.3901 5.3901 5.3901 5.7860 5.7860 5.7860 5.7860 6.5144 6.5144 6.5144 6.5144 10.0540 10.0540 10.0540 10.0540 11.7332 11.7332 11.7332 11.7332 12.1955 12.1955 12.1955 12.1955 k = 0.5000 0.5000 0.2183 ( 5336 PWs) bands (ev): -16.5697 -16.5697 -16.5697 -16.5697 -16.5033 -16.5033 -16.5033 -16.5033 -13.7369 -13.7369 -13.7369 -13.7369 -13.5371 -13.5371 -13.5371 -13.5371 -13.5065 -13.5065 -13.5065 -13.5065 -10.0141 -10.0141 -10.0141 -10.0141 -3.5360 -3.5360 -3.5360 -3.5360 -3.0227 -3.0227 -3.0227 -3.0227 2.4798 2.4798 2.4798 2.4798 3.8101 3.8101 3.8101 3.8101 4.6538 4.6538 4.6538 4.6538 5.3858 5.3858 5.3858 5.3858 5.7860 5.7860 5.7860 5.7860 6.5133 6.5133 6.5133 6.5133 10.0584 10.0584 10.0584 10.0584 11.7357 11.7357 11.7357 11.7357 12.1887 12.1887 12.1887 12.1887 Writing output data file BiIO.save init_run : 1.19s CPU 0.75s WALL ( 1 calls) electrons : 462.78s CPU 360.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.02s CPU 0.01s WALL ( 1 calls) potinit : 0.18s CPU 0.12s WALL ( 1 calls) Called by electrons: c_bands : 462.77s CPU 360.90s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.32s CPU 0.18s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.29s CPU 0.37s WALL ( 335 calls) cegterg : 396.23s CPU 320.23s WALL ( 380 calls) Called by sum_band: Called by *egterg: h_psi : 281.63s CPU 196.65s WALL ( 5848 calls) s_psi : 8.95s CPU 6.71s WALL ( 5848 calls) g_psi : 0.20s CPU 0.19s WALL ( 5133 calls) cdiaghg : 128.79s CPU 118.25s WALL ( 5468 calls) cegterg:over : 14.98s CPU 13.24s WALL ( 5133 calls) cegterg:upda : 7.80s CPU 6.67s WALL ( 5133 calls) cegterg:last : 3.96s CPU 4.14s WALL ( 1050 calls) cdiaghg:chol : 4.82s CPU 4.47s WALL ( 5468 calls) cdiaghg:inve : 3.48s CPU 3.23s WALL ( 5468 calls) cdiaghg:para : 7.70s CPU 7.34s WALL ( 10936 calls) Called by h_psi: h_psi:vloc : 258.73s CPU 179.71s WALL ( 5848 calls) h_psi:vnl : 22.61s CPU 16.74s WALL ( 5848 calls) add_vuspsi : 12.92s CPU 9.14s WALL ( 5848 calls) General routines calbec : 9.67s CPU 7.58s WALL ( 5848 calls) fft : 0.08s CPU 0.07s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 251.05s CPU 174.13s WALL ( 903380 calls) interpolate : 0.03s CPU 0.02s WALL ( 4 calls) davcio : 0.41s CPU 0.81s WALL ( 670 calls) Parallel routines fft_scatter : 169.81s CPU 126.94s WALL ( 903403 calls) PWSCF : 8m37.07s CPU 7m39.48s WALL This run was terminated on: 21:23: 3 20Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=