Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:39:48 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CaNiGeH.save/ file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 34 23 6 1782 980 154 Max 35 24 7 1791 994 165 Sum 1245 845 241 64273 35523 5755 bravais-lattice index = 14 lattice parameter (alat) = 7.5661 a.u. unit-cell volume = 840.0035 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 50.00 number of Kohn-Sham states= 60 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 274.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.566066 celldm(2)= 1.000000 celldm(3)= 1.939415 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.939415 ) 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 0.515619 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 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 Ca read from file: /users/gautes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1169 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 Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Ca 10.00 40.07800 Ca( 1.00) Ni 10.00 58.69340 Ni( 1.00) H 1.00 1.00790 H( 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= 344 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0029070 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0029070 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0029070 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0029070 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0029070 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0029070 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0029070 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0029070 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0029070 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0029070 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0029070 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0029070 k( 14) = ( 0.0000000 0.1625000 -0.0000000), wk = 0.0029070 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0029070 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0029070 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0029070 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0029070 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0029070 k( 20) = ( 0.0000000 0.2375000 -0.0000000), wk = 0.0029070 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0029070 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0029070 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0029070 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0029070 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0029070 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0029070 k( 27) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0029070 k( 28) = ( 0.0000000 0.3375000 -0.0000000), wk = 0.0029070 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0029070 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0029070 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0029070 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0029070 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0029070 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0029070 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0029070 k( 36) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0029070 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0029070 k( 38) = ( 0.0000000 0.4625000 -0.0000000), wk = 0.0029070 k( 39) = ( 0.0000000 0.4750000 -0.0000000), wk = 0.0029070 k( 40) = ( 0.0000000 0.4875000 -0.0000000), wk = 0.0029070 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0029070 k( 44) = ( 0.0250000 0.5000000 -0.0000000), wk = 0.0029070 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0029070 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0029070 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0029070 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0029070 k( 49) = ( 0.0875000 0.5000000 -0.0000000), wk = 0.0029070 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0029070 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0029070 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0029070 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0029070 k( 54) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0029070 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0029070 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0029070 k( 57) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0029070 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0029070 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0029070 k( 60) = ( 0.2250000 0.5000000 -0.0000000), wk = 0.0029070 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0029070 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0029070 k( 63) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0029070 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0029070 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0029070 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0029070 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0029070 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0029070 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0029070 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0029070 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0029070 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0029070 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0029070 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0029070 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0029070 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0029070 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0029070 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0029070 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0029070 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0029070 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0029070 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 84) = ( 0.4910714 0.4910714 -0.0000000), wk = 0.0029070 k( 85) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0029070 k( 86) = ( 0.4732143 0.4732143 -0.0000000), wk = 0.0029070 k( 87) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0029070 k( 88) = ( 0.4553571 0.4553571 -0.0000000), wk = 0.0029070 k( 89) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0029070 k( 90) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0029070 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0029070 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0029070 k( 93) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0029070 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0029070 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0029070 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0029070 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0029070 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0029070 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0029070 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0029070 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0029070 k( 102) = ( 0.3303571 0.3303571 -0.0000000), wk = 0.0029070 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0029070 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0029070 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0029070 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0029070 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0029070 k( 108) = ( 0.2767857 0.2767857 -0.0000000), wk = 0.0029070 k( 109) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0029070 k( 110) = ( 0.2589286 0.2589286 -0.0000000), wk = 0.0029070 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0029070 k( 112) = ( 0.2410714 0.2410714 -0.0000000), wk = 0.0029070 k( 113) = ( 0.2321429 0.2321429 -0.0000000), wk = 0.0029070 k( 114) = ( 0.2232143 0.2232143 -0.0000000), wk = 0.0029070 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0029070 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0029070 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0029070 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0029070 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0029070 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0029070 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0029070 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0029070 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0029070 k( 124) = ( 0.1339286 0.1339286 -0.0000000), wk = 0.0029070 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0029070 k( 126) = ( 0.1160714 0.1160714 -0.0000000), wk = 0.0029070 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0029070 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0029070 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0029070 k( 130) = ( 0.0803571 0.0803571 -0.0000000), wk = 0.0029070 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0029070 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0029070 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0029070 k( 134) = ( 0.0446429 0.0446429 -0.0000000), wk = 0.0029070 k( 135) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0029070 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0029070 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0029070 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0029070 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 141) = ( 0.0000000 0.0000000 0.0122767), wk = 0.0029070 k( 142) = ( 0.0000000 0.0000000 0.0245533), wk = 0.0029070 k( 143) = ( 0.0000000 0.0000000 0.0368300), wk = 0.0029070 k( 144) = ( 0.0000000 0.0000000 0.0491066), wk = 0.0029070 k( 145) = ( 0.0000000 0.0000000 0.0613833), wk = 0.0029070 k( 146) = ( 0.0000000 0.0000000 0.0736599), wk = 0.0029070 k( 147) = ( 0.0000000 0.0000000 0.0859366), wk = 0.0029070 k( 148) = ( 0.0000000 0.0000000 0.0982132), wk = 0.0029070 k( 149) = ( 0.0000000 0.0000000 0.1104899), wk = 0.0029070 k( 150) = ( 0.0000000 0.0000000 0.1227665), wk = 0.0029070 k( 151) = ( 0.0000000 0.0000000 0.1350432), wk = 0.0029070 k( 152) = ( 0.0000000 0.0000000 0.1473198), wk = 0.0029070 k( 153) = ( 0.0000000 0.0000000 0.1595965), wk = 0.0029070 k( 154) = ( 0.0000000 0.0000000 0.1718731), wk = 0.0029070 k( 155) = ( 0.0000000 0.0000000 0.1841498), wk = 0.0029070 k( 156) = ( 0.0000000 0.0000000 0.1964264), wk = 0.0029070 k( 157) = ( 0.0000000 0.0000000 0.2087031), wk = 0.0029070 k( 158) = ( 0.0000000 0.0000000 0.2209798), wk = 0.0029070 k( 159) = ( 0.0000000 0.0000000 0.2332564), wk = 0.0029070 k( 160) = ( 0.0000000 0.0000000 0.2455331), wk = 0.0029070 k( 161) = ( 0.0000000 0.0000000 0.2578097), wk = 0.0029070 k( 162) = ( 0.0000000 0.0000000 0.2578097), wk = 0.0029070 k( 163) = ( 0.0000000 0.0125000 0.2578097), wk = 0.0029070 k( 164) = ( 0.0000000 0.0250000 0.2578097), wk = 0.0029070 k( 165) = ( 0.0000000 0.0375000 0.2578097), wk = 0.0029070 k( 166) = ( 0.0000000 0.0500000 0.2578097), wk = 0.0029070 k( 167) = ( 0.0000000 0.0625000 0.2578097), wk = 0.0029070 k( 168) = ( 0.0000000 0.0750000 0.2578097), wk = 0.0029070 k( 169) = ( 0.0000000 0.0875000 0.2578097), wk = 0.0029070 k( 170) = ( 0.0000000 0.1000000 0.2578097), wk = 0.0029070 k( 171) = ( 0.0000000 0.1125000 0.2578097), wk = 0.0029070 k( 172) = ( 0.0000000 0.1250000 0.2578097), wk = 0.0029070 k( 173) = ( 0.0000000 0.1375000 0.2578097), wk = 0.0029070 k( 174) = ( 0.0000000 0.1500000 0.2578097), wk = 0.0029070 k( 175) = ( 0.0000000 0.1625000 0.2578097), wk = 0.0029070 k( 176) = ( 0.0000000 0.1750000 0.2578097), wk = 0.0029070 k( 177) = ( 0.0000000 0.1875000 0.2578097), wk = 0.0029070 k( 178) = ( 0.0000000 0.2000000 0.2578097), wk = 0.0029070 k( 179) = ( 0.0000000 0.2125000 0.2578097), wk = 0.0029070 k( 180) = ( 0.0000000 0.2250000 0.2578097), wk = 0.0029070 k( 181) = ( 0.0000000 0.2375000 0.2578097), wk = 0.0029070 k( 182) = ( 0.0000000 0.2500000 0.2578097), wk = 0.0029070 k( 183) = ( 0.0000000 0.2625000 0.2578097), wk = 0.0029070 k( 184) = ( 0.0000000 0.2750000 0.2578097), wk = 0.0029070 k( 185) = ( 0.0000000 0.2875000 0.2578097), wk = 0.0029070 k( 186) = ( 0.0000000 0.3000000 0.2578097), wk = 0.0029070 k( 187) = ( 0.0000000 0.3125000 0.2578097), wk = 0.0029070 k( 188) = ( 0.0000000 0.3250000 0.2578097), wk = 0.0029070 k( 189) = ( 0.0000000 0.3375000 0.2578097), wk = 0.0029070 k( 190) = ( 0.0000000 0.3500000 0.2578097), wk = 0.0029070 k( 191) = ( 0.0000000 0.3625000 0.2578097), wk = 0.0029070 k( 192) = ( 0.0000000 0.3750000 0.2578097), wk = 0.0029070 k( 193) = ( 0.0000000 0.3875000 0.2578097), wk = 0.0029070 k( 194) = ( 0.0000000 0.4000000 0.2578097), wk = 0.0029070 k( 195) = ( 0.0000000 0.4125000 0.2578097), wk = 0.0029070 k( 196) = ( 0.0000000 0.4250000 0.2578097), wk = 0.0029070 k( 197) = ( 0.0000000 0.4375000 0.2578097), wk = 0.0029070 k( 198) = ( 0.0000000 0.4500000 0.2578097), wk = 0.0029070 k( 199) = ( 0.0000000 0.4625000 0.2578097), wk = 0.0029070 k( 200) = ( 0.0000000 0.4750000 0.2578097), wk = 0.0029070 k( 201) = ( 0.0000000 0.4875000 0.2578097), wk = 0.0029070 k( 202) = ( 0.0000000 0.5000000 0.2578097), wk = 0.0029070 k( 203) = ( 0.0000000 0.5000000 0.2578097), wk = 0.0029070 k( 204) = ( 0.0125000 0.5000000 0.2578097), wk = 0.0029070 k( 205) = ( 0.0250000 0.5000000 0.2578097), wk = 0.0029070 k( 206) = ( 0.0375000 0.5000000 0.2578097), wk = 0.0029070 k( 207) = ( 0.0500000 0.5000000 0.2578097), wk = 0.0029070 k( 208) = ( 0.0625000 0.5000000 0.2578097), wk = 0.0029070 k( 209) = ( 0.0750000 0.5000000 0.2578097), wk = 0.0029070 k( 210) = ( 0.0875000 0.5000000 0.2578097), wk = 0.0029070 k( 211) = ( 0.1000000 0.5000000 0.2578097), wk = 0.0029070 k( 212) = ( 0.1125000 0.5000000 0.2578097), wk = 0.0029070 k( 213) = ( 0.1250000 0.5000000 0.2578097), wk = 0.0029070 k( 214) = ( 0.1375000 0.5000000 0.2578097), wk = 0.0029070 k( 215) = ( 0.1500000 0.5000000 0.2578097), wk = 0.0029070 k( 216) = ( 0.1625000 0.5000000 0.2578097), wk = 0.0029070 k( 217) = ( 0.1750000 0.5000000 0.2578097), wk = 0.0029070 k( 218) = ( 0.1875000 0.5000000 0.2578097), wk = 0.0029070 k( 219) = ( 0.2000000 0.5000000 0.2578097), wk = 0.0029070 k( 220) = ( 0.2125000 0.5000000 0.2578097), wk = 0.0029070 k( 221) = ( 0.2250000 0.5000000 0.2578097), wk = 0.0029070 k( 222) = ( 0.2375000 0.5000000 0.2578097), wk = 0.0029070 k( 223) = ( 0.2500000 0.5000000 0.2578097), wk = 0.0029070 k( 224) = ( 0.2625000 0.5000000 0.2578097), wk = 0.0029070 k( 225) = ( 0.2750000 0.5000000 0.2578097), wk = 0.0029070 k( 226) = ( 0.2875000 0.5000000 0.2578097), wk = 0.0029070 k( 227) = ( 0.3000000 0.5000000 0.2578097), wk = 0.0029070 k( 228) = ( 0.3125000 0.5000000 0.2578097), wk = 0.0029070 k( 229) = ( 0.3250000 0.5000000 0.2578097), wk = 0.0029070 k( 230) = ( 0.3375000 0.5000000 0.2578097), wk = 0.0029070 k( 231) = ( 0.3500000 0.5000000 0.2578097), wk = 0.0029070 k( 232) = ( 0.3625000 0.5000000 0.2578097), wk = 0.0029070 k( 233) = ( 0.3750000 0.5000000 0.2578097), wk = 0.0029070 k( 234) = ( 0.3875000 0.5000000 0.2578097), wk = 0.0029070 k( 235) = ( 0.4000000 0.5000000 0.2578097), wk = 0.0029070 k( 236) = ( 0.4125000 0.5000000 0.2578097), wk = 0.0029070 k( 237) = ( 0.4250000 0.5000000 0.2578097), wk = 0.0029070 k( 238) = ( 0.4375000 0.5000000 0.2578097), wk = 0.0029070 k( 239) = ( 0.4500000 0.5000000 0.2578097), wk = 0.0029070 k( 240) = ( 0.4625000 0.5000000 0.2578097), wk = 0.0029070 k( 241) = ( 0.4750000 0.5000000 0.2578097), wk = 0.0029070 k( 242) = ( 0.4875000 0.5000000 0.2578097), wk = 0.0029070 k( 243) = ( 0.5000000 0.5000000 0.2578097), wk = 0.0029070 k( 244) = ( 0.5000000 0.5000000 0.2578097), wk = 0.0029070 k( 245) = ( 0.4910714 0.4910714 0.2578097), wk = 0.0029070 k( 246) = ( 0.4821429 0.4821429 0.2578097), wk = 0.0029070 k( 247) = ( 0.4732143 0.4732143 0.2578097), wk = 0.0029070 k( 248) = ( 0.4642857 0.4642857 0.2578097), wk = 0.0029070 k( 249) = ( 0.4553571 0.4553571 0.2578097), wk = 0.0029070 k( 250) = ( 0.4464286 0.4464286 0.2578097), wk = 0.0029070 k( 251) = ( 0.4375000 0.4375000 0.2578097), wk = 0.0029070 k( 252) = ( 0.4285714 0.4285714 0.2578097), wk = 0.0029070 k( 253) = ( 0.4196429 0.4196429 0.2578097), wk = 0.0029070 k( 254) = ( 0.4107143 0.4107143 0.2578097), wk = 0.0029070 k( 255) = ( 0.4017857 0.4017857 0.2578097), wk = 0.0029070 k( 256) = ( 0.3928571 0.3928571 0.2578097), wk = 0.0029070 k( 257) = ( 0.3839286 0.3839286 0.2578097), wk = 0.0029070 k( 258) = ( 0.3750000 0.3750000 0.2578097), wk = 0.0029070 k( 259) = ( 0.3660714 0.3660714 0.2578097), wk = 0.0029070 k( 260) = ( 0.3571429 0.3571429 0.2578097), wk = 0.0029070 k( 261) = ( 0.3482143 0.3482143 0.2578097), wk = 0.0029070 k( 262) = ( 0.3392857 0.3392857 0.2578097), wk = 0.0029070 k( 263) = ( 0.3303571 0.3303571 0.2578097), wk = 0.0029070 k( 264) = ( 0.3214286 0.3214286 0.2578097), wk = 0.0029070 k( 265) = ( 0.3125000 0.3125000 0.2578097), wk = 0.0029070 k( 266) = ( 0.3035714 0.3035714 0.2578097), wk = 0.0029070 k( 267) = ( 0.2946429 0.2946429 0.2578097), wk = 0.0029070 k( 268) = ( 0.2857143 0.2857143 0.2578097), wk = 0.0029070 k( 269) = ( 0.2767857 0.2767857 0.2578097), wk = 0.0029070 k( 270) = ( 0.2678571 0.2678571 0.2578097), wk = 0.0029070 k( 271) = ( 0.2589286 0.2589286 0.2578097), wk = 0.0029070 k( 272) = ( 0.2500000 0.2500000 0.2578097), wk = 0.0029070 k( 273) = ( 0.2410714 0.2410714 0.2578097), wk = 0.0029070 k( 274) = ( 0.2321429 0.2321429 0.2578097), wk = 0.0029070 k( 275) = ( 0.2232143 0.2232143 0.2578097), wk = 0.0029070 k( 276) = ( 0.2142857 0.2142857 0.2578097), wk = 0.0029070 k( 277) = ( 0.2053571 0.2053571 0.2578097), wk = 0.0029070 k( 278) = ( 0.1964286 0.1964286 0.2578097), wk = 0.0029070 k( 279) = ( 0.1875000 0.1875000 0.2578097), wk = 0.0029070 k( 280) = ( 0.1785714 0.1785714 0.2578097), wk = 0.0029070 k( 281) = ( 0.1696429 0.1696429 0.2578097), wk = 0.0029070 k( 282) = ( 0.1607143 0.1607143 0.2578097), wk = 0.0029070 k( 283) = ( 0.1517857 0.1517857 0.2578097), wk = 0.0029070 k( 284) = ( 0.1428571 0.1428571 0.2578097), wk = 0.0029070 k( 285) = ( 0.1339286 0.1339286 0.2578097), wk = 0.0029070 k( 286) = ( 0.1250000 0.1250000 0.2578097), wk = 0.0029070 k( 287) = ( 0.1160714 0.1160714 0.2578097), wk = 0.0029070 k( 288) = ( 0.1071429 0.1071429 0.2578097), wk = 0.0029070 k( 289) = ( 0.0982143 0.0982143 0.2578097), wk = 0.0029070 k( 290) = ( 0.0892857 0.0892857 0.2578097), wk = 0.0029070 k( 291) = ( 0.0803571 0.0803571 0.2578097), wk = 0.0029070 k( 292) = ( 0.0714286 0.0714286 0.2578097), wk = 0.0029070 k( 293) = ( 0.0625000 0.0625000 0.2578097), wk = 0.0029070 k( 294) = ( 0.0535714 0.0535714 0.2578097), wk = 0.0029070 k( 295) = ( 0.0446429 0.0446429 0.2578097), wk = 0.0029070 k( 296) = ( 0.0357143 0.0357143 0.2578097), wk = 0.0029070 k( 297) = ( 0.0267857 0.0267857 0.2578097), wk = 0.0029070 k( 298) = ( 0.0178571 0.0178571 0.2578097), wk = 0.0029070 k( 299) = ( 0.0089286 0.0089286 0.2578097), wk = 0.0029070 k( 300) = ( 0.0000000 0.0000000 0.2578097), wk = 0.0029070 k( 301) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 302) = ( 0.0000000 0.5000000 0.0122767), wk = 0.0029070 k( 303) = ( 0.0000000 0.5000000 0.0245533), wk = 0.0029070 k( 304) = ( 0.0000000 0.5000000 0.0368300), wk = 0.0029070 k( 305) = ( 0.0000000 0.5000000 0.0491066), wk = 0.0029070 k( 306) = ( 0.0000000 0.5000000 0.0613833), wk = 0.0029070 k( 307) = ( 0.0000000 0.5000000 0.0736599), wk = 0.0029070 k( 308) = ( 0.0000000 0.5000000 0.0859366), wk = 0.0029070 k( 309) = ( 0.0000000 0.5000000 0.0982132), wk = 0.0029070 k( 310) = ( 0.0000000 0.5000000 0.1104899), wk = 0.0029070 k( 311) = ( 0.0000000 0.5000000 0.1227665), wk = 0.0029070 k( 312) = ( 0.0000000 0.5000000 0.1350432), wk = 0.0029070 k( 313) = ( 0.0000000 0.5000000 0.1473198), wk = 0.0029070 k( 314) = ( 0.0000000 0.5000000 0.1595965), wk = 0.0029070 k( 315) = ( 0.0000000 0.5000000 0.1718731), wk = 0.0029070 k( 316) = ( 0.0000000 0.5000000 0.1841498), wk = 0.0029070 k( 317) = ( 0.0000000 0.5000000 0.1964264), wk = 0.0029070 k( 318) = ( 0.0000000 0.5000000 0.2087031), wk = 0.0029070 k( 319) = ( 0.0000000 0.5000000 0.2209798), wk = 0.0029070 k( 320) = ( 0.0000000 0.5000000 0.2332564), wk = 0.0029070 k( 321) = ( 0.0000000 0.5000000 0.2455331), wk = 0.0029070 k( 322) = ( 0.0000000 0.5000000 0.2578097), wk = 0.0029070 k( 323) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 324) = ( 0.5000000 0.5000000 0.0122767), wk = 0.0029070 k( 325) = ( 0.5000000 0.5000000 0.0245533), wk = 0.0029070 k( 326) = ( 0.5000000 0.5000000 0.0368300), wk = 0.0029070 k( 327) = ( 0.5000000 0.5000000 0.0491066), wk = 0.0029070 k( 328) = ( 0.5000000 0.5000000 0.0613833), wk = 0.0029070 k( 329) = ( 0.5000000 0.5000000 0.0736599), wk = 0.0029070 k( 330) = ( 0.5000000 0.5000000 0.0859366), wk = 0.0029070 k( 331) = ( 0.5000000 0.5000000 0.0982132), wk = 0.0029070 k( 332) = ( 0.5000000 0.5000000 0.1104899), wk = 0.0029070 k( 333) = ( 0.5000000 0.5000000 0.1227665), wk = 0.0029070 k( 334) = ( 0.5000000 0.5000000 0.1350432), wk = 0.0029070 k( 335) = ( 0.5000000 0.5000000 0.1473198), wk = 0.0029070 k( 336) = ( 0.5000000 0.5000000 0.1595965), wk = 0.0029070 k( 337) = ( 0.5000000 0.5000000 0.1718731), wk = 0.0029070 k( 338) = ( 0.5000000 0.5000000 0.1841498), wk = 0.0029070 k( 339) = ( 0.5000000 0.5000000 0.1964264), wk = 0.0029070 k( 340) = ( 0.5000000 0.5000000 0.2087031), wk = 0.0029070 k( 341) = ( 0.5000000 0.5000000 0.2209798), wk = 0.0029070 k( 342) = ( 0.5000000 0.5000000 0.2332564), wk = 0.0029070 k( 343) = ( 0.5000000 0.5000000 0.2455331), wk = 0.0029070 k( 344) = ( 0.5000000 0.5000000 0.2578097), wk = 0.0029070 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0029070 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0029070 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0029070 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0029070 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0029070 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0029070 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0029070 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0029070 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0029070 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0029070 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0029070 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0029070 k( 14) = ( 0.0000000 0.1625000 0.0000000), wk = 0.0029070 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0029070 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0029070 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0029070 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0029070 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0029070 k( 20) = ( 0.0000000 0.2375000 0.0000000), wk = 0.0029070 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0029070 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0029070 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0029070 k( 24) = ( 0.0000000 0.2875000 0.0000000), wk = 0.0029070 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0029070 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0029070 k( 27) = ( 0.0000000 0.3250000 0.0000000), wk = 0.0029070 k( 28) = ( 0.0000000 0.3375000 0.0000000), wk = 0.0029070 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0029070 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0029070 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0029070 k( 32) = ( 0.0000000 0.3875000 0.0000000), wk = 0.0029070 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0029070 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0029070 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0029070 k( 36) = ( 0.0000000 0.4375000 0.0000000), wk = 0.0029070 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0029070 k( 38) = ( 0.0000000 0.4625000 -0.0000000), wk = 0.0029070 k( 39) = ( 0.0000000 0.4750000 0.0000000), wk = 0.0029070 k( 40) = ( 0.0000000 0.4875000 0.0000000), wk = 0.0029070 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0029070 k( 44) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0029070 k( 45) = ( 0.0375000 0.5000000 0.0000000), wk = 0.0029070 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0029070 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0029070 k( 48) = ( 0.0750000 0.5000000 0.0000000), wk = 0.0029070 k( 49) = ( 0.0875000 0.5000000 0.0000000), wk = 0.0029070 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0029070 k( 51) = ( 0.1125000 0.5000000 0.0000000), wk = 0.0029070 k( 52) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0029070 k( 53) = ( 0.1375000 0.5000000 0.0000000), wk = 0.0029070 k( 54) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0029070 k( 55) = ( 0.1625000 0.5000000 0.0000000), wk = 0.0029070 k( 56) = ( 0.1750000 0.5000000 0.0000000), wk = 0.0029070 k( 57) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0029070 k( 58) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0029070 k( 59) = ( 0.2125000 0.5000000 0.0000000), wk = 0.0029070 k( 60) = ( 0.2250000 0.5000000 0.0000000), wk = 0.0029070 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0029070 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0029070 k( 63) = ( 0.2625000 0.5000000 0.0000000), wk = 0.0029070 k( 64) = ( 0.2750000 0.5000000 0.0000000), wk = 0.0029070 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0029070 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0029070 k( 67) = ( 0.3125000 0.5000000 0.0000000), wk = 0.0029070 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0029070 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0029070 k( 70) = ( 0.3500000 0.5000000 0.0000000), wk = 0.0029070 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0029070 k( 72) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0029070 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0029070 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0029070 k( 75) = ( 0.4125000 0.5000000 0.0000000), wk = 0.0029070 k( 76) = ( 0.4250000 0.5000000 0.0000000), wk = 0.0029070 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0029070 k( 78) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0029070 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0029070 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0029070 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0029070 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 84) = ( 0.4910714 0.4910714 0.0000000), wk = 0.0029070 k( 85) = ( 0.4821429 0.4821429 0.0000000), wk = 0.0029070 k( 86) = ( 0.4732143 0.4732143 0.0000000), wk = 0.0029070 k( 87) = ( 0.4642857 0.4642857 0.0000000), wk = 0.0029070 k( 88) = ( 0.4553571 0.4553571 -0.0000000), wk = 0.0029070 k( 89) = ( 0.4464286 0.4464286 0.0000000), wk = 0.0029070 k( 90) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0029070 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0029070 k( 92) = ( 0.4196429 0.4196429 0.0000000), wk = 0.0029070 k( 93) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0029070 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0029070 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0029070 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0029070 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0029070 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0029070 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0029070 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0029070 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0029070 k( 102) = ( 0.3303571 0.3303571 -0.0000000), wk = 0.0029070 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0029070 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0029070 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0029070 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0029070 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0029070 k( 108) = ( 0.2767857 0.2767857 0.0000000), wk = 0.0029070 k( 109) = ( 0.2678571 0.2678571 0.0000000), wk = 0.0029070 k( 110) = ( 0.2589286 0.2589286 0.0000000), wk = 0.0029070 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0029070 k( 112) = ( 0.2410714 0.2410714 0.0000000), wk = 0.0029070 k( 113) = ( 0.2321429 0.2321429 0.0000000), wk = 0.0029070 k( 114) = ( 0.2232143 0.2232143 0.0000000), wk = 0.0029070 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0029070 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0029070 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0029070 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0029070 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0029070 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0029070 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0029070 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0029070 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0029070 k( 124) = ( 0.1339286 0.1339286 0.0000000), wk = 0.0029070 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0029070 k( 126) = ( 0.1160714 0.1160714 0.0000000), wk = 0.0029070 k( 127) = ( 0.1071429 0.1071429 0.0000000), wk = 0.0029070 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0029070 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0029070 k( 130) = ( 0.0803571 0.0803571 -0.0000000), wk = 0.0029070 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0029070 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0029070 k( 133) = ( 0.0535714 0.0535714 0.0000000), wk = 0.0029070 k( 134) = ( 0.0446429 0.0446429 0.0000000), wk = 0.0029070 k( 135) = ( 0.0357143 0.0357143 0.0000000), wk = 0.0029070 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0029070 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0029070 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0029070 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 141) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0029070 k( 142) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0029070 k( 143) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0029070 k( 144) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0029070 k( 145) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0029070 k( 146) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0029070 k( 147) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0029070 k( 148) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0029070 k( 149) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0029070 k( 150) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0029070 k( 151) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0029070 k( 152) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0029070 k( 153) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0029070 k( 154) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0029070 k( 155) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0029070 k( 156) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0029070 k( 157) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0029070 k( 158) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0029070 k( 159) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0029070 k( 160) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0029070 k( 161) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 162) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 163) = ( 0.0000000 0.0125000 0.5000000), wk = 0.0029070 k( 164) = ( 0.0000000 0.0250000 0.5000000), wk = 0.0029070 k( 165) = ( 0.0000000 0.0375000 0.5000000), wk = 0.0029070 k( 166) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0029070 k( 167) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0029070 k( 168) = ( 0.0000000 0.0750000 0.5000000), wk = 0.0029070 k( 169) = ( 0.0000000 0.0875000 0.5000000), wk = 0.0029070 k( 170) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0029070 k( 171) = ( 0.0000000 0.1125000 0.5000000), wk = 0.0029070 k( 172) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0029070 k( 173) = ( 0.0000000 0.1375000 0.5000000), wk = 0.0029070 k( 174) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0029070 k( 175) = ( 0.0000000 0.1625000 0.5000000), wk = 0.0029070 k( 176) = ( 0.0000000 0.1750000 0.5000000), wk = 0.0029070 k( 177) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0029070 k( 178) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0029070 k( 179) = ( 0.0000000 0.2125000 0.5000000), wk = 0.0029070 k( 180) = ( 0.0000000 0.2250000 0.5000000), wk = 0.0029070 k( 181) = ( 0.0000000 0.2375000 0.5000000), wk = 0.0029070 k( 182) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0029070 k( 183) = ( 0.0000000 0.2625000 0.5000000), wk = 0.0029070 k( 184) = ( 0.0000000 0.2750000 0.5000000), wk = 0.0029070 k( 185) = ( 0.0000000 0.2875000 0.5000000), wk = 0.0029070 k( 186) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0029070 k( 187) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0029070 k( 188) = ( 0.0000000 0.3250000 0.5000000), wk = 0.0029070 k( 189) = ( 0.0000000 0.3375000 0.5000000), wk = 0.0029070 k( 190) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0029070 k( 191) = ( 0.0000000 0.3625000 0.5000000), wk = 0.0029070 k( 192) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0029070 k( 193) = ( 0.0000000 0.3875000 0.5000000), wk = 0.0029070 k( 194) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0029070 k( 195) = ( 0.0000000 0.4125000 0.5000000), wk = 0.0029070 k( 196) = ( 0.0000000 0.4250000 0.5000000), wk = 0.0029070 k( 197) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0029070 k( 198) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0029070 k( 199) = ( 0.0000000 0.4625000 0.5000000), wk = 0.0029070 k( 200) = ( 0.0000000 0.4750000 0.5000000), wk = 0.0029070 k( 201) = ( 0.0000000 0.4875000 0.5000000), wk = 0.0029070 k( 202) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 203) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 204) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0029070 k( 205) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0029070 k( 206) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0029070 k( 207) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0029070 k( 208) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0029070 k( 209) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0029070 k( 210) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0029070 k( 211) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0029070 k( 212) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0029070 k( 213) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0029070 k( 214) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0029070 k( 215) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0029070 k( 216) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0029070 k( 217) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0029070 k( 218) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0029070 k( 219) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0029070 k( 220) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0029070 k( 221) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0029070 k( 222) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0029070 k( 223) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0029070 k( 224) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0029070 k( 225) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0029070 k( 226) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0029070 k( 227) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0029070 k( 228) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0029070 k( 229) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0029070 k( 230) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0029070 k( 231) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0029070 k( 232) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0029070 k( 233) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0029070 k( 234) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0029070 k( 235) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0029070 k( 236) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0029070 k( 237) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0029070 k( 238) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0029070 k( 239) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0029070 k( 240) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0029070 k( 241) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0029070 k( 242) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0029070 k( 243) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 k( 244) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 k( 245) = ( 0.4910714 0.4910714 0.5000000), wk = 0.0029070 k( 246) = ( 0.4821429 0.4821429 0.5000000), wk = 0.0029070 k( 247) = ( 0.4732143 0.4732143 0.5000000), wk = 0.0029070 k( 248) = ( 0.4642857 0.4642857 0.5000000), wk = 0.0029070 k( 249) = ( 0.4553571 0.4553571 0.5000000), wk = 0.0029070 k( 250) = ( 0.4464286 0.4464286 0.5000000), wk = 0.0029070 k( 251) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0029070 k( 252) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0029070 k( 253) = ( 0.4196429 0.4196429 0.5000000), wk = 0.0029070 k( 254) = ( 0.4107143 0.4107143 0.5000000), wk = 0.0029070 k( 255) = ( 0.4017857 0.4017857 0.5000000), wk = 0.0029070 k( 256) = ( 0.3928571 0.3928571 0.5000000), wk = 0.0029070 k( 257) = ( 0.3839286 0.3839286 0.5000000), wk = 0.0029070 k( 258) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0029070 k( 259) = ( 0.3660714 0.3660714 0.5000000), wk = 0.0029070 k( 260) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0029070 k( 261) = ( 0.3482143 0.3482143 0.5000000), wk = 0.0029070 k( 262) = ( 0.3392857 0.3392857 0.5000000), wk = 0.0029070 k( 263) = ( 0.3303571 0.3303571 0.5000000), wk = 0.0029070 k( 264) = ( 0.3214286 0.3214286 0.5000000), wk = 0.0029070 k( 265) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0029070 k( 266) = ( 0.3035714 0.3035714 0.5000000), wk = 0.0029070 k( 267) = ( 0.2946429 0.2946429 0.5000000), wk = 0.0029070 k( 268) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0029070 k( 269) = ( 0.2767857 0.2767857 0.5000000), wk = 0.0029070 k( 270) = ( 0.2678571 0.2678571 0.5000000), wk = 0.0029070 k( 271) = ( 0.2589286 0.2589286 0.5000000), wk = 0.0029070 k( 272) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0029070 k( 273) = ( 0.2410714 0.2410714 0.5000000), wk = 0.0029070 k( 274) = ( 0.2321429 0.2321429 0.5000000), wk = 0.0029070 k( 275) = ( 0.2232143 0.2232143 0.5000000), wk = 0.0029070 k( 276) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0029070 k( 277) = ( 0.2053571 0.2053571 0.5000000), wk = 0.0029070 k( 278) = ( 0.1964286 0.1964286 0.5000000), wk = 0.0029070 k( 279) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0029070 k( 280) = ( 0.1785714 0.1785714 0.5000000), wk = 0.0029070 k( 281) = ( 0.1696429 0.1696429 0.5000000), wk = 0.0029070 k( 282) = ( 0.1607143 0.1607143 0.5000000), wk = 0.0029070 k( 283) = ( 0.1517857 0.1517857 0.5000000), wk = 0.0029070 k( 284) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0029070 k( 285) = ( 0.1339286 0.1339286 0.5000000), wk = 0.0029070 k( 286) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0029070 k( 287) = ( 0.1160714 0.1160714 0.5000000), wk = 0.0029070 k( 288) = ( 0.1071429 0.1071429 0.5000000), wk = 0.0029070 k( 289) = ( 0.0982143 0.0982143 0.5000000), wk = 0.0029070 k( 290) = ( 0.0892857 0.0892857 0.5000000), wk = 0.0029070 k( 291) = ( 0.0803571 0.0803571 0.5000000), wk = 0.0029070 k( 292) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0029070 k( 293) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0029070 k( 294) = ( 0.0535714 0.0535714 0.5000000), wk = 0.0029070 k( 295) = ( 0.0446429 0.0446429 0.5000000), wk = 0.0029070 k( 296) = ( 0.0357143 0.0357143 0.5000000), wk = 0.0029070 k( 297) = ( 0.0267857 0.0267857 0.5000000), wk = 0.0029070 k( 298) = ( 0.0178571 0.0178571 0.5000000), wk = 0.0029070 k( 299) = ( 0.0089286 0.0089286 0.5000000), wk = 0.0029070 k( 300) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 301) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 302) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0029070 k( 303) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0029070 k( 304) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0029070 k( 305) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0029070 k( 306) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0029070 k( 307) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0029070 k( 308) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0029070 k( 309) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0029070 k( 310) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0029070 k( 311) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0029070 k( 312) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0029070 k( 313) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0029070 k( 314) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0029070 k( 315) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0029070 k( 316) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0029070 k( 317) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0029070 k( 318) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0029070 k( 319) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0029070 k( 320) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0029070 k( 321) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0029070 k( 322) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 323) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 324) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0029070 k( 325) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0029070 k( 326) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0029070 k( 327) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0029070 k( 328) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0029070 k( 329) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0029070 k( 330) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0029070 k( 331) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0029070 k( 332) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0029070 k( 333) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0029070 k( 334) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0029070 k( 335) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0029070 k( 336) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0029070 k( 337) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0029070 k( 338) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0029070 k( 339) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0029070 k( 340) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0029070 k( 341) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0029070 k( 342) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0029070 k( 343) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0029070 k( 344) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 Dense grid: 64273 G-vectors FFT dimensions: ( 40, 40, 80) Smooth grid: 35523 G-vectors FFT dimensions: ( 36, 36, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.24 Mb ( 264, 60) NL pseudopotentials 0.34 Mb ( 132, 168) Each V/rho on FFT grid 0.07 Mb ( 4800) Each G-vector array 0.01 Mb ( 1785) G-vector shells 0.01 Mb ( 826) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.97 Mb ( 264, 240) Each subspace H/S matrix 0.05 Mb ( 60, 60) Each matrix 0.31 Mb ( 168, 2, 60) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./CaNiGeH.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 4.7 secs Computing kpt #: 2 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 6.5 secs Computing kpt #: 3 total cpu time spent up to now is 8.2 secs Computing kpt #: 4 total cpu time spent up to now is 9.5 secs Computing kpt #: 5 total cpu time spent up to now is 10.8 secs Computing kpt #: 6 total cpu time spent up to now is 11.8 secs Computing kpt #: 7 total cpu time spent up to now is 12.7 secs Computing kpt #: 8 total cpu time spent up to now is 13.7 secs Computing kpt #: 9 total cpu time spent up to now is 14.7 secs Computing kpt #: 10 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 16.5 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 18.4 secs Computing kpt #: 12 total cpu time spent up to now is 19.6 secs Computing kpt #: 13 total cpu time spent up to now is 20.7 secs Computing kpt #: 14 total cpu time spent up to now is 21.6 secs Computing kpt #: 15 total cpu time spent up to now is 22.7 secs Computing kpt #: 16 total cpu time spent up to now is 23.6 secs Computing kpt #: 17 total cpu time spent up to now is 24.6 secs Computing kpt #: 18 total cpu time spent up to now is 25.5 secs Computing kpt #: 19 total cpu time spent up to now is 26.5 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 28.3 secs Computing kpt #: 22 total cpu time spent up to now is 29.3 secs Computing kpt #: 23 total cpu time spent up to now is 30.2 secs Computing kpt #: 24 total cpu time spent up to now is 31.1 secs Computing kpt #: 25 total cpu time spent up to now is 32.1 secs Computing kpt #: 26 total cpu time spent up to now is 33.0 secs Computing kpt #: 27 total cpu time spent up to now is 34.0 secs Computing kpt #: 28 total cpu time spent up to now is 34.9 secs Computing kpt #: 29 total cpu time spent up to now is 35.9 secs Computing kpt #: 30 total cpu time spent up to now is 36.9 secs Computing kpt #: 31 total cpu time spent up to now is 37.9 secs Computing kpt #: 32 total cpu time spent up to now is 38.9 secs Computing kpt #: 33 total cpu time spent up to now is 40.0 secs Computing kpt #: 34 total cpu time spent up to now is 41.0 secs Computing kpt #: 35 total cpu time spent up to now is 42.6 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 44.5 secs Computing kpt #: 37 total cpu time spent up to now is 46.0 secs Computing kpt #: 38 total cpu time spent up to now is 47.4 secs Computing kpt #: 39 total cpu time spent up to now is 48.4 secs Computing kpt #: 40 total cpu time spent up to now is 49.4 secs Computing kpt #: 41 total cpu time spent up to now is 50.3 secs Computing kpt #: 42 total cpu time spent up to now is 51.3 secs Computing kpt #: 43 total cpu time spent up to now is 52.2 secs Computing kpt #: 44 total cpu time spent up to now is 53.2 secs Computing kpt #: 45 total cpu time spent up to now is 54.2 secs Computing kpt #: 46 total cpu time spent up to now is 55.1 secs Computing kpt #: 47 total cpu time spent up to now is 56.1 secs Computing kpt #: 48 total cpu time spent up to now is 57.1 secs Computing kpt #: 49 total cpu time spent up to now is 58.1 secs Computing kpt #: 50 total cpu time spent up to now is 59.0 secs Computing kpt #: 51 total cpu time spent up to now is 60.0 secs Computing kpt #: 52 total cpu time spent up to now is 60.9 secs Computing kpt #: 53 total cpu time spent up to now is 61.8 secs Computing kpt #: 54 total cpu time spent up to now is 62.7 secs Computing kpt #: 55 total cpu time spent up to now is 63.6 secs Computing kpt #: 56 total cpu time spent up to now is 64.4 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 66.1 secs Computing kpt #: 59 total cpu time spent up to now is 67.0 secs Computing kpt #: 60 total cpu time spent up to now is 67.8 secs Computing kpt #: 61 total cpu time spent up to now is 68.6 secs Computing kpt #: 62 total cpu time spent up to now is 69.4 secs Computing kpt #: 63 total cpu time spent up to now is 70.3 secs Computing kpt #: 64 total cpu time spent up to now is 71.1 secs Computing kpt #: 65 total cpu time spent up to now is 71.9 secs Computing kpt #: 66 total cpu time spent up to now is 72.8 secs Computing kpt #: 67 total cpu time spent up to now is 73.6 secs Computing kpt #: 68 total cpu time spent up to now is 74.4 secs Computing kpt #: 69 total cpu time spent up to now is 75.1 secs Computing kpt #: 70 total cpu time spent up to now is 75.9 secs Computing kpt #: 71 total cpu time spent up to now is 76.7 secs Computing kpt #: 72 total cpu time spent up to now is 77.4 secs Computing kpt #: 73 total cpu time spent up to now is 78.0 secs Computing kpt #: 74 total cpu time spent up to now is 78.6 secs Computing kpt #: 75 total cpu time spent up to now is 79.3 secs Computing kpt #: 76 total cpu time spent up to now is 79.9 secs Computing kpt #: 77 total cpu time spent up to now is 80.6 secs Computing kpt #: 78 total cpu time spent up to now is 81.2 secs Computing kpt #: 79 total cpu time spent up to now is 81.8 secs Computing kpt #: 80 total cpu time spent up to now is 82.5 secs Computing kpt #: 81 total cpu time spent up to now is 83.2 secs Computing kpt #: 82 total cpu time spent up to now is 84.0 secs Computing kpt #: 83 total cpu time spent up to now is 84.6 secs Computing kpt #: 84 total cpu time spent up to now is 85.3 secs Computing kpt #: 85 total cpu time spent up to now is 86.0 secs Computing kpt #: 86 total cpu time spent up to now is 86.7 secs Computing kpt #: 87 total cpu time spent up to now is 87.3 secs Computing kpt #: 88 total cpu time spent up to now is 88.0 secs Computing kpt #: 89 total cpu time spent up to now is 88.6 secs Computing kpt #: 90 total cpu time spent up to now is 89.3 secs Computing kpt #: 91 total cpu time spent up to now is 89.9 secs Computing kpt #: 92 total cpu time spent up to now is 90.6 secs Computing kpt #: 93 total cpu time spent up to now is 91.2 secs Computing kpt #: 94 total cpu time spent up to now is 92.0 secs Computing kpt #: 95 total cpu time spent up to now is 92.6 secs Computing kpt #: 96 total cpu time spent up to now is 93.3 secs Computing kpt #: 97 total cpu time spent up to now is 94.0 secs Computing kpt #: 98 total cpu time spent up to now is 94.7 secs Computing kpt #: 99 total cpu time spent up to now is 95.5 secs Computing kpt #: 100 total cpu time spent up to now is 96.3 secs Computing kpt #: 101 total cpu time spent up to now is 97.1 secs Computing kpt #: 102 total cpu time spent up to now is 97.9 secs Computing kpt #: 103 total cpu time spent up to now is 98.7 secs Computing kpt #: 104 total cpu time spent up to now is 99.5 secs Computing kpt #: 105 total cpu time spent up to now is 100.3 secs Computing kpt #: 106 total cpu time spent up to now is 101.1 secs Computing kpt #: 107 total cpu time spent up to now is 102.0 secs Computing kpt #: 108 total cpu time spent up to now is 102.8 secs Computing kpt #: 109 total cpu time spent up to now is 103.6 secs Computing kpt #: 110 total cpu time spent up to now is 104.4 secs Computing kpt #: 111 total cpu time spent up to now is 105.2 secs Computing kpt #: 112 total cpu time spent up to now is 106.0 secs Computing kpt #: 113 total cpu time spent up to now is 106.7 secs Computing kpt #: 114 total cpu time spent up to now is 107.6 secs Computing kpt #: 115 total cpu time spent up to now is 108.5 secs Computing kpt #: 116 total cpu time spent up to now is 109.3 secs Computing kpt #: 117 total cpu time spent up to now is 110.3 secs Computing kpt #: 118 total cpu time spent up to now is 111.6 secs Computing kpt #: 119 total cpu time spent up to now is 113.3 secs Computing kpt #: 120 total cpu time spent up to now is 114.1 secs Computing kpt #: 121 total cpu time spent up to now is 115.2 secs Computing kpt #: 122 total cpu time spent up to now is 116.2 secs Computing kpt #: 123 total cpu time spent up to now is 117.6 secs Computing kpt #: 124 total cpu time spent up to now is 118.7 secs Computing kpt #: 125 total cpu time spent up to now is 119.6 secs Computing kpt #: 126 total cpu time spent up to now is 120.8 secs Computing kpt #: 127 total cpu time spent up to now is 122.0 secs Computing kpt #: 128 total cpu time spent up to now is 122.9 secs Computing kpt #: 129 total cpu time spent up to now is 123.8 secs Computing kpt #: 130 total cpu time spent up to now is 124.7 secs Computing kpt #: 131 total cpu time spent up to now is 125.7 secs Computing kpt #: 132 total cpu time spent up to now is 126.6 secs Computing kpt #: 133 total cpu time spent up to now is 127.6 secs Computing kpt #: 134 total cpu time spent up to now is 128.6 secs Computing kpt #: 135 total cpu time spent up to now is 129.4 secs Computing kpt #: 136 total cpu time spent up to now is 131.0 secs Computing kpt #: 137 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 132.7 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 134.5 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 136.3 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 138.1 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 139.9 secs Computing kpt #: 142 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 141.7 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 143.5 secs Computing kpt #: 144 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 145.2 secs Computing kpt #: 145 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 147.0 secs Computing kpt #: 146 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 148.8 secs Computing kpt #: 147 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 150.6 secs Computing kpt #: 148 total cpu time spent up to now is 151.6 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 153.4 secs Computing kpt #: 150 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 155.3 secs Computing kpt #: 151 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 157.2 secs Computing kpt #: 152 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 159.0 secs Computing kpt #: 153 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 160.9 secs Computing kpt #: 154 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 162.7 secs Computing kpt #: 155 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 164.6 secs Computing kpt #: 156 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 166.4 secs Computing kpt #: 157 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 168.3 secs Computing kpt #: 158 total cpu time spent up to now is 169.6 secs Computing kpt #: 159 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 171.4 secs Computing kpt #: 160 total cpu time spent up to now is 173.0 secs Computing kpt #: 161 total cpu time spent up to now is 174.2 secs Computing kpt #: 162 total cpu time spent up to now is 175.8 secs Computing kpt #: 163 total cpu time spent up to now is 177.5 secs Computing kpt #: 164 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 179.3 secs Computing kpt #: 165 total cpu time spent up to now is 180.6 secs Computing kpt #: 166 total cpu time spent up to now is 182.1 secs Computing kpt #: 167 total cpu time spent up to now is 183.2 secs Computing kpt #: 168 total cpu time spent up to now is 184.5 secs Computing kpt #: 169 total cpu time spent up to now is 186.0 secs Computing kpt #: 170 total cpu time spent up to now is 187.1 secs Computing kpt #: 171 total cpu time spent up to now is 188.4 secs Computing kpt #: 172 total cpu time spent up to now is 189.4 secs Computing kpt #: 173 total cpu time spent up to now is 190.3 secs Computing kpt #: 174 total cpu time spent up to now is 191.2 secs Computing kpt #: 175 total cpu time spent up to now is 192.1 secs Computing kpt #: 176 total cpu time spent up to now is 193.1 secs Computing kpt #: 177 total cpu time spent up to now is 194.0 secs Computing kpt #: 178 total cpu time spent up to now is 194.9 secs Computing kpt #: 179 total cpu time spent up to now is 195.8 secs Computing kpt #: 180 total cpu time spent up to now is 196.7 secs Computing kpt #: 181 total cpu time spent up to now is 197.7 secs Computing kpt #: 182 total cpu time spent up to now is 198.7 secs Computing kpt #: 183 total cpu time spent up to now is 199.7 secs Computing kpt #: 184 total cpu time spent up to now is 200.6 secs Computing kpt #: 185 total cpu time spent up to now is 201.6 secs Computing kpt #: 186 total cpu time spent up to now is 202.7 secs Computing kpt #: 187 total cpu time spent up to now is 203.7 secs Computing kpt #: 188 total cpu time spent up to now is 205.1 secs Computing kpt #: 189 total cpu time spent up to now is 206.9 secs Computing kpt #: 190 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 208.7 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 210.5 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 212.4 secs Computing kpt #: 193 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 214.2 secs Computing kpt #: 194 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 216.1 secs Computing kpt #: 195 total cpu time spent up to now is 217.6 secs Computing kpt #: 196 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 219.5 secs Computing kpt #: 197 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 221.3 secs Computing kpt #: 198 total cpu time spent up to now is 222.8 secs Computing kpt #: 199 total cpu time spent up to now is 224.2 secs Computing kpt #: 200 total cpu time spent up to now is 225.5 secs Computing kpt #: 201 total cpu time spent up to now is 226.6 secs Computing kpt #: 202 total cpu time spent up to now is 227.7 secs Computing kpt #: 203 total cpu time spent up to now is 228.9 secs Computing kpt #: 204 total cpu time spent up to now is 230.1 secs Computing kpt #: 205 total cpu time spent up to now is 231.2 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 233.4 secs Computing kpt #: 208 total cpu time spent up to now is 234.4 secs Computing kpt #: 209 total cpu time spent up to now is 235.3 secs Computing kpt #: 210 total cpu time spent up to now is 236.3 secs Computing kpt #: 211 total cpu time spent up to now is 237.3 secs Computing kpt #: 212 total cpu time spent up to now is 238.2 secs Computing kpt #: 213 total cpu time spent up to now is 239.2 secs Computing kpt #: 214 total cpu time spent up to now is 240.1 secs Computing kpt #: 215 total cpu time spent up to now is 241.0 secs Computing kpt #: 216 total cpu time spent up to now is 241.9 secs Computing kpt #: 217 total cpu time spent up to now is 242.8 secs Computing kpt #: 218 total cpu time spent up to now is 243.8 secs Computing kpt #: 219 total cpu time spent up to now is 244.9 secs Computing kpt #: 220 total cpu time spent up to now is 245.7 secs Computing kpt #: 221 total cpu time spent up to now is 246.6 secs Computing kpt #: 222 total cpu time spent up to now is 247.4 secs Computing kpt #: 223 total cpu time spent up to now is 248.3 secs Computing kpt #: 224 total cpu time spent up to now is 249.1 secs Computing kpt #: 225 total cpu time spent up to now is 249.9 secs Computing kpt #: 226 total cpu time spent up to now is 250.7 secs Computing kpt #: 227 total cpu time spent up to now is 251.6 secs Computing kpt #: 228 total cpu time spent up to now is 252.4 secs Computing kpt #: 229 total cpu time spent up to now is 253.2 secs Computing kpt #: 230 total cpu time spent up to now is 254.1 secs Computing kpt #: 231 total cpu time spent up to now is 254.9 secs Computing kpt #: 232 total cpu time spent up to now is 255.7 secs Computing kpt #: 233 total cpu time spent up to now is 256.5 secs Computing kpt #: 234 total cpu time spent up to now is 257.3 secs Computing kpt #: 235 total cpu time spent up to now is 258.1 secs Computing kpt #: 236 total cpu time spent up to now is 258.9 secs Computing kpt #: 237 total cpu time spent up to now is 259.7 secs Computing kpt #: 238 total cpu time spent up to now is 260.4 secs Computing kpt #: 239 total cpu time spent up to now is 261.1 secs Computing kpt #: 240 total cpu time spent up to now is 261.9 secs Computing kpt #: 241 total cpu time spent up to now is 262.6 secs Computing kpt #: 242 total cpu time spent up to now is 263.4 secs Computing kpt #: 243 total cpu time spent up to now is 264.2 secs Computing kpt #: 244 total cpu time spent up to now is 265.0 secs Computing kpt #: 245 total cpu time spent up to now is 265.9 secs Computing kpt #: 246 total cpu time spent up to now is 266.6 secs Computing kpt #: 247 total cpu time spent up to now is 267.3 secs Computing kpt #: 248 total cpu time spent up to now is 268.0 secs Computing kpt #: 249 total cpu time spent up to now is 268.8 secs Computing kpt #: 250 total cpu time spent up to now is 269.5 secs Computing kpt #: 251 total cpu time spent up to now is 270.3 secs Computing kpt #: 252 total cpu time spent up to now is 271.1 secs Computing kpt #: 253 total cpu time spent up to now is 271.9 secs Computing kpt #: 254 total cpu time spent up to now is 272.9 secs Computing kpt #: 255 total cpu time spent up to now is 273.8 secs Computing kpt #: 256 total cpu time spent up to now is 274.8 secs Computing kpt #: 257 total cpu time spent up to now is 276.0 secs Computing kpt #: 258 total cpu time spent up to now is 277.2 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 279.0 secs Computing kpt #: 260 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 280.8 secs Computing kpt #: 261 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 282.6 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 284.4 secs Computing kpt #: 263 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 286.2 secs Computing kpt #: 264 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 287.9 secs Computing kpt #: 265 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 289.7 secs Computing kpt #: 266 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 291.5 secs Computing kpt #: 267 total cpu time spent up to now is 293.2 secs Computing kpt #: 268 total cpu time spent up to now is 294.6 secs Computing kpt #: 269 total cpu time spent up to now is 295.8 secs Computing kpt #: 270 total cpu time spent up to now is 296.9 secs Computing kpt #: 271 total cpu time spent up to now is 297.9 secs Computing kpt #: 272 total cpu time spent up to now is 298.7 secs Computing kpt #: 273 total cpu time spent up to now is 299.6 secs Computing kpt #: 274 total cpu time spent up to now is 300.5 secs Computing kpt #: 275 total cpu time spent up to now is 301.4 secs Computing kpt #: 276 total cpu time spent up to now is 302.3 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 304.9 secs Computing kpt #: 280 total cpu time spent up to now is 305.7 secs Computing kpt #: 281 total cpu time spent up to now is 306.6 secs Computing kpt #: 282 total cpu time spent up to now is 307.5 secs Computing kpt #: 283 total cpu time spent up to now is 308.5 secs Computing kpt #: 284 total cpu time spent up to now is 309.5 secs Computing kpt #: 285 total cpu time spent up to now is 310.4 secs Computing kpt #: 286 total cpu time spent up to now is 311.4 secs Computing kpt #: 287 total cpu time spent up to now is 312.4 secs Computing kpt #: 288 total cpu time spent up to now is 313.5 secs Computing kpt #: 289 total cpu time spent up to now is 314.4 secs Computing kpt #: 290 total cpu time spent up to now is 315.4 secs Computing kpt #: 291 total cpu time spent up to now is 316.4 secs Computing kpt #: 292 total cpu time spent up to now is 317.4 secs Computing kpt #: 293 total cpu time spent up to now is 318.5 secs Computing kpt #: 294 total cpu time spent up to now is 319.6 secs Computing kpt #: 295 total cpu time spent up to now is 320.7 secs Computing kpt #: 296 total cpu time spent up to now is 321.7 secs Computing kpt #: 297 total cpu time spent up to now is 322.9 secs Computing kpt #: 298 total cpu time spent up to now is 324.1 secs Computing kpt #: 299 total cpu time spent up to now is 325.8 secs Computing kpt #: 300 total cpu time spent up to now is 327.1 secs Computing kpt #: 301 total cpu time spent up to now is 328.0 secs Computing kpt #: 302 total cpu time spent up to now is 329.0 secs Computing kpt #: 303 total cpu time spent up to now is 329.9 secs Computing kpt #: 304 total cpu time spent up to now is 330.9 secs Computing kpt #: 305 total cpu time spent up to now is 331.9 secs Computing kpt #: 306 total cpu time spent up to now is 332.8 secs Computing kpt #: 307 total cpu time spent up to now is 333.8 secs Computing kpt #: 308 total cpu time spent up to now is 334.8 secs Computing kpt #: 309 total cpu time spent up to now is 335.9 secs Computing kpt #: 310 total cpu time spent up to now is 337.1 secs Computing kpt #: 311 total cpu time spent up to now is 338.4 secs Computing kpt #: 312 total cpu time spent up to now is 340.0 secs Computing kpt #: 313 total cpu time spent up to now is 341.8 secs Computing kpt #: 314 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 343.7 secs Computing kpt #: 315 total cpu time spent up to now is 345.5 secs Computing kpt #: 316 total cpu time spent up to now is 347.3 secs Computing kpt #: 317 total cpu time spent up to now is 348.8 secs Computing kpt #: 318 total cpu time spent up to now is 350.2 secs Computing kpt #: 319 total cpu time spent up to now is 351.5 secs Computing kpt #: 320 total cpu time spent up to now is 352.7 secs Computing kpt #: 321 total cpu time spent up to now is 353.9 secs Computing kpt #: 322 total cpu time spent up to now is 355.1 secs Computing kpt #: 323 total cpu time spent up to now is 355.8 secs Computing kpt #: 324 total cpu time spent up to now is 356.5 secs Computing kpt #: 325 total cpu time spent up to now is 357.3 secs Computing kpt #: 326 total cpu time spent up to now is 358.0 secs Computing kpt #: 327 total cpu time spent up to now is 358.6 secs Computing kpt #: 328 total cpu time spent up to now is 359.2 secs Computing kpt #: 329 total cpu time spent up to now is 359.9 secs Computing kpt #: 330 total cpu time spent up to now is 360.6 secs Computing kpt #: 331 total cpu time spent up to now is 361.3 secs Computing kpt #: 332 total cpu time spent up to now is 362.0 secs Computing kpt #: 333 total cpu time spent up to now is 362.7 secs Computing kpt #: 334 total cpu time spent up to now is 363.4 secs Computing kpt #: 335 total cpu time spent up to now is 364.0 secs Computing kpt #: 336 total cpu time spent up to now is 364.7 secs Computing kpt #: 337 total cpu time spent up to now is 365.4 secs Computing kpt #: 338 total cpu time spent up to now is 366.2 secs Computing kpt #: 339 total cpu time spent up to now is 366.9 secs Computing kpt #: 340 total cpu time spent up to now is 367.6 secs Computing kpt #: 341 total cpu time spent up to now is 368.3 secs Computing kpt #: 342 total cpu time spent up to now is 369.0 secs Computing kpt #: 343 total cpu time spent up to now is 369.8 secs Computing kpt #: 344 total cpu time spent up to now is 370.6 secs ethr = 2.00E-08, avg # of iterations = 53.5 total cpu time spent up to now is 370.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4435 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8500 -13.8500 -13.7681 -13.7681 -13.4931 -13.4931 -13.4497 -13.4497 -13.3951 -13.3951 -13.3829 -13.3829 -2.4640 -2.4640 -0.3956 -0.3956 2.4553 2.4553 4.3426 4.3426 4.9952 4.9952 5.0207 5.0207 5.2776 5.2776 5.3025 5.3025 5.3860 5.3860 5.9157 5.9157 6.0090 6.0090 6.5470 6.5470 6.7634 6.7634 7.2314 7.2314 7.4372 7.4372 7.4924 7.4924 8.2022 8.2022 8.6477 8.6477 10.2349 10.2349 10.7748 10.7748 10.8444 10.8444 11.4512 11.4516 k = 0.0000 0.0125-0.0000 ( 4431 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8500 -13.8500 -13.7681 -13.7681 -13.4931 -13.4931 -13.4498 -13.4498 -13.3951 -13.3951 -13.3830 -13.3830 -2.4627 -2.4627 -0.3953 -0.3953 2.4567 2.4567 4.3432 4.3432 4.9942 4.9942 5.0197 5.0197 5.2783 5.2783 5.3037 5.3037 5.3845 5.3845 5.9151 5.9151 6.0081 6.0081 6.5465 6.5465 6.7628 6.7628 7.2232 7.2232 7.4380 7.4380 7.4951 7.4951 8.2011 8.2011 8.6491 8.6491 10.2221 10.2221 10.7798 10.7798 10.8503 10.8503 11.4399 11.4406 k = 0.0000 0.0250-0.0000 ( 4429 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8500 -13.8500 -13.7683 -13.7683 -13.4930 -13.4930 -13.4500 -13.4500 -13.3951 -13.3951 -13.3831 -13.3831 -2.4589 -2.4589 -0.3943 -0.3943 2.4607 2.4607 4.3450 4.3450 4.9909 4.9909 5.0172 5.0172 5.2805 5.2805 5.3073 5.3073 5.3799 5.3799 5.9132 5.9132 6.0055 6.0055 6.5447 6.5447 6.7611 6.7611 7.2017 7.2017 7.4304 7.4304 7.5102 7.5102 8.1977 8.1977 8.6533 8.6533 10.1868 10.1868 10.7857 10.7857 10.8739 10.8739 11.4066 11.4066 k = 0.0000 0.0375-0.0000 ( 4425 PWs) bands (ev): -32.5503 -32.5503 -32.5272 -32.5272 -13.8500 -13.8500 -13.7687 -13.7687 -13.4930 -13.4930 -13.4503 -13.4503 -13.3951 -13.3951 -13.3834 -13.3834 -2.4526 -2.4526 -0.3926 -0.3926 2.4675 2.4675 4.3478 4.3478 4.9844 4.9844 5.0141 5.0141 5.2840 5.2840 5.3129 5.3129 5.3724 5.3724 5.9101 5.9101 6.0011 6.0011 6.5419 6.5419 6.7582 6.7582 7.1724 7.1724 7.4069 7.4069 7.5405 7.5405 8.1920 8.1920 8.6602 8.6602 10.1362 10.1362 10.7823 10.7823 10.9186 10.9186 11.3656 11.3657 k = 0.0000 0.0500-0.0000 ( 4419 PWs) bands (ev): -32.5502 -32.5502 -32.5272 -32.5272 -13.8501 -13.8501 -13.7692 -13.7692 -13.4929 -13.4929 -13.4508 -13.4508 -13.3951 -13.3951 -13.3838 -13.3838 -2.4438 -2.4438 -0.3904 -0.3904 2.4769 2.4769 4.3518 4.3518 4.9741 4.9741 5.0116 5.0116 5.2889 5.2889 5.3203 5.3203 5.3619 5.3619 5.9057 5.9057 5.9949 5.9949 6.5379 6.5379 6.7541 6.7541 7.1394 7.1394 7.3710 7.3710 7.5798 7.5798 8.1838 8.1838 8.6697 8.6697 10.0767 10.0767 10.7710 10.7710 10.9768 10.9768 11.3233 11.3233 k = 0.0000 0.0625-0.0000 ( 4423 PWs) bands (ev): -32.5501 -32.5501 -32.5272 -32.5272 -13.8501 -13.8501 -13.7699 -13.7699 -13.4927 -13.4927 -13.4513 -13.4513 -13.3953 -13.3953 -13.3844 -13.3844 -2.4325 -2.4325 -0.3876 -0.3876 2.4889 2.4889 4.3566 4.3566 4.9601 4.9601 5.0097 5.0097 5.2948 5.2948 5.3285 5.3285 5.3491 5.3491 5.9000 5.9000 5.9869 5.9869 6.5328 6.5328 6.7487 6.7487 7.1047 7.1047 7.3260 7.3260 7.6242 7.6242 8.1730 8.1730 8.6818 8.6818 10.0129 10.0129 10.7544 10.7544 11.0417 11.0417 11.2815 11.2815 k = 0.0000 0.0750-0.0000 ( 4423 PWs) bands (ev): -32.5499 -32.5499 -32.5273 -32.5273 -13.8501 -13.8501 -13.7707 -13.7707 -13.4926 -13.4926 -13.4520 -13.4520 -13.3954 -13.3954 -13.3850 -13.3850 -2.4187 -2.4187 -0.3842 -0.3842 2.5036 2.5036 4.3623 4.3623 4.9431 4.9431 5.0085 5.0085 5.3009 5.3009 5.3294 5.3294 5.3427 5.3427 5.8930 5.8930 5.9771 5.9771 6.5266 6.5266 6.7423 6.7423 7.0695 7.0695 7.2744 7.2744 7.6719 7.6719 8.1592 8.1592 8.6963 8.6963 9.9480 9.9480 10.7337 10.7337 11.1093 11.1093 11.2417 11.2417 k = 0.0000 0.0875-0.0000 ( 4425 PWs) bands (ev): -32.5497 -32.5497 -32.5273 -32.5273 -13.8501 -13.8501 -13.7716 -13.7716 -13.4924 -13.4924 -13.4527 -13.4527 -13.3957 -13.3957 -13.3856 -13.3856 -2.4024 -2.4024 -0.3804 -0.3804 2.5210 2.5210 4.3687 4.3687 4.9234 4.9234 5.0076 5.0076 5.2994 5.2994 5.3209 5.3209 5.3520 5.3520 5.8846 5.8846 5.9654 5.9654 6.5194 6.5194 6.7345 6.7345 7.0344 7.0344 7.2184 7.2184 7.7219 7.7219 8.1423 8.1423 8.7131 8.7131 9.8840 9.8840 10.7096 10.7096 11.1757 11.1757 11.2059 11.2059 k = 0.0000 0.1000-0.0000 ( 4435 PWs) bands (ev): -32.5495 -32.5495 -32.5273 -32.5273 -13.8502 -13.8502 -13.7728 -13.7728 -13.4922 -13.4922 -13.4536 -13.4536 -13.3961 -13.3961 -13.3863 -13.3863 -2.3837 -2.3837 -0.3762 -0.3762 2.5408 2.5408 4.3757 4.3757 4.9013 4.9013 5.0070 5.0070 5.2802 5.2802 5.3265 5.3265 5.3634 5.3634 5.8748 5.8748 5.9517 5.9517 6.5113 6.5113 6.7255 6.7255 6.9996 6.9996 7.1597 7.1597 7.7737 7.7737 8.1219 8.1219 8.7321 8.7321 9.8226 9.8226 10.6826 10.6826 11.1677 11.1677 11.2462 11.2462 k = 0.0000 0.1125-0.0000 ( 4431 PWs) bands (ev): -32.5493 -32.5493 -32.5274 -32.5274 -13.8502 -13.8502 -13.7740 -13.7740 -13.4920 -13.4920 -13.4544 -13.4544 -13.3966 -13.3966 -13.3870 -13.3870 -2.3626 -2.3626 -0.3717 -0.3717 2.5633 2.5633 4.3829 4.3829 4.8774 4.8774 5.0067 5.0067 5.2538 5.2538 5.3369 5.3369 5.3755 5.3755 5.8636 5.8636 5.9362 5.9362 6.5022 6.5022 6.7154 6.7154 6.9655 6.9655 7.1004 7.1004 7.8270 7.8270 8.0979 8.0979 8.7533 8.7533 9.7648 9.7648 10.6532 10.6532 11.1364 11.1364 11.3106 11.3107 k = 0.0000 0.1250-0.0000 ( 4427 PWs) bands (ev): -32.5490 -32.5490 -32.5274 -32.5274 -13.8503 -13.8503 -13.7754 -13.7754 -13.4919 -13.4919 -13.4554 -13.4554 -13.3972 -13.3972 -13.3876 -13.3876 -2.3391 -2.3391 -0.3669 -0.3669 2.5882 2.5882 4.3900 4.3900 4.8517 4.8517 5.0067 5.0067 5.2234 5.2234 5.3490 5.3490 5.3881 5.3881 5.8509 5.8509 5.9188 5.9188 6.4924 6.4924 6.7040 6.7040 6.9321 6.9321 7.0418 7.0418 7.8816 7.8816 8.0701 8.0701 8.7765 8.7765 9.7115 9.7115 10.6219 10.6219 11.1082 11.1082 11.3170 11.3171 k = 0.0000 0.1375-0.0000 ( 4427 PWs) bands (ev): -32.5487 -32.5487 -32.5275 -32.5275 -13.8503 -13.8503 -13.7769 -13.7769 -13.4917 -13.4917 -13.4563 -13.4563 -13.3981 -13.3981 -13.3881 -13.3881 -2.3132 -2.3132 -0.3620 -0.3620 2.6156 2.6156 4.3965 4.3965 4.8243 4.8243 5.0070 5.0070 5.1900 5.1900 5.3623 5.3623 5.4009 5.4009 5.8367 5.8367 5.8996 5.8996 6.4818 6.4818 6.6913 6.6913 6.8992 6.8992 6.9855 6.9855 7.9367 7.9367 8.0390 8.0390 8.8017 8.8017 9.6635 9.6635 10.5888 10.5888 11.0835 11.0835 11.2915 11.2915 k = 0.0000 0.1500-0.0000 ( 4423 PWs) bands (ev): -32.5484 -32.5484 -32.5276 -32.5276 -13.8504 -13.8504 -13.7785 -13.7785 -13.4915 -13.4915 -13.4573 -13.4573 -13.3991 -13.3991 -13.3886 -13.3886 -2.2850 -2.2850 -0.3572 -0.3572 2.6454 2.6454 4.4019 4.4019 4.7953 4.7953 5.0076 5.0076 5.1541 5.1541 5.3767 5.3767 5.4140 5.4140 5.8209 5.8209 5.8787 5.8787 6.4708 6.4708 6.6772 6.6772 6.8669 6.8669 6.9326 6.9326 7.9837 7.9837 8.0129 8.0129 8.8287 8.8287 9.6211 9.6211 10.5544 10.5544 11.0624 11.0624 11.2652 11.2652 k = 0.0000 0.1625-0.0000 ( 4425 PWs) bands (ev): -32.5480 -32.5480 -32.5277 -32.5277 -13.8504 -13.8504 -13.7802 -13.7802 -13.4914 -13.4914 -13.4583 -13.4583 -13.4002 -13.4002 -13.3890 -13.3890 -2.2546 -2.2546 -0.3525 -0.3525 2.6776 2.6776 4.4055 4.4055 4.7650 4.7650 5.0083 5.0083 5.1167 5.1167 5.3919 5.3919 5.4272 5.4272 5.8034 5.8034 5.8564 5.8564 6.4593 6.4593 6.6620 6.6620 6.8349 6.8349 6.8840 6.8840 7.9584 7.9584 8.0560 8.0560 8.8575 8.8575 9.5846 9.5846 10.5188 10.5188 11.0452 11.0452 11.2383 11.2383 k = 0.0000 0.1750-0.0000 ( 4428 PWs) bands (ev): -32.5476 -32.5476 -32.5278 -32.5278 -13.8505 -13.8505 -13.7821 -13.7821 -13.4913 -13.4913 -13.4593 -13.4593 -13.4015 -13.4015 -13.3894 -13.3894 -2.2218 -2.2218 -0.3481 -0.3481 2.7120 2.7120 4.4065 4.4065 4.7333 4.7333 5.0089 5.0089 5.0792 5.0792 5.4080 5.4080 5.4406 5.4406 5.7840 5.7840 5.8331 5.8331 6.4477 6.4477 6.6454 6.6454 6.8030 6.8030 6.8403 6.8403 7.9157 7.9157 8.1137 8.1137 8.8880 8.8880 9.5540 9.5540 10.4824 10.4824 11.0318 11.0319 11.2113 11.2113 k = 0.0000 0.1875-0.0000 ( 4430 PWs) bands (ev): -32.5472 -32.5472 -32.5279 -32.5279 -13.8505 -13.8505 -13.7840 -13.7840 -13.4912 -13.4912 -13.4602 -13.4602 -13.4028 -13.4028 -13.3897 -13.3897 -2.1869 -2.1869 -0.3441 -0.3441 2.7486 2.7486 4.4036 4.4036 4.7003 4.7003 5.0073 5.0073 5.0448 5.0448 5.4247 5.4247 5.4541 5.4541 5.7626 5.7626 5.8094 5.8094 6.4361 6.4361 6.6276 6.6276 6.7709 6.7709 6.8018 6.8018 7.8687 7.8687 8.1729 8.1729 8.9201 8.9201 9.5294 9.5294 10.4453 10.4453 11.0223 11.0223 11.1844 11.1844 k = 0.0000 0.2000-0.0000 ( 4434 PWs) bands (ev): -32.5468 -32.5468 -32.5280 -32.5280 -13.8506 -13.8506 -13.7861 -13.7861 -13.4912 -13.4912 -13.4612 -13.4612 -13.4042 -13.4042 -13.3900 -13.3900 -2.1499 -2.1499 -0.3407 -0.3407 2.7874 2.7874 4.3958 4.3958 4.6661 4.6661 4.9929 4.9929 5.0257 5.0257 5.4420 5.4420 5.4677 5.4677 5.7389 5.7389 5.7859 5.7859 6.4246 6.4246 6.6087 6.6087 6.7389 6.7389 6.7681 6.7681 7.8186 7.8186 8.2330 8.2330 8.9538 8.9538 9.5104 9.5104 10.4078 10.4078 11.0164 11.0164 11.1580 11.1580 k = 0.0000 0.2125-0.0000 ( 4432 PWs) bands (ev): -32.5464 -32.5464 -32.5281 -32.5281 -13.8506 -13.8506 -13.7882 -13.7882 -13.4912 -13.4912 -13.4621 -13.4621 -13.4056 -13.4056 -13.3903 -13.3903 -2.1107 -2.1107 -0.3381 -0.3381 2.8282 2.8282 4.3818 4.3818 4.6309 4.6309 4.9656 4.9656 5.0238 5.0238 5.4597 5.4597 5.4815 5.4815 5.7132 5.7132 5.7629 5.7629 6.4135 6.4135 6.5889 6.5889 6.7079 6.7079 6.7380 6.7380 7.7658 7.7658 8.2936 8.2936 8.9890 8.9890 9.4967 9.4967 10.3700 10.3700 11.0139 11.0139 11.1323 11.1323 k = 0.0000 0.2250-0.0000 ( 4428 PWs) bands (ev): -32.5460 -32.5460 -32.5282 -32.5282 -13.8507 -13.8507 -13.7904 -13.7904 -13.4912 -13.4912 -13.4630 -13.4630 -13.4070 -13.4070 -13.3906 -13.3906 -2.0696 -2.0696 -0.3364 -0.3364 2.8710 2.8710 4.3606 4.3606 4.5947 4.5947 4.9396 4.9396 5.0261 5.0261 5.4771 5.4771 5.4959 5.4959 5.6858 5.6858 5.7405 5.7405 6.4029 6.4029 6.5683 6.5683 6.6783 6.6783 6.7105 6.7105 7.7109 7.7109 8.3547 8.3547 9.0256 9.0256 9.4880 9.4880 10.3321 10.3321 11.0146 11.0146 11.1078 11.1078 k = 0.0000 0.2375-0.0000 ( 4428 PWs) bands (ev): -32.5455 -32.5455 -32.5284 -32.5284 -13.8507 -13.8507 -13.7927 -13.7927 -13.4913 -13.4913 -13.4639 -13.4639 -13.4083 -13.4083 -13.3910 -13.3910 -2.0265 -2.0265 -0.3360 -0.3360 2.9156 2.9156 4.3319 4.3319 4.5577 4.5577 4.9186 4.9186 5.0296 5.0296 5.4936 5.4936 5.5113 5.5113 5.6573 5.6573 5.7188 5.7188 6.3928 6.3928 6.5472 6.5472 6.6500 6.6500 6.6849 6.6849 7.6545 7.6545 8.4162 8.4162 9.0635 9.0635 9.4838 9.4838 10.2942 10.2942 11.0178 11.0178 11.0846 11.0846 k = 0.0000 0.2500-0.0000 ( 4432 PWs) bands (ev): -32.5450 -32.5450 -32.5285 -32.5285 -13.8507 -13.8507 -13.7951 -13.7951 -13.4914 -13.4914 -13.4648 -13.4648 -13.4096 -13.4096 -13.3914 -13.3914 -1.9815 -1.9815 -0.3369 -0.3369 2.9619 2.9619 4.2961 4.2961 4.5200 4.5200 4.9031 4.9031 5.0340 5.0340 5.5081 5.5081 5.5281 5.5281 5.6288 5.6288 5.6980 5.6980 6.3832 6.3832 6.5258 6.5258 6.6229 6.6229 6.6612 6.6612 7.5970 7.5970 8.4779 8.4779 9.1027 9.1027 9.4837 9.4837 10.2564 10.2564 11.0229 11.0229 11.0630 11.0630 k = 0.0000 0.2625-0.0000 ( 4422 PWs) bands (ev): -32.5445 -32.5445 -32.5287 -32.5287 -13.8506 -13.8506 -13.7975 -13.7975 -13.4915 -13.4915 -13.4657 -13.4657 -13.4107 -13.4107 -13.3918 -13.3918 -1.9348 -1.9348 -0.3394 -0.3394 3.0099 3.0099 4.2543 4.2543 4.4817 4.4817 4.8925 4.8925 5.0391 5.0391 5.5202 5.5202 5.5451 5.5451 5.6020 5.6020 5.6784 5.6784 6.3741 6.3741 6.5042 6.5042 6.5965 6.5965 6.6392 6.6392 7.5391 7.5391 8.5396 8.5396 9.1432 9.1432 9.4872 9.4872 10.2188 10.2188 11.0289 11.0289 11.0435 11.0435 k = 0.0000 0.2750-0.0000 ( 4418 PWs) bands (ev): -32.5440 -32.5440 -32.5289 -32.5289 -13.8506 -13.8506 -13.7999 -13.7999 -13.4917 -13.4917 -13.4666 -13.4666 -13.4117 -13.4117 -13.3922 -13.3922 -1.8863 -1.8863 -0.3436 -0.3436 3.0594 3.0594 4.2079 4.2079 4.4431 4.4431 4.8854 4.8854 5.0447 5.0447 5.5287 5.5287 5.5550 5.5550 5.5852 5.5852 5.6609 5.6609 6.3652 6.3652 6.4824 6.4824 6.5706 6.5706 6.6192 6.6192 7.4810 7.4810 8.6014 8.6014 9.1848 9.1848 9.4940 9.4940 10.1815 10.1815 11.0259 11.0259 11.0348 11.0348 k = 0.0000 0.2875-0.0000 ( 4416 PWs) bands (ev): -32.5435 -32.5435 -32.5291 -32.5291 -13.8505 -13.8505 -13.8024 -13.8024 -13.4918 -13.4918 -13.4675 -13.4675 -13.4126 -13.4126 -13.3927 -13.3927 -1.8362 -1.8362 -0.3499 -0.3499 3.1101 3.1101 4.1586 4.1586 4.4043 4.4043 4.8802 4.8802 5.0510 5.0510 5.5270 5.5270 5.5477 5.5477 5.5934 5.5934 5.6477 5.6477 6.3566 6.3566 6.4606 6.4606 6.5448 6.5448 6.6011 6.6011 7.4232 7.4232 8.6629 8.6629 9.2274 9.2274 9.5035 9.5035 10.1446 10.1446 11.0110 11.0110 11.0386 11.0386 k = 0.0000 0.3000-0.0000 ( 4412 PWs) bands (ev): -32.5430 -32.5430 -32.5293 -32.5293 -13.8504 -13.8504 -13.8049 -13.8049 -13.4920 -13.4920 -13.4685 -13.4685 -13.4134 -13.4134 -13.3932 -13.3932 -1.7846 -1.7846 -0.3584 -0.3584 3.1620 3.1620 4.1079 4.1079 4.3657 4.3657 4.8753 4.8753 5.0579 5.0579 5.5096 5.5096 5.5444 5.5444 5.6065 5.6065 5.6441 5.6441 6.3479 6.3479 6.4389 6.4389 6.5192 6.5192 6.5851 6.5851 7.3660 7.3660 8.7242 8.7242 9.2710 9.2710 9.5156 9.5156 10.1080 10.1080 10.9989 10.9989 11.0390 11.0390 k = 0.0000 0.3125-0.0000 ( 4412 PWs) bands (ev): -32.5425 -32.5425 -32.5295 -32.5295 -13.8502 -13.8502 -13.8074 -13.8074 -13.4921 -13.4921 -13.4695 -13.4695 -13.4140 -13.4140 -13.3938 -13.3938 -1.7317 -1.7317 -0.3693 -0.3693 3.2147 3.2147 4.0571 4.0571 4.3274 4.3274 4.8689 4.8689 5.0654 5.0654 5.4900 5.4900 5.5380 5.5380 5.6138 5.6138 5.6549 5.6549 6.3389 6.3389 6.4172 6.4172 6.4936 6.4936 6.5713 6.5713 7.3096 7.3096 8.7849 8.7849 9.3153 9.3153 9.5297 9.5297 10.0719 10.0719 10.9896 10.9896 11.0343 11.0343 k = 0.0000 0.3250-0.0000 ( 4416 PWs) bands (ev): -32.5419 -32.5419 -32.5297 -32.5297 -13.8500 -13.8500 -13.8099 -13.8099 -13.4922 -13.4922 -13.4705 -13.4705 -13.4144 -13.4144 -13.3945 -13.3945 -1.6774 -1.6774 -0.3828 -0.3828 3.2680 3.2680 4.0074 4.0074 4.2899 4.2899 4.8595 4.8595 5.0735 5.0735 5.4730 5.4730 5.5263 5.5263 5.6196 5.6196 5.6743 5.6743 6.3294 6.3294 6.3957 6.3957 6.4682 6.4682 6.5599 6.5599 7.2545 7.2545 8.8451 8.8451 9.3602 9.3602 9.5456 9.5456 10.0362 10.0362 10.9837 10.9837 11.0233 11.0233 k = 0.0000 0.3375-0.0000 ( 4420 PWs) bands (ev): -32.5414 -32.5414 -32.5300 -32.5300 -13.8498 -13.8498 -13.8124 -13.8124 -13.4923 -13.4923 -13.4716 -13.4716 -13.4147 -13.4147 -13.3952 -13.3952 -1.6221 -1.6221 -0.3990 -0.3990 3.3216 3.3216 3.9597 3.9597 4.2536 4.2536 4.8461 4.8461 5.0822 5.0822 5.4598 5.4598 5.5112 5.5112 5.6266 5.6266 5.6969 5.6969 6.3190 6.3190 6.3746 6.3746 6.4429 6.4429 6.5510 6.5510 7.2007 7.2007 8.9043 8.9043 9.4055 9.4055 9.5631 9.5631 10.0008 10.0008 10.9812 10.9812 11.0058 11.0058 k = 0.0000 0.3500-0.0000 ( 4420 PWs) bands (ev): -32.5409 -32.5409 -32.5302 -32.5302 -13.8495 -13.8495 -13.8149 -13.8149 -13.4923 -13.4923 -13.4727 -13.4727 -13.4147 -13.4147 -13.3959 -13.3959 -1.5657 -1.5657 -0.4180 -0.4180 3.3750 3.3750 3.9148 3.9148 4.2192 4.2192 4.8275 4.8275 5.0915 5.0915 5.4502 5.4502 5.4955 5.4955 5.6343 5.6343 5.7209 5.7209 6.3074 6.3074 6.3541 6.3541 6.4180 6.4180 6.5448 6.5448 7.1485 7.1485 8.9626 8.9626 9.4508 9.4508 9.5818 9.5818 9.9660 9.9660 10.9820 10.9820 10.9829 10.9829 k = 0.0000 0.3625-0.0000 ( 4426 PWs) bands (ev): -32.5403 -32.5403 -32.5305 -32.5305 -13.8491 -13.8491 -13.8173 -13.8173 -13.4923 -13.4923 -13.4739 -13.4739 -13.4147 -13.4147 -13.3967 -13.3967 -1.5084 -1.5084 -0.4401 -0.4401 3.4277 3.4277 3.8734 3.8734 4.1871 4.1871 4.8035 4.8035 5.1015 5.1015 5.4423 5.4423 5.4823 5.4823 5.6420 5.6420 5.7457 5.7457 6.2941 6.2941 6.3345 6.3345 6.3937 6.3937 6.5413 6.5413 7.0979 7.0979 9.0198 9.0198 9.4957 9.4957 9.6014 9.6014 9.9316 9.9316 10.9553 10.9553 10.9875 10.9875 k = 0.0000 0.3750-0.0000 ( 4422 PWs) bands (ev): -32.5398 -32.5398 -32.5308 -32.5308 -13.8487 -13.8487 -13.8197 -13.8197 -13.4922 -13.4922 -13.4751 -13.4751 -13.4144 -13.4144 -13.3975 -13.3975 -1.4505 -1.4505 -0.4652 -0.4652 3.4788 3.4788 3.8357 3.8357 4.1585 4.1585 4.7740 4.7740 5.1122 5.1122 5.4317 5.4317 5.4762 5.4762 5.6492 5.6492 5.7711 5.7711 6.2788 6.2788 6.3162 6.3162 6.3702 6.3702 6.5406 6.5406 7.0492 7.0492 9.0756 9.0756 9.5398 9.5398 9.6218 9.6218 9.8975 9.8975 10.9260 10.9260 10.9968 10.9968 k = 0.0000 0.3875-0.0000 ( 4420 PWs) bands (ev): -32.5392 -32.5392 -32.5311 -32.5311 -13.8481 -13.8481 -13.8220 -13.8220 -13.4920 -13.4920 -13.4764 -13.4764 -13.4141 -13.4141 -13.3983 -13.3983 -1.3920 -1.3920 -0.4935 -0.4935 3.5273 3.5273 3.8023 3.8023 4.1343 4.1343 4.7394 4.7394 5.1234 5.1234 5.4167 5.4167 5.4789 5.4789 5.6554 5.6554 5.7970 5.7970 6.2612 6.2612 6.2994 6.2994 6.3479 6.3479 6.5427 6.5427 7.0025 7.0025 9.1300 9.1300 9.5824 9.5824 9.6426 9.6426 9.8638 9.8638 10.8967 10.8967 11.0104 11.0104 k = 0.0000 0.4000-0.0000 ( 4420 PWs) bands (ev): -32.5387 -32.5387 -32.5315 -32.5315 -13.8475 -13.8475 -13.8243 -13.8243 -13.4917 -13.4917 -13.4776 -13.4776 -13.4136 -13.4136 -13.3992 -13.3992 -1.3332 -1.3332 -0.5248 -0.5248 3.5719 3.5719 3.7732 3.7732 4.1161 4.1161 4.7002 4.7002 5.1353 5.1353 5.3990 5.3990 5.4880 5.4880 5.6603 5.6603 5.8233 5.8233 6.2416 6.2416 6.2840 6.2840 6.3272 6.3272 6.5476 6.5476 6.9577 6.9577 9.1828 9.1828 9.6226 9.6226 9.6635 9.6635 9.8306 9.8306 10.8696 10.8696 11.0284 11.0284 k = 0.0000 0.4125-0.0000 ( 4414 PWs) bands (ev): -32.5382 -32.5382 -32.5318 -32.5318 -13.8469 -13.8469 -13.8264 -13.8264 -13.4914 -13.4914 -13.4788 -13.4788 -13.4130 -13.4130 -13.4001 -13.4001 -1.2742 -1.2742 -0.5592 -0.5592 3.6110 3.6110 3.7487 3.7487 4.1058 4.1058 4.6571 4.6571 5.1479 5.1479 5.3803 5.3803 5.5012 5.5012 5.6635 5.6635 5.8499 5.8499 6.2201 6.2201 6.2701 6.2701 6.3082 6.3082 6.5552 6.5552 6.9151 6.9151 9.2339 9.2339 9.6594 9.6594 9.6843 9.6843 9.7980 9.7980 10.8463 10.8463 11.0509 11.0509 k = 0.0000 0.4250-0.0000 ( 4414 PWs) bands (ev): -32.5377 -32.5377 -32.5322 -32.5322 -13.8461 -13.8461 -13.8285 -13.8285 -13.4910 -13.4910 -13.4801 -13.4801 -13.4123 -13.4123 -13.4010 -13.4010 -1.2153 -1.2153 -0.5966 -0.5966 3.6426 3.6426 3.7287 3.7287 4.1051 4.1051 4.6107 4.6107 5.1611 5.1611 5.3612 5.3612 5.5170 5.5170 5.6648 5.6648 5.8768 5.8768 6.1971 6.1971 6.2578 6.2578 6.2912 6.2912 6.5654 6.5654 6.8745 6.8745 9.2832 9.2832 9.6898 9.6898 9.7049 9.7049 9.7675 9.7675 10.8284 10.8284 11.0780 11.0780 k = 0.0000 0.4375-0.0000 ( 4406 PWs) bands (ev): -32.5371 -32.5371 -32.5326 -32.5326 -13.8452 -13.8452 -13.8305 -13.8305 -13.4905 -13.4905 -13.4813 -13.4813 -13.4115 -13.4115 -13.4020 -13.4020 -1.1567 -1.1567 -0.6368 -0.6368 3.6657 3.6657 3.7131 3.7131 4.1155 4.1155 4.5618 4.5618 5.1748 5.1748 5.3423 5.3423 5.5344 5.5344 5.6637 5.6637 5.9039 5.9039 6.1729 6.1729 6.2473 6.2473 6.2763 6.2763 6.5782 6.5782 6.8361 6.8361 9.3308 9.3308 9.7023 9.7023 9.7262 9.7262 9.7486 9.7486 10.8174 10.8174 11.1092 11.1096 k = 0.0000 0.4500-0.0000 ( 4416 PWs) bands (ev): -32.5366 -32.5366 -32.5330 -32.5330 -13.8442 -13.8442 -13.8325 -13.8325 -13.4899 -13.4899 -13.4825 -13.4825 -13.4107 -13.4107 -13.4030 -13.4030 -1.0985 -1.0985 -0.6799 -0.6799 3.6800 3.6800 3.7019 3.7019 4.1371 4.1371 4.5110 4.5110 5.1892 5.1892 5.3235 5.3235 5.5526 5.5526 5.6601 5.6601 5.9311 5.9311 6.1477 6.1477 6.2390 6.2390 6.2633 6.2633 6.5933 6.5933 6.8000 6.8000 9.3765 9.3765 9.6827 9.6827 9.7445 9.7445 9.7574 9.7574 10.8141 10.8141 11.0800 11.0800 k = 0.0000 0.4625-0.0000 ( 4416 PWs) bands (ev): -32.5361 -32.5361 -32.5334 -32.5334 -13.8431 -13.8431 -13.8343 -13.8343 -13.4892 -13.4892 -13.4836 -13.4836 -13.4099 -13.4099 -13.4040 -13.4040 -1.0411 -1.0411 -0.7254 -0.7254 3.6868 3.6868 3.6948 3.6948 4.1687 4.1687 4.4589 4.4589 5.2041 5.2041 5.3051 5.3051 5.5710 5.5710 5.6541 5.6541 5.9585 5.9585 6.1217 6.1217 6.2331 6.2331 6.2522 6.2522 6.6109 6.6109 6.7660 6.7660 9.4205 9.4205 9.6509 9.6509 9.7600 9.7600 9.7726 9.7726 10.8197 10.8197 11.0252 11.0252 k = 0.0000 0.4750-0.0000 ( 4424 PWs) bands (ev): -32.5357 -32.5357 -32.5338 -32.5338 -13.8419 -13.8419 -13.8361 -13.8361 -13.4885 -13.4885 -13.4848 -13.4848 -13.4090 -13.4090 -13.4050 -13.4050 -0.9847 -0.9847 -0.7734 -0.7734 3.6879 3.6879 3.6917 3.6917 4.2083 4.2083 4.4063 4.4063 5.2196 5.2196 5.2870 5.2870 5.5889 5.5889 5.6454 5.6454 5.9859 5.9859 6.0950 6.0950 6.2300 6.2300 6.2431 6.2431 6.6309 6.6309 6.7344 6.7344 9.4627 9.4627 9.6162 9.6162 9.7730 9.7730 9.7834 9.7834 10.8342 10.8342 10.9743 10.9743 k = 0.0000 0.4875-0.0000 ( 4428 PWs) bands (ev): -32.5352 -32.5352 -32.5343 -32.5343 -13.8407 -13.8407 -13.8377 -13.8377 -13.4877 -13.4877 -13.4858 -13.4858 -13.4080 -13.4080 -13.4060 -13.4060 -0.9294 -0.9294 -0.8236 -0.8236 3.6875 3.6875 3.6901 3.6901 4.2535 4.2535 4.3538 4.3538 5.2357 5.2357 5.2694 5.2694 5.6057 5.6057 5.6343 5.6343 6.0133 6.0133 6.0680 6.0680 6.2294 6.2294 6.2362 6.2362 6.6533 6.6533 6.7050 6.7050 9.5032 9.5032 9.5800 9.5800 9.7827 9.7827 9.7886 9.7886 10.8577 10.8577 10.9287 10.9287 k = 0.0000 0.5000-0.0000 ( 4420 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4867 -13.4867 -13.4867 -13.4867 -13.4070 -13.4070 -13.4070 -13.4070 -0.8756 -0.8756 -0.8756 -0.8756 3.6885 3.6885 3.6885 3.6885 4.3025 4.3025 4.3025 4.3025 5.2523 5.2523 5.2523 5.2523 5.6210 5.6210 5.6210 5.6210 6.0408 6.0408 6.0408 6.0408 6.2316 6.2316 6.2316 6.2316 6.6780 6.6780 6.6780 6.6780 9.5423 9.5423 9.5423 9.5423 9.7882 9.7882 9.7882 9.7882 10.8894 10.8894 10.8894 10.8894 k = 0.0000 0.5000-0.0000 ( 4420 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4867 -13.4867 -13.4867 -13.4867 -13.4070 -13.4070 -13.4070 -13.4070 -0.8756 -0.8756 -0.8756 -0.8756 3.6885 3.6885 3.6885 3.6885 4.3025 4.3025 4.3025 4.3025 5.2523 5.2523 5.2523 5.2523 5.6210 5.6210 5.6210 5.6210 6.0408 6.0408 6.0408 6.0408 6.2316 6.2316 6.2316 6.2316 6.6780 6.6780 6.6780 6.6780 9.5423 9.5423 9.5423 9.5423 9.7882 9.7882 9.7882 9.7882 10.8894 10.8894 10.8894 10.8894 k = 0.0125 0.5000-0.0000 ( 4416 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8395 -13.8395 -13.8389 -13.8389 -13.4881 -13.4881 -13.4854 -13.4854 -13.4081 -13.4081 -13.4060 -13.4060 -0.8748 -0.8748 -0.8747 -0.8747 3.6884 3.6884 3.6892 3.6892 4.3022 4.3022 4.3034 4.3034 5.2523 5.2523 5.2528 5.2528 5.6179 5.6179 5.6243 5.6243 6.0373 6.0373 6.0419 6.0419 6.2318 6.2318 6.2342 6.2342 6.6769 6.6769 6.6788 6.6788 9.5159 9.5159 9.5337 9.5337 9.7818 9.7818 9.7997 9.7997 10.8914 10.8914 10.8918 10.8918 k = 0.0250 0.5000-0.0000 ( 4408 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8399 -13.8399 -13.8386 -13.8386 -13.4894 -13.4894 -13.4841 -13.4841 -13.4092 -13.4092 -13.4052 -13.4052 -0.8722 -0.8722 -0.8721 -0.8721 3.6889 3.6889 3.6905 3.6905 4.3025 4.3025 4.3048 4.3048 5.2527 5.2527 5.2538 5.2538 5.6147 5.6147 5.6276 5.6276 6.0317 6.0317 6.0406 6.0406 6.2346 6.2346 6.2392 6.2392 6.6754 6.6754 6.6793 6.6793 9.4630 9.4630 9.4918 9.4918 9.7793 9.7793 9.8080 9.8080 10.8977 10.8977 10.8985 10.8985 k = 0.0375 0.5000-0.0000 ( 4402 PWs) bands (ev): -32.5346 -32.5346 -32.5346 -32.5346 -13.8402 -13.8402 -13.8384 -13.8384 -13.4908 -13.4908 -13.4828 -13.4828 -13.4106 -13.4106 -13.4045 -13.4045 -0.8679 -0.8679 -0.8677 -0.8677 3.6899 3.6899 3.6923 3.6923 4.3033 4.3033 4.3067 4.3067 5.2535 5.2535 5.2553 5.2553 5.6117 5.6117 5.6309 5.6309 6.0242 6.0242 6.0371 6.0371 6.2398 6.2398 6.2463 6.2463 6.6735 6.6735 6.6794 6.6794 9.3923 9.3923 9.4265 9.4265 9.7721 9.7721 9.8055 9.8055 10.9084 10.9084 10.9098 10.9098 k = 0.0500 0.5000-0.0000 ( 4408 PWs) bands (ev): -32.5346 -32.5346 -32.5346 -32.5346 -13.8406 -13.8406 -13.8382 -13.8382 -13.4922 -13.4922 -13.4816 -13.4816 -13.4120 -13.4120 -13.4039 -13.4039 -0.8619 -0.8619 -0.8616 -0.8616 3.6913 3.6913 3.6945 3.6945 4.3048 4.3048 4.3092 4.3092 5.2548 5.2548 5.2574 5.2574 5.6087 5.6087 5.6340 5.6340 6.0154 6.0154 6.0319 6.0319 6.2470 6.2470 6.2550 6.2550 6.6712 6.6712 6.6791 6.6791 9.3099 9.3099 9.3464 9.3464 9.7539 9.7539 9.7884 9.7884 10.9235 10.9235 10.9254 10.9254 k = 0.0625 0.5000-0.0000 ( 4422 PWs) bands (ev): -32.5346 -32.5346 -32.5346 -32.5346 -13.8411 -13.8411 -13.8381 -13.8381 -13.4936 -13.4936 -13.4804 -13.4804 -13.4136 -13.4136 -13.4035 -13.4035 -0.8542 -0.8542 -0.8537 -0.8537 3.6931 3.6931 3.6971 3.6971 4.3068 4.3068 4.3124 4.3124 5.2566 5.2566 5.2601 5.2601 5.6059 5.6059 5.6370 5.6370 6.0056 6.0056 6.0253 6.0253 6.2556 6.2556 6.2649 6.2649 6.6685 6.6685 6.6785 6.6785 9.2194 9.2194 9.2568 9.2568 9.7227 9.7227 9.7562 9.7562 10.9423 10.9423 10.9447 10.9447 k = 0.0750 0.5000-0.0000 ( 4410 PWs) bands (ev): -32.5345 -32.5345 -32.5345 -32.5345 -13.8415 -13.8415 -13.8379 -13.8379 -13.4950 -13.4950 -13.4791 -13.4791 -13.4153 -13.4153 -13.4032 -13.4032 -0.8448 -0.8448 -0.8442 -0.8442 3.6949 3.6949 3.6999 3.6999 4.3097 4.3097 4.3162 4.3162 5.2591 5.2591 5.2637 5.2637 5.6032 5.6032 5.6399 5.6399 5.9952 5.9952 6.0178 6.0178 6.2654 6.2654 6.2757 6.2757 6.6655 6.6655 6.6778 6.6778 9.1235 9.1235 9.1610 9.1610 9.6787 9.6787 9.7103 9.7103 10.9636 10.9636 10.9665 10.9665 k = 0.0875 0.5000-0.0000 ( 4406 PWs) bands (ev): -32.5344 -32.5344 -32.5344 -32.5344 -13.8419 -13.8419 -13.8378 -13.8378 -13.4963 -13.4963 -13.4779 -13.4779 -13.4171 -13.4171 -13.4030 -13.4030 -0.8337 -0.8337 -0.8331 -0.8331 3.6967 3.6967 3.7026 3.7026 4.3133 4.3133 4.3207 4.3207 5.2623 5.2623 5.2683 5.2683 5.6008 5.6008 5.6426 5.6426 5.9845 5.9845 6.0097 6.0097 6.2757 6.2757 6.2870 6.2870 6.6621 6.6621 6.6767 6.6767 9.0240 9.0240 9.0613 9.0613 9.6237 9.6237 9.6528 9.6528 10.9865 10.9865 10.9896 10.9896 k = 0.1000 0.5000-0.0000 ( 4406 PWs) bands (ev): -32.5343 -32.5343 -32.5343 -32.5343 -13.8424 -13.8424 -13.8377 -13.8377 -13.4977 -13.4977 -13.4768 -13.4768 -13.4190 -13.4190 -13.4029 -13.4029 -0.8210 -0.8210 -0.8203 -0.8203 3.6982 3.6982 3.7050 3.7050 4.3178 4.3178 4.3260 4.3260 5.2663 5.2663 5.2738 5.2738 5.5983 5.5983 5.6449 5.6449 5.9738 5.9738 6.0013 6.0013 6.2862 6.2862 6.2985 6.2985 6.6584 6.6584 6.6754 6.6754 8.9225 8.9225 8.9592 8.9592 9.5596 9.5596 9.5861 9.5861 11.0100 11.0100 11.0132 11.0132 k = 0.1125 0.5000-0.0000 ( 4410 PWs) bands (ev): -32.5342 -32.5342 -32.5342 -32.5342 -13.8429 -13.8429 -13.8377 -13.8377 -13.4991 -13.4991 -13.4757 -13.4757 -13.4210 -13.4210 -13.4029 -13.4029 -0.8068 -0.8068 -0.8060 -0.8060 3.6992 3.6992 3.7069 3.7069 4.3233 4.3233 4.3323 4.3323 5.2712 5.2712 5.2805 5.2805 5.5960 5.5960 5.6470 5.6470 5.9631 5.9631 5.9927 5.9927 6.2967 6.2967 6.3099 6.3099 6.6543 6.6543 6.6739 6.6739 8.8200 8.8200 8.8560 8.8560 9.4884 9.4884 9.5122 9.5122 11.0334 11.0334 11.0366 11.0366 k = 0.1250 0.5000-0.0000 ( 4418 PWs) bands (ev): -32.5341 -32.5341 -32.5341 -32.5341 -13.8434 -13.8434 -13.8378 -13.8378 -13.5004 -13.5004 -13.4746 -13.4746 -13.4231 -13.4231 -13.4031 -13.4031 -0.7910 -0.7910 -0.7901 -0.7901 3.6992 3.6992 3.7080 3.7080 4.3299 4.3299 4.3395 4.3395 5.2772 5.2772 5.2885 5.2885 5.5936 5.5936 5.6485 5.6485 5.9527 5.9527 5.9843 5.9843 6.3068 6.3068 6.3210 6.3210 6.6499 6.6499 6.6722 6.6722 8.7177 8.7177 8.7529 8.7529 9.4117 9.4117 9.4330 9.4330 11.0564 11.0564 11.0595 11.0595 k = 0.1375 0.5000-0.0000 ( 4410 PWs) bands (ev): -32.5340 -32.5340 -32.5340 -32.5340 -13.8439 -13.8439 -13.8378 -13.8378 -13.5017 -13.5017 -13.4736 -13.4736 -13.4252 -13.4252 -13.4033 -13.4033 -0.7737 -0.7737 -0.7727 -0.7727 3.6982 3.6982 3.7080 3.7080 4.3378 4.3378 4.3479 4.3479 5.2844 5.2844 5.2978 5.2978 5.5915 5.5915 5.6499 5.6499 5.9427 5.9427 5.9762 5.9762 6.3163 6.3163 6.3316 6.3316 6.6452 6.6452 6.6704 6.6704 8.6163 8.6163 8.6505 8.6505 9.3311 9.3311 9.3500 9.3500 11.0788 11.0788 11.0819 11.0819 k = 0.1500 0.5000-0.0000 ( 4422 PWs) bands (ev): -32.5339 -32.5339 -32.5339 -32.5339 -13.8445 -13.8445 -13.8380 -13.8380 -13.5030 -13.5030 -13.4727 -13.4727 -13.4273 -13.4273 -13.4036 -13.4036 -0.7550 -0.7550 -0.7539 -0.7539 3.6958 3.6958 3.7066 3.7066 4.3471 4.3471 4.3576 4.3576 5.2928 5.2928 5.3085 5.3085 5.5895 5.5895 5.6508 5.6508 5.9330 5.9330 5.9683 5.9683 6.3249 6.3249 6.3414 6.3414 6.6404 6.6404 6.6686 6.6686 8.5165 8.5165 8.5496 8.5496 9.2477 9.2477 9.2642 9.2642 11.1003 11.1003 11.1033 11.1033 k = 0.1625 0.5000-0.0000 ( 4420 PWs) bands (ev): -32.5337 -32.5337 -32.5337 -32.5337 -13.8450 -13.8450 -13.8382 -13.8382 -13.5042 -13.5042 -13.4717 -13.4717 -13.4295 -13.4295 -13.4040 -13.4040 -0.7349 -0.7349 -0.7338 -0.7338 3.6916 3.6916 3.7034 3.7034 4.3578 4.3578 4.3686 4.3686 5.3025 5.3025 5.3207 5.3207 5.5876 5.5876 5.6514 5.6514 5.9240 5.9240 5.9608 5.9608 6.3326 6.3326 6.3503 6.3503 6.6355 6.6355 6.6668 6.6668 8.4189 8.4189 8.4509 8.4509 9.1623 9.1623 9.1766 9.1766 11.1207 11.1207 11.1237 11.1237 k = 0.1750 0.5000-0.0000 ( 4424 PWs) bands (ev): -32.5336 -32.5336 -32.5336 -32.5336 -13.8456 -13.8456 -13.8384 -13.8384 -13.5054 -13.5054 -13.4709 -13.4709 -13.4317 -13.4317 -13.4046 -13.4046 -0.7135 -0.7135 -0.7123 -0.7123 3.6856 3.6856 3.6984 3.6984 4.3702 4.3702 4.3811 4.3811 5.3136 5.3136 5.3344 5.3344 5.5859 5.5859 5.6517 5.6517 5.9155 5.9155 5.9538 5.9538 6.3390 6.3390 6.3579 6.3579 6.6306 6.6306 6.6651 6.6651 8.3242 8.3242 8.3548 8.3548 9.0757 9.0757 9.0880 9.0880 11.1396 11.1396 11.1427 11.1427 k = 0.1875 0.5000-0.0000 ( 4426 PWs) bands (ev): -32.5335 -32.5335 -32.5335 -32.5335 -13.8462 -13.8462 -13.8387 -13.8387 -13.5066 -13.5066 -13.4701 -13.4701 -13.4339 -13.4339 -13.4051 -13.4051 -0.6910 -0.6910 -0.6897 -0.6897 3.6775 3.6775 3.6911 3.6911 4.3842 4.3842 4.3952 4.3952 5.3261 5.3261 5.3494 5.3494 5.5843 5.5843 5.6517 5.6517 5.9077 5.9077 5.9473 5.9473 6.3441 6.3441 6.3641 6.3641 6.6259 6.6259 6.6635 6.6635 8.2327 8.2327 8.2618 8.2618 8.9886 8.9886 8.9989 8.9989 11.1567 11.1567 11.1598 11.1598 k = 0.2000 0.5000-0.0000 ( 4422 PWs) bands (ev): -32.5333 -32.5333 -32.5333 -32.5333 -13.8467 -13.8467 -13.8390 -13.8390 -13.5076 -13.5076 -13.4695 -13.4695 -13.4361 -13.4361 -13.4058 -13.4058 -0.6673 -0.6673 -0.6659 -0.6659 3.6671 3.6671 3.6815 3.6815 4.3999 4.3999 4.4109 4.4109 5.3398 5.3398 5.3659 5.3659 5.5831 5.5831 5.6515 5.6515 5.9006 5.9006 5.9413 5.9413 6.3478 6.3478 6.3688 6.3688 6.6215 6.6215 6.6621 6.6621 8.1448 8.1448 8.1724 8.1724 8.9014 8.9014 8.9099 8.9099 11.1716 11.1716 11.1748 11.1748 k = 0.2125 0.5000-0.0000 ( 4430 PWs) bands (ev): -32.5332 -32.5332 -32.5332 -32.5332 -13.8473 -13.8473 -13.8395 -13.8395 -13.5086 -13.5086 -13.4689 -13.4689 -13.4382 -13.4382 -13.4065 -13.4065 -0.6426 -0.6426 -0.6412 -0.6412 3.6544 3.6544 3.6695 3.6695 4.4173 4.4173 4.4281 4.4281 5.3548 5.3548 5.3836 5.3836 5.5822 5.5822 5.6512 5.6512 5.8941 5.8941 5.9359 5.9359 6.3499 6.3499 6.3715 6.3715 6.6176 6.6176 6.6609 6.6609 8.0608 8.0608 8.0866 8.0866 8.8145 8.8145 8.8214 8.8214 11.1835 11.1835 11.1869 11.1869 k = 0.2250 0.5000-0.0000 ( 4436 PWs) bands (ev): -32.5330 -32.5330 -32.5330 -32.5330 -13.8479 -13.8479 -13.8399 -13.8399 -13.5096 -13.5096 -13.4686 -13.4686 -13.4401 -13.4401 -13.4073 -13.4073 -0.6169 -0.6169 -0.6155 -0.6155 3.6394 3.6394 3.6550 3.6550 4.4362 4.4362 4.4469 4.4469 5.3708 5.3708 5.4023 5.4023 5.5817 5.5817 5.6511 5.6511 5.8883 5.8883 5.9310 5.9310 6.3504 6.3504 6.3723 6.3723 6.6142 6.6142 6.6599 6.6599 7.9809 7.9809 8.0048 8.0048 8.7284 8.7284 8.7337 8.7337 11.1920 11.1920 11.1955 11.1955 k = 0.2375 0.5000-0.0000 ( 4430 PWs) bands (ev): -32.5329 -32.5329 -32.5329 -32.5329 -13.8485 -13.8485 -13.8404 -13.8404 -13.5104 -13.5104 -13.4684 -13.4684 -13.4419 -13.4419 -13.4082 -13.4082 -0.5905 -0.5905 -0.5890 -0.5890 3.6221 3.6221 3.6381 3.6381 4.4567 4.4567 4.4672 4.4672 5.3877 5.3877 5.4217 5.4217 5.5820 5.5820 5.6512 5.6512 5.8833 5.8833 5.9269 5.9269 6.3496 6.3496 6.3712 6.3712 6.6116 6.6116 6.6592 6.6592 7.9052 7.9052 7.9272 7.9272 8.6435 8.6435 8.6472 8.6472 11.1963 11.1963 11.2000 11.2000 k = 0.2500 0.5000-0.0000 ( 4434 PWs) bands (ev): -32.5327 -32.5327 -32.5327 -32.5327 -13.8491 -13.8491 -13.8409 -13.8409 -13.5111 -13.5111 -13.4684 -13.4684 -13.4435 -13.4435 -13.4091 -13.4091 -0.5634 -0.5634 -0.5619 -0.5619 3.6026 3.6026 3.6189 3.6189 4.4785 4.4785 4.4888 4.4888 5.4051 5.4051 5.4415 5.4415 5.5829 5.5829 5.6518 5.6518 5.8791 5.8791 5.9233 5.9233 6.3475 6.3475 6.3683 6.3683 6.6096 6.6096 6.6587 6.6587 7.8338 7.8338 7.8536 7.8536 8.5599 8.5599 8.5622 8.5622 11.1957 11.1957 11.1997 11.1997 k = 0.2625 0.5000-0.0000 ( 4434 PWs) bands (ev): -32.5325 -32.5325 -32.5325 -32.5325 -13.8497 -13.8497 -13.8415 -13.8415 -13.5118 -13.5118 -13.4688 -13.4688 -13.4447 -13.4447 -13.4100 -13.4100 -0.5358 -0.5358 -0.5342 -0.5342 3.5811 3.5811 3.5974 3.5974 4.5015 4.5015 4.5115 4.5115 5.4225 5.4225 5.4611 5.4611 5.5849 5.5849 5.6533 5.6533 5.8757 5.8757 5.9205 5.9205 6.3443 6.3443 6.3638 6.3638 6.6084 6.6084 6.6583 6.6583 7.7667 7.7667 7.7842 7.7842 8.4781 8.4781 8.4791 8.4791 11.1899 11.1899 11.1942 11.1942 k = 0.2750 0.5000-0.0000 ( 4450 PWs) bands (ev): -32.5324 -32.5324 -32.5324 -32.5324 -13.8503 -13.8503 -13.8422 -13.8422 -13.5124 -13.5124 -13.4695 -13.4695 -13.4457 -13.4457 -13.4111 -13.4111 -0.5077 -0.5077 -0.5061 -0.5061 3.5578 3.5578 3.5740 3.5740 4.5254 4.5254 4.5351 4.5351 5.4395 5.4395 5.4799 5.4799 5.5881 5.5881 5.6558 5.6558 5.8732 5.8732 5.9183 5.9183 6.3404 6.3404 6.3581 6.3581 6.6076 6.6076 6.6580 6.6580 7.7034 7.7034 7.7187 7.7187 8.3980 8.3980 8.3982 8.3982 11.1784 11.1784 11.1828 11.1828 k = 0.2875 0.5000-0.0000 ( 4450 PWs) bands (ev): -32.5322 -32.5322 -32.5322 -32.5322 -13.8508 -13.8508 -13.8429 -13.8429 -13.5128 -13.5128 -13.4705 -13.4705 -13.4463 -13.4463 -13.4121 -13.4121 -0.4795 -0.4795 -0.4779 -0.4779 3.5329 3.5329 3.5490 3.5490 4.5501 4.5501 4.5594 4.5594 5.4556 5.4556 5.4972 5.4972 5.5929 5.5929 5.6598 5.6598 5.8718 5.8718 5.9170 5.9170 6.3363 6.3363 6.3518 6.3518 6.6074 6.6074 6.6576 6.6576 7.6440 7.6440 7.6569 7.6569 8.3195 8.3195 8.3209 8.3209 11.1611 11.1611 11.1657 11.1657 k = 0.3000 0.5000-0.0000 ( 4466 PWs) bands (ev): -32.5321 -32.5321 -32.5321 -32.5321 -13.8514 -13.8514 -13.8436 -13.8436 -13.5132 -13.5132 -13.4718 -13.4718 -13.4466 -13.4466 -13.4132 -13.4132 -0.4512 -0.4512 -0.4495 -0.4495 3.5067 3.5067 3.5224 3.5224 4.5752 4.5752 4.5842 4.5842 5.4700 5.4700 5.5123 5.5123 5.5995 5.5995 5.6654 5.6654 5.8716 5.8716 5.9162 5.9162 6.3324 6.3324 6.3454 6.3454 6.6074 6.6074 6.6571 6.6571 7.5880 7.5880 7.5986 7.5986 8.2438 8.2438 8.2462 8.2462 11.1381 11.1381 11.1429 11.1429 k = 0.3125 0.5000-0.0000 ( 4458 PWs) bands (ev): -32.5319 -32.5319 -32.5319 -32.5319 -13.8519 -13.8519 -13.8443 -13.8443 -13.5134 -13.5134 -13.4733 -13.4733 -13.4465 -13.4465 -13.4143 -13.4143 -0.4230 -0.4230 -0.4214 -0.4214 3.4796 3.4796 3.4948 3.4948 4.6007 4.6007 4.6093 4.6093 5.4826 5.4826 5.5248 5.5248 5.6079 5.6079 5.6725 5.6725 5.8729 5.8729 5.9163 5.9163 6.3294 6.3294 6.3398 6.3398 6.6076 6.6076 6.6565 6.6565 7.5349 7.5349 7.5433 7.5433 8.1714 8.1714 8.1747 8.1747 11.1100 11.1100 11.1150 11.1150 k = 0.3250 0.5000-0.0000 ( 4454 PWs) bands (ev): -32.5318 -32.5318 -32.5318 -32.5318 -13.8523 -13.8523 -13.8450 -13.8450 -13.5134 -13.5134 -13.4751 -13.4751 -13.4463 -13.4463 -13.4154 -13.4154 -0.3951 -0.3951 -0.3935 -0.3935 3.4519 3.4519 3.4664 3.4664 4.6261 4.6261 4.6343 4.6343 5.4932 5.4932 5.5345 5.5345 5.6178 5.6178 5.6805 5.6805 5.8759 5.8759 5.9170 5.9170 6.3279 6.3279 6.3355 6.3355 6.6079 6.6079 6.6556 6.6556 7.4843 7.4843 7.4905 7.4905 8.1027 8.1027 8.1068 8.1068 11.0776 11.0776 11.0826 11.0826 k = 0.3375 0.5000-0.0000 ( 4454 PWs) bands (ev): -32.5317 -32.5317 -32.5317 -32.5317 -13.8528 -13.8528 -13.8458 -13.8458 -13.5134 -13.5134 -13.4770 -13.4770 -13.4458 -13.4458 -13.4165 -13.4165 -0.3678 -0.3678 -0.3662 -0.3662 3.4238 3.4238 3.4377 3.4377 4.6513 4.6513 4.6589 4.6589 5.5017 5.5017 5.5417 5.5417 5.6287 5.6287 5.6887 5.6887 5.8805 5.8805 5.9184 5.9184 6.3286 6.3286 6.3334 6.3334 6.6081 6.6081 6.6543 6.6543 7.4355 7.4355 7.4398 7.4398 8.0379 8.0379 8.0427 8.0427 11.0418 11.0418 11.0468 11.0468 k = 0.3500 0.5000-0.0000 ( 4454 PWs) bands (ev): -32.5315 -32.5315 -32.5315 -32.5315 -13.8532 -13.8532 -13.8466 -13.8466 -13.5132 -13.5132 -13.4790 -13.4790 -13.4452 -13.4452 -13.4177 -13.4177 -0.3411 -0.3411 -0.3396 -0.3396 3.3958 3.3958 3.4089 3.4089 4.6759 4.6759 4.6831 4.6831 5.5087 5.5087 5.5467 5.5467 5.6398 5.6398 5.6961 5.6961 5.8866 5.8866 5.9201 5.9201 6.3321 6.3321 6.3344 6.3344 6.6081 6.6081 6.6528 6.6528 7.3879 7.3879 7.3905 7.3905 7.9778 7.9778 7.9830 7.9830 11.0037 11.0037 11.0086 11.0086 k = 0.3625 0.5000-0.0000 ( 4458 PWs) bands (ev): -32.5314 -32.5314 -32.5314 -32.5314 -13.8536 -13.8536 -13.8473 -13.8473 -13.5130 -13.5130 -13.4811 -13.4811 -13.4445 -13.4445 -13.4189 -13.4189 -0.3155 -0.3155 -0.3140 -0.3140 3.3683 3.3683 3.3805 3.3805 4.6997 4.6997 4.7064 4.7064 5.5144 5.5144 5.5501 5.5501 5.6506 5.6506 5.7022 5.7022 5.8939 5.8939 5.9221 5.9221 6.3390 6.3390 6.3391 6.3391 6.6080 6.6080 6.6509 6.6509 7.3411 7.3411 7.3421 7.3421 7.9225 7.9225 7.9279 7.9279 10.9643 10.9643 10.9690 10.9690 k = 0.3750 0.5000-0.0000 ( 4458 PWs) bands (ev): -32.5313 -32.5313 -32.5313 -32.5313 -13.8539 -13.8539 -13.8481 -13.8481 -13.5126 -13.5126 -13.4832 -13.4832 -13.4436 -13.4436 -13.4201 -13.4201 -0.2910 -0.2910 -0.2896 -0.2896 3.3416 3.3416 3.3528 3.3528 4.7225 4.7225 4.7286 4.7286 5.5193 5.5193 5.5523 5.5523 5.6605 5.6605 5.7066 5.7066 5.9018 5.9018 5.9242 5.9242 6.3481 6.3481 6.3497 6.3497 6.6078 6.6078 6.6487 6.6487 7.2942 7.2942 7.2945 7.2945 7.8725 7.8725 7.8780 7.8780 10.9247 10.9247 10.9293 10.9293 k = 0.3875 0.5000-0.0000 ( 4456 PWs) bands (ev): -32.5312 -32.5312 -32.5312 -32.5312 -13.8542 -13.8542 -13.8488 -13.8488 -13.5121 -13.5121 -13.4852 -13.4852 -13.4427 -13.4427 -13.4214 -13.4214 -0.2679 -0.2679 -0.2666 -0.2666 3.3160 3.3160 3.3263 3.3263 4.7441 4.7441 4.7495 4.7495 5.5235 5.5235 5.5536 5.5536 5.6692 5.6692 5.7093 5.7093 5.9095 5.9095 5.9262 5.9262 6.3618 6.3618 6.3645 6.3645 6.6074 6.6074 6.6463 6.6463 7.2465 7.2465 7.2478 7.2478 7.8280 7.8280 7.8334 7.8334 10.8860 10.8860 10.8903 10.8903 k = 0.4000 0.5000-0.0000 ( 4460 PWs) bands (ev): -32.5311 -32.5311 -32.5311 -32.5311 -13.8544 -13.8544 -13.8496 -13.8496 -13.5114 -13.5114 -13.4873 -13.4873 -13.4418 -13.4418 -13.4226 -13.4226 -0.2465 -0.2465 -0.2453 -0.2453 3.2921 3.2921 3.3013 3.3013 4.7640 4.7640 4.7688 4.7688 5.5273 5.5273 5.5543 5.5543 5.6764 5.6764 5.7105 5.7105 5.9164 5.9164 5.9279 5.9279 6.3802 6.3802 6.3832 6.3832 6.6069 6.6069 6.6437 6.6437 7.1988 7.1988 7.2010 7.2010 7.7890 7.7890 7.7941 7.7941 10.8490 10.8490 10.8530 10.8530 k = 0.4125 0.5000-0.0000 ( 4456 PWs) bands (ev): -32.5310 -32.5310 -32.5310 -32.5310 -13.8546 -13.8546 -13.8503 -13.8503 -13.5107 -13.5107 -13.4894 -13.4894 -13.4407 -13.4407 -13.4239 -13.4239 -0.2269 -0.2269 -0.2258 -0.2258 3.2701 3.2701 3.2782 3.2782 4.7823 4.7823 4.7865 4.7865 5.5307 5.5307 5.5545 5.5545 5.6823 5.6823 5.7106 5.7106 5.9223 5.9223 5.9294 5.9294 6.4030 6.4030 6.4054 6.4054 6.6065 6.6065 6.6412 6.6412 7.1513 7.1513 7.1541 7.1541 7.7555 7.7555 7.7602 7.7602 10.8147 10.8147 10.8182 10.8182 k = 0.4250 0.5000-0.0000 ( 4456 PWs) bands (ev): -32.5309 -32.5309 -32.5309 -32.5309 -13.8547 -13.8547 -13.8509 -13.8509 -13.5098 -13.5098 -13.4914 -13.4914 -13.4397 -13.4397 -13.4251 -13.4251 -0.2095 -0.2095 -0.2085 -0.2085 3.2503 3.2503 3.2573 3.2573 4.7986 4.7986 4.8021 4.8021 5.5339 5.5339 5.5544 5.5544 5.6870 5.6870 5.7098 5.7098 5.9268 5.9268 5.9306 5.9306 6.4294 6.4294 6.4306 6.4306 6.6063 6.6063 6.6389 6.6389 7.1043 7.1043 7.1076 7.1076 7.7274 7.7274 7.7314 7.7314 10.7835 10.7835 10.7867 10.7867 k = 0.4375 0.5000-0.0000 ( 4448 PWs) bands (ev): -32.5309 -32.5309 -32.5309 -32.5309 -13.8547 -13.8547 -13.8516 -13.8516 -13.5088 -13.5088 -13.4934 -13.4934 -13.4385 -13.4385 -13.4264 -13.4264 -0.1943 -0.1943 -0.1934 -0.1934 3.2331 3.2331 3.2390 3.2390 4.8127 4.8127 4.8156 4.8156 5.5369 5.5369 5.5540 5.5540 5.6906 5.6906 5.7086 5.7086 5.9302 5.9302 5.9316 5.9316 6.4577 6.4577 6.4583 6.4583 6.6064 6.6064 6.6369 6.6369 7.0585 7.0585 7.0622 7.0622 7.7043 7.7043 7.7078 7.7078 10.7562 10.7562 10.7589 10.7589 k = 0.4500 0.5000-0.0000 ( 4452 PWs) bands (ev): -32.5308 -32.5308 -32.5308 -32.5308 -13.8547 -13.8547 -13.8521 -13.8521 -13.5077 -13.5077 -13.4953 -13.4953 -13.4374 -13.4374 -13.4276 -13.4276 -0.1815 -0.1815 -0.1809 -0.1809 3.2187 3.2187 3.2234 3.2234 4.8246 4.8246 4.8269 4.8269 5.5397 5.5397 5.5534 5.5534 5.6934 5.6934 5.7070 5.7070 5.9324 5.9324 5.9325 5.9325 6.4851 6.4851 6.4880 6.4880 6.6072 6.6072 6.6355 6.6355 7.0150 7.0150 7.0190 7.0190 7.6861 7.6861 7.6888 7.6888 10.7333 10.7333 10.7355 10.7355 k = 0.4625 0.5000-0.0000 ( 4448 PWs) bands (ev): -32.5308 -32.5308 -32.5308 -32.5308 -13.8546 -13.8546 -13.8527 -13.8527 -13.5065 -13.5065 -13.4971 -13.4971 -13.4362 -13.4362 -13.4289 -13.4289 -0.1714 -0.1714 -0.1709 -0.1709 3.2074 3.2074 3.2110 3.2110 4.8340 4.8340 4.8357 4.8357 5.5422 5.5422 5.5525 5.5525 5.6956 5.6956 5.7053 5.7053 5.9331 5.9331 5.9338 5.9338 6.5110 6.5110 6.5161 6.5161 6.6094 6.6094 6.6348 6.6348 6.9757 6.9757 6.9797 6.9797 7.6723 7.6723 7.6744 7.6744 10.7151 10.7151 10.7168 10.7168 k = 0.4750 0.5000-0.0000 ( 4452 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8544 -13.8544 -13.8532 -13.8532 -13.5052 -13.5052 -13.4989 -13.4989 -13.4351 -13.4351 -13.4301 -13.4301 -0.1641 -0.1641 -0.1638 -0.1638 3.1993 3.1993 3.2017 3.2017 4.8408 4.8408 4.8420 4.8420 5.5445 5.5445 5.5514 5.5514 5.6974 5.6974 5.7036 5.7036 5.9337 5.9337 5.9345 5.9345 6.5327 6.5327 6.5388 6.5388 6.6141 6.6141 6.6346 6.6346 6.9433 6.9433 6.9467 6.9467 7.6628 7.6628 7.6641 7.6641 10.7020 10.7020 10.7032 10.7032 k = 0.4875 0.5000-0.0000 ( 4456 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8542 -13.8542 -13.8536 -13.8536 -13.5037 -13.5037 -13.5006 -13.5006 -13.4339 -13.4339 -13.4314 -13.4314 -0.1596 -0.1596 -0.1595 -0.1595 3.1947 3.1947 3.1959 3.1959 4.8451 4.8451 4.8456 4.8456 5.5466 5.5466 5.5500 5.5500 5.6989 5.6989 5.7020 5.7020 5.9342 5.9342 5.9347 5.9347 6.5478 6.5478 6.5520 6.5520 6.6216 6.6216 6.6334 6.6334 6.9217 6.9217 6.9238 6.9238 7.6572 7.6572 7.6579 7.6579 10.6942 10.6942 10.6947 10.6947 k = 0.5000 0.5000-0.0000 ( 4440 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1581 -0.1581 -0.1581 -0.1581 3.1936 3.1936 3.1936 3.1936 4.8467 4.8467 4.8467 4.8467 5.5485 5.5485 5.5485 5.5485 5.7005 5.7005 5.7005 5.7005 5.9346 5.9346 5.9346 5.9346 6.5547 6.5547 6.5547 6.5547 6.6292 6.6292 6.6292 6.6292 6.9147 6.9147 6.9147 6.9147 7.6557 7.6557 7.6557 7.6557 10.6918 10.6918 10.6918 10.6918 k = 0.5000 0.5000-0.0000 ( 4440 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1581 -0.1581 -0.1581 -0.1581 3.1936 3.1936 3.1936 3.1936 4.8467 4.8467 4.8467 4.8467 5.5485 5.5485 5.5485 5.5485 5.7005 5.7005 5.7005 5.7005 5.9346 5.9346 5.9346 5.9346 6.5547 6.5547 6.5547 6.5547 6.6292 6.6292 6.6292 6.6292 6.9147 6.9147 6.9147 6.9147 7.6557 7.6557 7.6557 7.6557 10.6918 10.6918 10.6918 10.6918 k = 0.4911 0.4911-0.0000 ( 4452 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8542 -13.8542 -13.8536 -13.8536 -13.5038 -13.5038 -13.5006 -13.5006 -13.4339 -13.4339 -13.4314 -13.4314 -0.1611 -0.1611 -0.1581 -0.1581 3.1947 3.1947 3.1960 3.1960 4.8435 4.8435 4.8472 4.8472 5.5466 5.5466 5.5500 5.5500 5.6989 5.6989 5.7021 5.7021 5.9338 5.9338 5.9351 5.9351 6.5441 6.5441 6.5559 6.5559 6.6210 6.6210 6.6336 6.6336 6.9199 6.9199 6.9258 6.9258 7.6558 7.6558 7.6595 7.6595 10.6934 10.6934 10.6957 10.6957 k = 0.4821 0.4821-0.0000 ( 4452 PWs) bands (ev): -32.5308 -32.5308 -32.5307 -32.5307 -13.8545 -13.8545 -13.8531 -13.8531 -13.5052 -13.5052 -13.4989 -13.4989 -13.4351 -13.4351 -13.4301 -13.4301 -0.1700 -0.1700 -0.1581 -0.1581 3.1989 3.1989 3.2025 3.2025 4.8340 4.8340 4.8487 4.8487 5.5444 5.5444 5.5514 5.5514 5.6969 5.6969 5.7041 5.7041 5.9316 5.9316 5.9366 5.9366 6.5168 6.5168 6.5584 6.5584 6.6091 6.6091 6.6352 6.6352 6.9353 6.9353 6.9557 6.9557 7.6560 7.6560 7.6711 7.6711 10.6985 10.6985 10.7072 10.7072 k = 0.4732 0.4732-0.0000 ( 4452 PWs) bands (ev): -32.5308 -32.5308 -32.5307 -32.5307 -13.8546 -13.8546 -13.8526 -13.8526 -13.5065 -13.5065 -13.4971 -13.4971 -13.4363 -13.4363 -13.4288 -13.4288 -0.1848 -0.1848 -0.1582 -0.1582 3.2062 3.2062 3.2130 3.2130 4.8182 4.8182 4.8511 4.8511 5.5420 5.5420 5.5526 5.5526 5.6940 5.6940 5.7067 5.7067 5.9281 5.9281 5.9391 5.9391 6.4788 6.4788 6.5624 6.5624 6.5936 6.5936 6.6357 6.6357 6.9589 6.9589 6.9984 6.9984 7.6564 7.6564 7.6901 7.6901 10.7068 10.7068 10.7262 10.7262 k = 0.4643 0.4643-0.0000 ( 4452 PWs) bands (ev): -32.5309 -32.5309 -32.5307 -32.5307 -13.8548 -13.8548 -13.8520 -13.8520 -13.5077 -13.5077 -13.4952 -13.4952 -13.4375 -13.4375 -13.4276 -13.4276 -0.2052 -0.2052 -0.1583 -0.1583 3.2164 3.2164 3.2274 3.2274 4.7966 4.7966 4.8545 4.8545 5.5392 5.5392 5.5536 5.5536 5.6900 5.6900 5.7097 5.7097 5.9231 5.9231 5.9425 5.9425 6.4354 6.4354 6.5678 6.5678 6.5755 6.5755 6.6362 6.6362 6.9885 6.9885 7.0491 7.0491 7.6571 7.6571 7.7164 7.7164 10.7184 10.7184 10.7524 10.7524 k = 0.4554 0.4554-0.0000 ( 4452 PWs) bands (ev): -32.5311 -32.5311 -32.5306 -32.5306 -13.8548 -13.8548 -13.8514 -13.8514 -13.5088 -13.5088 -13.4933 -13.4933 -13.4387 -13.4387 -13.4263 -13.4263 -0.2310 -0.2310 -0.1584 -0.1584 3.2295 3.2295 3.2456 3.2456 4.7694 4.7694 4.8589 4.8589 5.5359 5.5359 5.5546 5.5546 5.6843 5.6843 5.7131 5.7131 5.9168 5.9168 5.9469 5.9469 6.3902 6.3902 6.5554 6.5554 6.5750 6.5750 6.6374 6.6374 7.0227 7.0227 7.1048 7.1048 7.6578 7.6578 7.7498 7.7498 10.7330 10.7330 10.7853 10.7853 k = 0.4464 0.4464-0.0000 ( 4448 PWs) bands (ev): -32.5313 -32.5313 -32.5306 -32.5306 -13.8549 -13.8549 -13.8506 -13.8506 -13.5098 -13.5098 -13.4912 -13.4912 -13.4398 -13.4398 -13.4250 -13.4250 -0.2619 -0.2619 -0.1586 -0.1586 3.2455 3.2455 3.2673 3.2673 4.7370 4.7370 4.8642 4.8642 5.5323 5.5323 5.5554 5.5554 5.6767 5.6767 5.7166 5.7166 5.9092 5.9092 5.9522 5.9522 6.3455 6.3455 6.5353 6.5353 6.5829 6.5829 6.6398 6.6398 7.0604 7.0604 7.1637 7.1637 7.6588 7.6588 7.7897 7.7897 10.7504 10.7504 10.8245 10.8245 k = 0.4375 0.4375-0.0000 ( 4448 PWs) bands (ev): -32.5314 -32.5314 -32.5306 -32.5306 -13.8549 -13.8549 -13.8498 -13.8498 -13.5107 -13.5107 -13.4892 -13.4892 -13.4409 -13.4409 -13.4237 -13.4237 -0.2975 -0.2975 -0.1589 -0.1589 3.2644 3.2644 3.2922 3.2922 4.6998 4.6998 4.8705 4.8705 5.5280 5.5280 5.5561 5.5561 5.6664 5.6664 5.7199 5.7199 5.9005 5.9005 5.9584 5.9584 6.3032 6.3032 6.5155 6.5155 6.5910 6.5910 6.6443 6.6443 7.1008 7.1008 7.2248 7.2248 7.6600 7.6600 7.8360 7.8360 10.7705 10.7705 10.8692 10.8692 k = 0.4286 0.4286-0.0000 ( 4440 PWs) bands (ev): -32.5317 -32.5317 -32.5305 -32.5305 -13.8548 -13.8548 -13.8488 -13.8488 -13.5114 -13.5114 -13.4870 -13.4870 -13.4420 -13.4420 -13.4223 -13.4223 -0.3376 -0.3376 -0.1593 -0.1593 3.2861 3.2861 3.3201 3.3201 4.6584 4.6584 4.8778 4.8778 5.5232 5.5232 5.5569 5.5569 5.6530 5.6530 5.7227 5.7227 5.8904 5.8904 5.9655 5.9655 6.2646 6.2646 6.4966 6.4966 6.5981 6.5981 6.6523 6.6523 7.1435 7.1435 7.2876 7.2876 7.6615 7.6615 7.8882 7.8882 10.7929 10.7929 10.9186 10.9186 k = 0.4196 0.4196-0.0000 ( 4444 PWs) bands (ev): -32.5319 -32.5319 -32.5305 -32.5305 -13.8548 -13.8548 -13.8478 -13.8478 -13.5121 -13.5121 -13.4848 -13.4848 -13.4431 -13.4431 -13.4210 -13.4210 -0.3818 -0.3818 -0.1598 -0.1598 3.3106 3.3106 3.3507 3.3507 4.6129 4.6129 4.8860 4.8860 5.5176 5.5176 5.5578 5.5578 5.6358 5.6358 5.7249 5.7249 5.8791 5.8791 5.9735 5.9735 6.2310 6.2310 6.4790 6.4790 6.6030 6.6030 6.6649 6.6649 7.1881 7.1881 7.3517 7.3517 7.6632 7.6632 7.9458 7.9458 10.8174 10.8174 10.9715 10.9715 k = 0.4107 0.4107-0.0000 ( 4436 PWs) bands (ev): -32.5322 -32.5322 -32.5304 -32.5304 -13.8547 -13.8547 -13.8466 -13.8466 -13.5126 -13.5126 -13.4826 -13.4826 -13.4442 -13.4442 -13.4197 -13.4197 -0.4295 -0.4295 -0.1605 -0.1605 3.3379 3.3379 3.3836 3.3836 4.5641 4.5641 4.8952 4.8952 5.5113 5.5113 5.5587 5.5587 5.6142 5.6142 5.7263 5.7263 5.8668 5.8668 5.9824 5.9824 6.2033 6.2033 6.4630 6.4630 6.6057 6.6057 6.6822 6.6822 7.2344 7.2344 7.4166 7.4166 7.6654 7.6654 8.0086 8.0086 10.8438 10.8438 11.0266 11.0266 k = 0.4018 0.4018-0.0000 ( 4432 PWs) bands (ev): -32.5325 -32.5325 -32.5304 -32.5304 -13.8546 -13.8546 -13.8454 -13.8454 -13.5130 -13.5130 -13.4803 -13.4803 -13.4452 -13.4452 -13.4184 -13.4184 -0.4805 -0.4805 -0.1613 -0.1613 3.3680 3.3680 3.4185 3.4185 4.5121 4.5121 4.9054 4.9054 5.5041 5.5041 5.5598 5.5598 5.5881 5.5881 5.7267 5.7267 5.8538 5.8538 5.9922 5.9922 6.1820 6.1820 6.4486 6.4486 6.6067 6.6067 6.7037 6.7037 7.2823 7.2823 7.4822 7.4822 7.6681 7.6681 8.0758 8.0758 10.8716 10.8716 11.0824 11.0824 k = 0.3929 0.3929-0.0000 ( 4432 PWs) bands (ev): -32.5328 -32.5328 -32.5303 -32.5303 -13.8545 -13.8545 -13.8441 -13.8441 -13.5132 -13.5132 -13.4780 -13.4780 -13.4462 -13.4462 -13.4171 -13.4171 -0.5344 -0.5344 -0.1623 -0.1623 3.4008 3.4008 3.4551 3.4551 4.4574 4.4574 4.9165 4.9165 5.4961 5.4961 5.5550 5.5550 5.5635 5.5635 5.7260 5.7260 5.8402 5.8402 6.0028 6.0028 6.1671 6.1671 6.4361 6.4361 6.6067 6.6067 6.7287 6.7287 7.3315 7.3315 7.5474 7.5474 7.6723 7.6723 8.1474 8.1474 10.9006 10.9006 11.1370 11.1370 k = 0.3839 0.3839-0.0000 ( 4436 PWs) bands (ev): -32.5332 -32.5332 -32.5302 -32.5302 -13.8544 -13.8544 -13.8427 -13.8427 -13.5133 -13.5133 -13.4757 -13.4757 -13.4472 -13.4472 -13.4158 -13.4158 -0.5908 -0.5908 -0.1636 -0.1636 3.4363 3.4363 3.4933 3.4933 4.4004 4.4004 4.9286 4.9286 5.4868 5.4868 5.5214 5.5214 5.5638 5.5638 5.7241 5.7241 5.8264 5.8264 6.0142 6.0142 6.1584 6.1584 6.4255 6.4255 6.6059 6.6059 6.7570 6.7570 7.3821 7.3821 7.6088 7.6088 7.6814 7.6814 8.2229 8.2229 10.9305 10.9305 11.1880 11.1880 k = 0.3750 0.3750-0.0000 ( 4444 PWs) bands (ev): -32.5336 -32.5336 -32.5302 -32.5302 -13.8542 -13.8542 -13.8412 -13.8412 -13.5134 -13.5134 -13.4734 -13.4734 -13.4481 -13.4481 -13.4146 -13.4146 -0.6493 -0.6493 -0.1652 -0.1652 3.4743 3.4743 3.5326 3.5326 4.3415 4.3415 4.9416 4.9416 5.4737 5.4737 5.4856 5.4856 5.5659 5.5659 5.7209 5.7209 5.8126 5.8126 6.0263 6.0263 6.1554 6.1554 6.4168 6.4168 6.6047 6.6047 6.7880 6.7880 7.4339 7.4339 7.6495 7.6495 7.7120 7.7120 8.3020 8.3020 10.9610 10.9610 11.2332 11.2332 k = 0.3661 0.3661-0.0000 ( 4440 PWs) bands (ev): -32.5340 -32.5340 -32.5301 -32.5301 -13.8541 -13.8541 -13.8396 -13.8396 -13.5132 -13.5132 -13.4711 -13.4711 -13.4489 -13.4489 -13.4133 -13.4133 -0.7096 -0.7096 -0.1670 -0.1670 3.5149 3.5149 3.5729 3.5729 4.2810 4.2810 4.9556 4.9556 5.4378 5.4378 5.4687 5.4687 5.5686 5.5686 5.7167 5.7167 5.7988 5.7988 6.0394 6.0394 6.1574 6.1574 6.4101 6.4101 6.6031 6.6031 6.8217 6.8217 7.4869 7.4869 7.6626 7.6626 7.7712 7.7712 8.3843 8.3843 10.9919 10.9919 11.2700 11.2700 k = 0.3571 0.3571-0.0000 ( 4432 PWs) bands (ev): -32.5344 -32.5344 -32.5300 -32.5300 -13.8539 -13.8539 -13.8380 -13.8380 -13.5130 -13.5130 -13.4688 -13.4688 -13.4496 -13.4496 -13.4120 -13.4120 -0.7713 -0.7713 -0.1691 -0.1691 3.5580 3.5580 3.6140 3.6140 4.2193 4.2193 4.9706 4.9706 5.3938 5.3938 5.4568 5.4568 5.5716 5.5716 5.7112 5.7112 5.7853 5.7853 6.0532 6.0532 6.1638 6.1638 6.4053 6.4053 6.6014 6.6014 6.8577 6.8577 7.5410 7.5410 7.6681 7.6681 7.8388 7.8388 8.4694 8.4694 11.0230 11.0230 11.2961 11.2961 k = 0.3482 0.3482-0.0000 ( 4428 PWs) bands (ev): -32.5348 -32.5348 -32.5299 -32.5299 -13.8537 -13.8537 -13.8362 -13.8362 -13.5126 -13.5126 -13.4667 -13.4667 -13.4502 -13.4502 -13.4108 -13.4108 -0.8343 -0.8343 -0.1715 -0.1715 3.6034 3.6034 3.6554 3.6554 4.1568 4.1568 4.9865 4.9865 5.3478 5.3478 5.4444 5.4444 5.5752 5.5752 5.7046 5.7046 5.7719 5.7719 6.0678 6.0678 6.1740 6.1740 6.4024 6.4024 6.5995 6.5995 6.8958 6.8958 7.5962 7.5962 7.6718 7.6718 7.9088 7.9088 8.5571 8.5571 11.0541 11.0541 11.3100 11.3100 k = 0.3393 0.3393-0.0000 ( 4418 PWs) bands (ev): -32.5353 -32.5353 -32.5298 -32.5298 -13.8535 -13.8535 -13.8344 -13.8344 -13.5120 -13.5120 -13.4648 -13.4648 -13.4505 -13.4505 -13.4096 -13.4096 -0.8981 -0.8981 -0.1743 -0.1743 3.6512 3.6512 3.6967 3.6967 4.0941 4.0941 5.0034 5.0034 5.3008 5.3008 5.4314 5.4314 5.5793 5.5793 5.6970 5.6970 5.7588 5.7588 6.0833 6.0833 6.1875 6.1875 6.4013 6.4013 6.5975 6.5975 6.9359 6.9359 7.6525 7.6525 7.6750 7.6750 7.9799 7.9799 8.6468 8.6468 11.0853 11.0853 11.3112 11.3112 k = 0.3304 0.3304-0.0000 ( 4418 PWs) bands (ev): -32.5358 -32.5358 -32.5297 -32.5297 -13.8534 -13.8534 -13.8325 -13.8325 -13.5114 -13.5114 -13.4631 -13.4631 -13.4504 -13.4504 -13.4084 -13.4084 -0.9625 -0.9625 -0.1775 -0.1775 3.7009 3.7009 3.7373 3.7373 4.0323 4.0323 5.0212 5.0212 5.2534 5.2534 5.4177 5.4177 5.5836 5.5836 5.6884 5.6884 5.7459 5.7459 6.0994 6.0994 6.2038 6.2038 6.4019 6.4019 6.5956 6.5956 6.9776 6.9776 7.6779 7.6779 7.7099 7.7099 8.0515 8.0515 8.7382 8.7382 11.1165 11.1165 11.3002 11.3002 k = 0.3214 0.3214-0.0000 ( 4412 PWs) bands (ev): -32.5363 -32.5363 -32.5297 -32.5297 -13.8532 -13.8532 -13.8305 -13.8305 -13.5107 -13.5107 -13.4619 -13.4619 -13.4499 -13.4499 -13.4072 -13.4072 -1.0273 -1.0273 -0.1810 -0.1810 3.7520 3.7520 3.7750 3.7750 3.9740 3.9740 5.0398 5.0398 5.2061 5.2061 5.4034 5.4034 5.5882 5.5882 5.6793 5.6793 5.7333 5.7333 6.1162 6.1162 6.2228 6.2228 6.4042 6.4042 6.5937 6.5937 7.0208 7.0208 7.6807 7.6807 7.7683 7.7683 8.1234 8.1234 8.8312 8.8312 11.1478 11.1478 11.2786 11.2786 k = 0.3125 0.3125-0.0000 ( 4416 PWs) bands (ev): -32.5368 -32.5368 -32.5296 -32.5296 -13.8530 -13.8530 -13.8285 -13.8285 -13.5099 -13.5099 -13.4613 -13.4613 -13.4488 -13.4488 -13.4061 -13.4061 -1.0923 -1.0923 -0.1850 -0.1850 3.7938 3.7938 3.8111 3.8111 3.9286 3.9286 5.0591 5.0591 5.1594 5.1594 5.3885 5.3885 5.5926 5.5926 5.6699 5.6699 5.7208 5.7208 6.1336 6.1336 6.2442 6.2442 6.4080 6.4080 6.5919 6.5919 7.0653 7.0653 7.6835 7.6835 7.8276 7.8276 8.1951 8.1951 8.9250 8.9250 11.1792 11.1792 11.2484 11.2484 k = 0.3036 0.3036-0.0000 ( 4418 PWs) bands (ev): -32.5373 -32.5373 -32.5295 -32.5295 -13.8529 -13.8529 -13.8264 -13.8264 -13.5090 -13.5090 -13.4611 -13.4611 -13.4472 -13.4472 -13.4050 -13.4050 -1.1572 -1.1572 -0.1894 -0.1894 3.7833 3.7833 3.8632 3.8632 3.9217 3.9217 5.0776 5.0776 5.1153 5.1153 5.3732 5.3732 5.5963 5.5963 5.6610 5.6610 5.7086 5.7086 6.1516 6.1516 6.2676 6.2676 6.4132 6.4132 6.5904 6.5904 7.1109 7.1109 7.6863 7.6863 7.8880 7.8880 8.2663 8.2663 9.0194 9.0194 11.2101 11.2101 11.2128 11.2128 k = 0.2946 0.2946-0.0000 ( 4418 PWs) bands (ev): -32.5378 -32.5378 -32.5294 -32.5294 -13.8527 -13.8527 -13.8243 -13.8243 -13.5080 -13.5080 -13.4613 -13.4613 -13.4452 -13.4452 -13.4040 -13.4040 -1.2218 -1.2218 -0.1941 -0.1941 3.7357 3.7357 3.9171 3.9171 3.9521 3.9521 5.0627 5.0627 5.1062 5.1062 5.3576 5.3576 5.5980 5.5980 5.6540 5.6540 5.6965 5.6965 6.1700 6.1700 6.2930 6.2930 6.4199 6.4199 6.5891 6.5891 7.1573 7.1573 7.6890 7.6890 7.9493 7.9493 8.3368 8.3368 9.1141 9.1141 11.1709 11.1709 11.2436 11.2436 k = 0.2857 0.2857-0.0000 ( 4424 PWs) bands (ev): -32.5384 -32.5384 -32.5293 -32.5293 -13.8526 -13.8526 -13.8221 -13.8221 -13.5069 -13.5069 -13.4617 -13.4617 -13.4429 -13.4429 -13.4030 -13.4030 -1.2859 -1.2859 -0.1993 -0.1993 3.6769 3.6769 3.9678 3.9678 3.9989 3.9989 5.0200 5.0200 5.1271 5.1271 5.3417 5.3417 5.5959 5.5959 5.6507 5.6507 5.6845 5.6845 6.1888 6.1888 6.3200 6.3200 6.4279 6.4279 6.5882 6.5882 7.2044 7.2044 7.6917 7.6917 8.0116 8.0116 8.4059 8.4059 9.2085 9.2085 11.1278 11.1278 11.2770 11.2770 k = 0.2768 0.2768-0.0000 ( 4416 PWs) bands (ev): -32.5389 -32.5389 -32.5292 -32.5292 -13.8524 -13.8524 -13.8198 -13.8198 -13.5057 -13.5057 -13.4621 -13.4621 -13.4405 -13.4405 -13.4020 -13.4020 -1.3495 -1.3495 -0.2049 -0.2049 3.6152 3.6152 4.0140 4.0140 4.0551 4.0551 4.9770 4.9770 5.1505 5.1505 5.3258 5.3258 5.5892 5.5892 5.6520 5.6520 5.6729 5.6729 6.2079 6.2079 6.3483 6.3483 6.4373 6.4373 6.5879 6.5879 7.2520 7.2520 7.6945 7.6945 8.0749 8.0749 8.4732 8.4732 9.3023 9.3023 11.0841 11.0841 11.3115 11.3115 k = 0.2679 0.2679-0.0000 ( 4414 PWs) bands (ev): -32.5394 -32.5394 -32.5291 -32.5291 -13.8522 -13.8522 -13.8176 -13.8176 -13.5045 -13.5045 -13.4626 -13.4626 -13.4381 -13.4381 -13.4010 -13.4010 -1.4122 -1.4122 -0.2109 -0.2109 3.5527 3.5527 4.0583 4.0583 4.1159 4.1159 4.9350 4.9350 5.1750 5.1750 5.3097 5.3097 5.5790 5.5790 5.6548 5.6548 5.6633 5.6633 6.2273 6.2273 6.3774 6.3774 6.4485 6.4485 6.5883 6.5883 7.2998 7.2998 7.6972 7.6972 8.1392 8.1392 8.5381 8.5381 9.3951 9.3951 11.0415 11.0415 11.3475 11.3475 k = 0.2589 0.2589-0.0000 ( 4412 PWs) bands (ev): -32.5400 -32.5400 -32.5290 -32.5290 -13.8521 -13.8521 -13.8153 -13.8153 -13.5033 -13.5033 -13.4631 -13.4631 -13.4355 -13.4355 -13.4001 -13.4001 -1.4741 -1.4741 -0.2172 -0.2172 3.4903 3.4903 4.1019 4.1019 4.1789 4.1789 4.8942 4.8942 5.2005 5.2005 5.2939 5.2939 5.5667 5.5667 5.6469 5.6469 5.6669 5.6669 6.2468 6.2468 6.4059 6.4059 6.4622 6.4622 6.5898 6.5898 7.3476 7.3476 7.6999 7.6999 8.2044 8.2044 8.6000 8.6000 9.4865 9.4865 11.0012 11.0012 11.3852 11.3852 k = 0.2500 0.2500-0.0000 ( 4414 PWs) bands (ev): -32.5406 -32.5406 -32.5289 -32.5289 -13.8519 -13.8519 -13.8129 -13.8129 -13.5020 -13.5020 -13.4636 -13.4636 -13.4330 -13.4330 -13.3992 -13.3992 -1.5348 -1.5348 -0.2240 -0.2240 3.4285 3.4285 4.1452 4.1452 4.2433 4.2433 4.8549 4.8549 5.2264 5.2264 5.2790 5.2790 5.5532 5.5532 5.6352 5.6352 5.6758 5.6758 6.2662 6.2662 6.4316 6.4316 6.4802 6.4802 6.5929 6.5929 7.3952 7.3952 7.7026 7.7026 8.2706 8.2706 8.6582 8.6582 9.5760 9.5760 10.9645 10.9645 11.4249 11.4249 k = 0.2411 0.2411-0.0000 ( 4420 PWs) bands (ev): -32.5411 -32.5411 -32.5288 -32.5288 -13.8518 -13.8518 -13.8106 -13.8106 -13.5007 -13.5007 -13.4641 -13.4641 -13.4304 -13.4304 -13.3984 -13.3984 -1.5944 -1.5944 -0.2310 -0.2310 3.3676 3.3676 4.1881 4.1881 4.3087 4.3087 4.8171 4.8171 5.2467 5.2467 5.2707 5.2707 5.5390 5.5390 5.6231 5.6231 5.6862 5.6862 6.2855 6.2855 6.4521 6.4521 6.5041 6.5041 6.5981 6.5981 7.4425 7.4425 7.7053 7.7053 8.3377 8.3377 8.7119 8.7119 9.6634 9.6634 10.9325 10.9325 11.4669 11.4669 k = 0.2321 0.2321-0.0000 ( 4418 PWs) bands (ev): -32.5417 -32.5417 -32.5287 -32.5287 -13.8517 -13.8517 -13.8083 -13.8083 -13.4995 -13.4995 -13.4645 -13.4645 -13.4278 -13.4278 -13.3977 -13.3977 -1.6527 -1.6527 -0.2384 -0.2384 3.3077 3.3077 4.2307 4.2307 4.3746 4.3746 4.7809 4.7809 5.2408 5.2408 5.2900 5.2900 5.5245 5.5245 5.6109 5.6109 5.6974 5.6974 6.3047 6.3047 6.4680 6.4680 6.5316 6.5316 6.6071 6.6071 7.4890 7.4890 7.7081 7.7081 8.4057 8.4057 8.7604 8.7604 9.7482 9.7482 10.9061 10.9061 11.5115 11.5115 k = 0.2232 0.2232-0.0000 ( 4423 PWs) bands (ev): -32.5422 -32.5422 -32.5286 -32.5286 -13.8516 -13.8516 -13.8059 -13.8059 -13.4982 -13.4982 -13.4649 -13.4649 -13.4253 -13.4253 -13.3969 -13.3969 -1.7095 -1.7095 -0.2460 -0.2460 3.2490 3.2490 4.2730 4.2730 4.4405 4.4405 4.7463 4.7463 5.2265 5.2265 5.3191 5.3191 5.5099 5.5099 5.5985 5.5985 5.7093 5.7093 6.3234 6.3234 6.4813 6.4813 6.5579 6.5579 6.6228 6.6228 7.5344 7.5344 7.7112 7.7112 8.4747 8.4747 8.8031 8.8031 9.8300 9.8300 10.8859 10.8859 11.5588 11.5588 k = 0.2143 0.2143-0.0000 ( 4431 PWs) bands (ev): -32.5428 -32.5428 -32.5285 -32.5285 -13.8515 -13.8515 -13.8036 -13.8036 -13.4971 -13.4971 -13.4651 -13.4651 -13.4227 -13.4227 -13.3963 -13.3963 -1.7649 -1.7649 -0.2539 -0.2539 3.1918 3.1918 4.3148 4.3148 4.5060 4.5060 4.7135 4.7135 5.2115 5.2115 5.3503 5.3503 5.4952 5.4952 5.5861 5.5861 5.7218 5.7218 6.3415 6.3415 6.4936 6.4936 6.5786 6.5786 6.6482 6.6482 7.5781 7.5781 7.7149 7.7149 8.5445 8.5445 8.8394 8.8394 9.9088 9.9088 10.8726 10.8726 11.6088 11.6088 k = 0.2054 0.2054-0.0000 ( 4435 PWs) bands (ev): -32.5433 -32.5433 -32.5284 -32.5284 -13.8514 -13.8514 -13.8012 -13.8012 -13.4960 -13.4960 -13.4652 -13.4652 -13.4203 -13.4203 -13.3956 -13.3956 -1.8186 -1.8186 -0.2620 -0.2620 3.1360 3.1360 4.3561 4.3561 4.5702 4.5702 4.6831 4.6831 5.1966 5.1966 5.3830 5.3830 5.4807 5.4807 5.5737 5.5737 5.7347 5.7347 6.3587 6.3587 6.5054 6.5054 6.5942 6.5942 6.6821 6.6821 7.6189 7.6189 7.7204 7.7204 8.6153 8.6153 8.8688 8.8688 9.9841 9.9841 10.8664 10.8664 11.6618 11.6618 k = 0.1964 0.1964-0.0000 ( 4431 PWs) bands (ev): -32.5438 -32.5438 -32.5283 -32.5283 -13.8512 -13.8512 -13.7989 -13.7989 -13.4949 -13.4949 -13.4652 -13.4652 -13.4178 -13.4178 -13.3950 -13.3950 -1.8706 -1.8706 -0.2702 -0.2702 3.0819 3.0819 4.3970 4.3970 4.6248 4.6248 4.6629 4.6629 5.1820 5.1820 5.4165 5.4165 5.4666 5.4666 5.5613 5.5613 5.7480 5.7480 6.3750 6.3750 6.5175 6.5175 6.6077 6.6077 6.7211 6.7211 7.6537 7.6537 7.7305 7.7305 8.6870 8.6870 8.8911 8.8911 10.0559 10.0559 10.8672 10.8672 11.7177 11.7177 k = 0.1875 0.1875-0.0000 ( 4427 PWs) bands (ev): -32.5444 -32.5444 -32.5282 -32.5282 -13.8511 -13.8511 -13.7966 -13.7966 -13.4941 -13.4941 -13.4650 -13.4650 -13.4154 -13.4154 -13.3945 -13.3945 -1.9208 -1.9208 -0.2786 -0.2786 3.0295 3.0295 4.4373 4.4373 4.6174 4.6174 4.7050 4.7050 5.1678 5.1678 5.4457 5.4457 5.4580 5.4580 5.5491 5.5491 5.7616 5.7616 6.3901 6.3901 6.5301 6.5301 6.6211 6.6211 6.7628 6.7628 7.6772 7.6772 7.7502 7.7502 8.7595 8.7595 8.9065 8.9065 10.1240 10.1240 10.8745 10.8745 11.7762 11.7763 k = 0.1786 0.1786-0.0000 ( 4413 PWs) bands (ev): -32.5448 -32.5448 -32.5281 -32.5281 -13.8510 -13.8510 -13.7943 -13.7943 -13.4933 -13.4933 -13.4647 -13.4647 -13.4130 -13.4130 -13.3939 -13.3939 -1.9691 -1.9691 -0.2870 -0.2870 2.9790 2.9790 4.4770 4.4770 4.5924 4.5924 4.7647 4.7647 5.1541 5.1541 5.4369 5.4369 5.4874 5.4874 5.5382 5.5382 5.7754 5.7754 6.4038 6.4038 6.5436 6.5436 6.6351 6.6351 6.8063 6.8063 7.6886 7.6886 7.7802 7.7802 8.8325 8.8325 8.9155 8.9155 10.1885 10.1885 10.8879 10.8879 11.8056 11.8057 k = 0.1696 0.1696-0.0000 ( 4413 PWs) bands (ev): -32.5453 -32.5453 -32.5281 -32.5281 -13.8509 -13.8509 -13.7921 -13.7921 -13.4926 -13.4926 -13.4642 -13.4642 -13.4107 -13.4107 -13.3934 -13.3934 -2.0156 -2.0156 -0.2954 -0.2954 2.9303 2.9303 4.5158 4.5158 4.5676 4.5676 4.8236 4.8236 5.1407 5.1407 5.4237 5.4237 5.5102 5.5102 5.5394 5.5394 5.7894 5.7894 6.4162 6.4162 6.5583 6.5583 6.6500 6.6500 6.8510 6.8510 7.6931 7.6931 7.8151 7.8151 8.9006 8.9006 8.9237 8.9237 10.2492 10.2492 10.9061 10.9061 11.7681 11.7681 k = 0.1607 0.1607-0.0000 ( 4415 PWs) bands (ev): -32.5458 -32.5458 -32.5280 -32.5280 -13.8508 -13.8508 -13.7899 -13.7899 -13.4921 -13.4921 -13.4636 -13.4636 -13.4086 -13.4086 -13.3930 -13.3930 -2.0600 -2.0600 -0.3038 -0.3038 2.8837 2.8837 4.5425 4.5425 4.5555 4.5555 4.8804 4.8804 5.1279 5.1279 5.4106 5.4106 5.5045 5.5045 5.5700 5.5700 5.8035 5.8035 6.4272 6.4272 6.5742 6.5742 6.6659 6.6659 6.8963 6.8963 7.6942 7.6942 7.8510 7.8510 8.9106 8.9106 8.9853 8.9853 10.3063 10.3063 10.9282 10.9282 11.7309 11.7309 k = 0.1518 0.1518-0.0000 ( 4421 PWs) bands (ev): -32.5463 -32.5463 -32.5279 -32.5279 -13.8508 -13.8508 -13.7878 -13.7878 -13.4918 -13.4918 -13.4629 -13.4629 -13.4065 -13.4065 -13.3925 -13.3925 -2.1023 -2.1023 -0.3121 -0.3121 2.8391 2.8391 4.5210 4.5210 4.5921 4.5921 4.9346 4.9346 5.1157 5.1157 5.3979 5.3979 5.4926 5.4926 5.6070 5.6070 5.8176 5.8176 6.4372 6.4372 6.5911 6.5911 6.6833 6.6833 6.9420 6.9420 7.6932 7.6932 7.8865 7.8865 8.9028 8.9028 9.0605 9.0605 10.3598 10.3598 10.9530 10.9530 11.6945 11.6945 k = 0.1429 0.1429-0.0000 ( 4427 PWs) bands (ev): -32.5467 -32.5467 -32.5278 -32.5278 -13.8507 -13.8507 -13.7858 -13.7858 -13.4915 -13.4915 -13.4620 -13.4620 -13.4046 -13.4046 -13.3921 -13.3921 -2.1425 -2.1425 -0.3202 -0.3202 2.7967 2.7967 4.5001 4.5001 4.6287 4.6287 4.9858 4.9858 5.1042 5.1042 5.3857 5.3857 5.4797 5.4797 5.6447 5.6447 5.8318 5.8318 6.4464 6.4464 6.6086 6.6086 6.7022 6.7022 6.9878 6.9878 7.6907 7.6907 7.9208 7.9208 8.8904 8.8904 9.1371 9.1371 10.4099 10.4099 10.9795 10.9795 11.6592 11.6592 k = 0.1339 0.1339-0.0000 ( 4427 PWs) bands (ev): -32.5472 -32.5472 -32.5277 -32.5277 -13.8506 -13.8506 -13.7838 -13.7838 -13.4914 -13.4914 -13.4611 -13.4611 -13.4028 -13.4028 -13.3916 -13.3916 -2.1806 -2.1806 -0.3282 -0.3282 2.7565 2.7565 4.4806 4.4806 4.6644 4.6644 5.0335 5.0335 5.0938 5.0938 5.3741 5.3741 5.4664 5.4664 5.6820 5.6820 5.8461 5.8461 6.4551 6.4551 6.6264 6.6264 6.7233 6.7233 7.0334 7.0334 7.6868 7.6868 7.9537 7.9537 8.8745 8.8745 9.2145 9.2145 10.4566 10.4566 11.0068 11.0068 11.6253 11.6253 k = 0.1250 0.1250-0.0000 ( 4427 PWs) bands (ev): -32.5476 -32.5476 -32.5277 -32.5277 -13.8505 -13.8505 -13.7819 -13.7819 -13.4914 -13.4914 -13.4600 -13.4600 -13.4012 -13.4012 -13.3911 -13.3911 -2.2164 -2.2164 -0.3360 -0.3360 2.7187 2.7187 4.4624 4.4624 4.6992 4.6992 5.0716 5.0716 5.0904 5.0904 5.3629 5.3629 5.4530 5.4530 5.7178 5.7178 5.8605 5.8605 6.4636 6.4636 6.6439 6.6439 6.7470 6.7470 7.0784 7.0784 7.6815 7.6815 7.9848 7.9848 8.8562 8.8562 9.2927 9.2927 10.5003 10.5003 11.0343 11.0343 11.5930 11.5930 k = 0.1161 0.1161-0.0000 ( 4409 PWs) bands (ev): -32.5479 -32.5479 -32.5276 -32.5276 -13.8504 -13.8504 -13.7801 -13.7801 -13.4914 -13.4914 -13.4589 -13.4589 -13.3997 -13.3997 -13.3905 -13.3905 -2.2499 -2.2499 -0.3434 -0.3434 2.6832 2.6832 4.4455 4.4455 4.7330 4.7330 5.0703 5.0703 5.1239 5.1239 5.3526 5.3526 5.4394 5.4394 5.7515 5.7515 5.8751 5.8751 6.4720 6.4720 6.6607 6.6607 6.7739 6.7739 7.1226 7.1226 7.6748 7.6748 8.0141 8.0141 8.8361 8.8361 9.3714 9.3714 10.5409 10.5409 11.0617 11.0617 11.5626 11.5626 k = 0.1071 0.1071-0.0000 ( 4403 PWs) bands (ev): -32.5483 -32.5483 -32.5275 -32.5275 -13.8503 -13.8503 -13.7784 -13.7784 -13.4915 -13.4915 -13.4578 -13.4578 -13.3985 -13.3985 -13.3899 -13.3899 -2.2811 -2.2811 -0.3505 -0.3505 2.6501 2.6501 4.4300 4.4300 4.7657 4.7657 5.0620 5.0620 5.1618 5.1618 5.3427 5.3427 5.4257 5.4257 5.7823 5.7823 5.8899 5.8899 6.4804 6.4804 6.6764 6.6764 6.8039 6.8039 7.1656 7.1656 7.6665 7.6665 8.0415 8.0415 8.8149 8.8149 9.4507 9.4507 10.5786 10.5786 11.0889 11.0889 11.5326 11.5327 k = 0.0982 0.0982-0.0000 ( 4415 PWs) bands (ev): -32.5486 -32.5486 -32.5275 -32.5275 -13.8503 -13.8503 -13.7768 -13.7768 -13.4916 -13.4916 -13.4568 -13.4568 -13.3975 -13.3975 -13.3892 -13.3892 -2.3100 -2.3100 -0.3572 -0.3572 2.6194 2.6194 4.4158 4.4158 4.7971 4.7971 5.0538 5.0538 5.1970 5.1970 5.3335 5.3335 5.4120 5.4120 5.8096 5.8096 5.9049 5.9049 6.4887 6.4887 6.6904 6.6904 6.8374 6.8374 7.2070 7.2070 7.6565 7.6565 8.0669 8.0669 8.7934 8.7934 9.5302 9.5302 10.6136 10.6136 11.1160 11.1160 11.4769 11.4769 k = 0.0893 0.0893-0.0000 ( 4413 PWs) bands (ev): -32.5489 -32.5489 -32.5274 -32.5274 -13.8503 -13.8503 -13.7753 -13.7753 -13.4918 -13.4918 -13.4557 -13.4557 -13.3968 -13.3968 -13.3883 -13.3883 -2.3364 -2.3364 -0.3635 -0.3635 2.5913 2.5913 4.4029 4.4029 4.8272 4.8272 5.0462 5.0462 5.2291 5.2291 5.3251 5.3251 5.3983 5.3983 5.8329 5.8329 5.9203 5.9203 6.4970 6.4970 6.7034 6.7034 6.8740 6.8740 7.2464 7.2464 7.6447 7.6447 8.0901 8.0901 8.7720 8.7720 9.6100 9.6100 10.6457 10.6457 11.1435 11.1435 11.4060 11.4060 k = 0.0804 0.0804-0.0000 ( 4417 PWs) bands (ev): -32.5492 -32.5492 -32.5274 -32.5274 -13.8502 -13.8502 -13.7740 -13.7740 -13.4920 -13.4920 -13.4547 -13.4547 -13.3962 -13.3962 -13.3875 -13.3875 -2.3605 -2.3605 -0.3693 -0.3693 2.5657 2.5657 4.3914 4.3914 4.8559 4.8559 5.0392 5.0392 5.2579 5.2579 5.3175 5.3175 5.3847 5.3847 5.8522 5.8522 5.9355 5.9355 6.5052 6.5052 6.7149 6.7149 6.9134 6.9134 7.2836 7.2836 7.6311 7.6311 8.1113 8.1113 8.7512 8.7512 9.6896 9.6896 10.6751 10.6751 11.1717 11.1717 11.3333 11.3333 k = 0.0714 0.0714-0.0000 ( 4419 PWs) bands (ev): -32.5495 -32.5495 -32.5273 -32.5273 -13.8502 -13.8502 -13.7728 -13.7728 -13.4922 -13.4922 -13.4537 -13.4537 -13.3958 -13.3958 -13.3867 -13.3867 -2.3821 -2.3821 -0.3746 -0.3746 2.5427 2.5427 4.3810 4.3810 4.8829 4.8829 5.0330 5.0330 5.2828 5.2828 5.3113 5.3113 5.3714 5.3714 5.8680 5.8680 5.9502 5.9502 6.5130 6.5130 6.7252 6.7252 6.9552 6.9552 7.3181 7.3181 7.6155 7.6155 8.1303 8.1303 8.7315 8.7315 9.7689 9.7689 10.7017 10.7017 11.2009 11.2009 11.2599 11.2599 k = 0.0625 0.0625-0.0000 ( 4429 PWs) bands (ev): -32.5497 -32.5497 -32.5273 -32.5273 -13.8502 -13.8502 -13.7717 -13.7717 -13.4924 -13.4924 -13.4529 -13.4529 -13.3956 -13.3956 -13.3859 -13.3859 -2.4012 -2.4012 -0.3794 -0.3794 2.5224 2.5224 4.3719 4.3719 4.9080 4.9080 5.0276 5.0276 5.2980 5.2980 5.3123 5.3123 5.3588 5.3588 5.8807 5.8807 5.9638 5.9638 6.5203 6.5203 6.7342 6.7342 6.9983 6.9983 7.3495 7.3495 7.5980 7.5980 8.1471 8.1471 8.7132 8.7132 9.8473 9.8473 10.7255 10.7255 11.1863 11.1863 11.2315 11.2315 k = 0.0536 0.0536-0.0000 ( 4429 PWs) bands (ev): -32.5499 -32.5499 -32.5273 -32.5273 -13.8501 -13.8501 -13.7707 -13.7707 -13.4926 -13.4926 -13.4521 -13.4521 -13.3954 -13.3954 -13.3851 -13.3851 -2.4178 -2.4178 -0.3836 -0.3836 2.5047 2.5047 4.3642 4.3642 4.9310 4.9310 5.0231 5.0231 5.2958 5.2958 5.3268 5.3268 5.3483 5.3483 5.8909 5.8909 5.9758 5.9758 6.5270 6.5270 6.7420 6.7420 7.0424 7.0424 7.3773 7.3773 7.5788 7.5788 8.1617 8.1617 8.6967 8.6967 9.9242 9.9242 10.7462 10.7462 11.1137 11.1137 11.2639 11.2639 k = 0.0446 0.0446-0.0000 ( 4429 PWs) bands (ev): -32.5501 -32.5501 -32.5272 -32.5272 -13.8501 -13.8501 -13.7699 -13.7699 -13.4927 -13.4927 -13.4514 -13.4514 -13.3952 -13.3952 -13.3845 -13.3845 -2.4318 -2.4318 -0.3872 -0.3872 2.4897 2.4897 4.3575 4.3575 4.9514 4.9514 5.0196 5.0196 5.2913 5.2913 5.3298 5.3298 5.3501 5.3501 5.8989 5.8989 5.9861 5.9861 6.5329 6.5329 6.7485 6.7485 7.0862 7.0862 7.4010 7.4010 7.5582 7.5582 8.1740 8.1740 8.6823 8.6823 9.9986 9.9986 10.7635 10.7635 11.0431 11.0431 11.2981 11.2981 k = 0.0357 0.0357-0.0000 ( 4417 PWs) bands (ev): -32.5502 -32.5502 -32.5272 -32.5272 -13.8501 -13.8501 -13.7692 -13.7692 -13.4929 -13.4929 -13.4508 -13.4508 -13.3951 -13.3951 -13.3839 -13.3839 -2.4434 -2.4434 -0.3902 -0.3902 2.4773 2.4773 4.3522 4.3522 4.9687 4.9687 5.0174 5.0174 5.2871 5.2871 5.3216 5.3216 5.3619 5.3619 5.9052 5.9052 5.9945 5.9945 6.5379 6.5379 6.7539 6.7539 7.1284 7.1284 7.4201 7.4201 7.5372 7.5372 8.1842 8.1842 8.6701 8.6701 10.0689 10.0689 10.7771 10.7771 10.9768 10.9768 11.3343 11.3343 k = 0.0268 0.0268-0.0000 ( 4429 PWs) bands (ev): -32.5503 -32.5503 -32.5272 -32.5272 -13.8501 -13.8501 -13.7687 -13.7687 -13.4930 -13.4930 -13.4503 -13.4503 -13.3951 -13.3951 -13.3835 -13.3835 -2.4524 -2.4524 -0.3926 -0.3926 2.4677 2.4677 4.3480 4.3480 4.9818 4.9818 5.0167 5.0167 5.2834 5.2834 5.3136 5.3136 5.3723 5.3723 5.9099 5.9099 6.0008 6.0008 6.5418 6.5418 6.7581 6.7581 7.1671 7.1671 7.4333 7.4333 7.5175 7.5175 8.1920 8.1920 8.6604 8.6604 10.1325 10.1325 10.7857 10.7857 10.9182 10.9182 11.3718 11.3718 k = 0.0179 0.0179-0.0000 ( 4425 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8500 -13.8500 -13.7683 -13.7683 -13.4930 -13.4930 -13.4500 -13.4500 -13.3951 -13.3951 -13.3831 -13.3831 -2.4588 -2.4588 -0.3942 -0.3942 2.4609 2.4609 4.3450 4.3450 4.9902 4.9902 5.0178 5.0178 5.2804 5.2804 5.3075 5.3075 5.3799 5.3799 5.9132 5.9132 6.0054 6.0054 6.5447 6.5447 6.7610 6.7610 7.1999 7.1999 7.4394 7.4394 7.5023 7.5023 8.1977 8.1977 8.6534 8.6534 10.1855 10.1855 10.7870 10.7870 10.8738 10.8738 11.4090 11.4091 k = 0.0089 0.0089-0.0000 ( 4431 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8500 -13.8500 -13.7681 -13.7681 -13.4931 -13.4931 -13.4498 -13.4498 -13.3951 -13.3951 -13.3830 -13.3830 -2.4627 -2.4627 -0.3953 -0.3953 2.4567 2.4567 4.3432 4.3432 4.9941 4.9941 5.0197 5.0197 5.2783 5.2783 5.3038 5.3038 5.3844 5.3844 5.9151 5.9151 6.0081 6.0081 6.5465 6.5465 6.7628 6.7628 7.2229 7.2229 7.4388 7.4388 7.4944 7.4944 8.2010 8.2010 8.6492 8.6492 10.2218 10.2218 10.7800 10.7800 10.8503 10.8503 11.4407 11.4422 k = 0.0000 0.0000 0.0000 ( 4435 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8500 -13.8500 -13.7681 -13.7681 -13.4931 -13.4931 -13.4497 -13.4497 -13.3951 -13.3951 -13.3829 -13.3829 -2.4640 -2.4640 -0.3956 -0.3956 2.4553 2.4553 4.3426 4.3426 4.9952 4.9952 5.0207 5.0207 5.2776 5.2776 5.3025 5.3025 5.3860 5.3860 5.9157 5.9157 6.0090 6.0090 6.5470 6.5470 6.7634 6.7634 7.2314 7.2314 7.4372 7.4372 7.4924 7.4924 8.2022 8.2022 8.6477 8.6477 10.2349 10.2349 10.7748 10.7748 10.8444 10.8444 11.4532 11.4658 k = 0.0000 0.0000 0.0000 ( 4435 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8500 -13.8500 -13.7681 -13.7681 -13.4931 -13.4931 -13.4497 -13.4497 -13.3951 -13.3951 -13.3829 -13.3829 -2.4640 -2.4640 -0.3956 -0.3956 2.4553 2.4553 4.3426 4.3426 4.9952 4.9952 5.0207 5.0207 5.2776 5.2776 5.3025 5.3025 5.3860 5.3860 5.9157 5.9157 6.0090 6.0090 6.5470 6.5470 6.7634 6.7634 7.2314 7.2314 7.4372 7.4372 7.4924 7.4924 8.2022 8.2022 8.6477 8.6477 10.2349 10.2349 10.7748 10.7748 10.8444 10.8444 11.4515 11.4603 k = 0.0000 0.0000 0.0123 ( 4427 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8500 -13.8500 -13.7680 -13.7680 -13.4931 -13.4931 -13.4497 -13.4497 -13.3950 -13.3950 -13.3829 -13.3829 -2.4636 -2.4636 -0.3968 -0.3968 2.4575 2.4575 4.3423 4.3423 4.9952 4.9952 5.0207 5.0207 5.2776 5.2776 5.3017 5.3017 5.3864 5.3864 5.9157 5.9157 6.0090 6.0090 6.5461 6.5461 6.7634 6.7634 7.2314 7.2314 7.4370 7.4370 7.4923 7.4923 8.1727 8.1727 8.6816 8.6816 10.2350 10.2350 10.7756 10.7756 10.8452 10.8452 11.4529 11.4660 k = 0.0000 0.0000 0.0246 ( 4419 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8500 -13.8500 -13.7680 -13.7680 -13.4931 -13.4931 -13.4497 -13.4497 -13.3951 -13.3951 -13.3829 -13.3829 -2.4625 -2.4625 -0.4004 -0.4004 2.4638 2.4638 4.3413 4.3413 4.9954 4.9954 5.0209 5.0209 5.2776 5.2776 5.2992 5.2992 5.3879 5.3879 5.9155 5.9155 6.0089 6.0089 6.5431 6.5431 6.7634 6.7634 7.2315 7.2315 7.4367 7.4367 7.4919 7.4919 8.1022 8.1022 8.7652 8.7652 10.2353 10.2353 10.7779 10.7779 10.8476 10.8476 11.4501 11.4589 k = 0.0000 0.0000 0.0368 ( 4419 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8499 -13.8499 -13.7681 -13.7681 -13.4930 -13.4930 -13.4497 -13.4497 -13.3951 -13.3951 -13.3829 -13.3829 -2.4606 -2.4606 -0.4063 -0.4063 2.4743 2.4743 4.3395 4.3395 4.9955 4.9955 5.0210 5.0210 5.2776 5.2776 5.2950 5.2950 5.3902 5.3902 5.9151 5.9151 6.0088 6.0088 6.5383 6.5383 6.7635 6.7635 7.2314 7.2314 7.4360 7.4360 7.4914 7.4914 8.0147 8.0147 8.8744 8.8744 10.2356 10.2356 10.7818 10.7818 10.8516 10.8516 11.4489 11.4643 k = 0.0000 0.0000 0.0491 ( 4431 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8499 -13.8499 -13.7681 -13.7681 -13.4930 -13.4930 -13.4497 -13.4497 -13.3952 -13.3952 -13.3829 -13.3829 -2.4581 -2.4581 -0.4143 -0.4143 2.4887 2.4887 4.3370 4.3370 4.9957 4.9957 5.0211 5.0211 5.2776 5.2776 5.2892 5.2892 5.3934 5.3934 5.9147 5.9147 6.0085 6.0085 6.5317 6.5317 6.7634 6.7634 7.2314 7.2314 7.4351 7.4351 7.4906 7.4906 7.9226 7.9226 8.9971 8.9971 10.2361 10.2361 10.7871 10.7871 10.8570 10.8570 11.4464 11.4465 k = 0.0000 0.0000 0.0614 ( 4431 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8499 -13.8499 -13.7682 -13.7682 -13.4929 -13.4929 -13.4497 -13.4497 -13.3953 -13.3953 -13.3829 -13.3829 -2.4549 -2.4549 -0.4243 -0.4243 2.5067 2.5067 4.3337 4.3337 4.9960 4.9960 5.0213 5.0213 5.2776 5.2776 5.2820 5.2820 5.3974 5.3974 5.9141 5.9141 6.0083 6.0083 6.5234 6.5234 6.7634 6.7634 7.2314 7.2314 7.4339 7.4339 7.4896 7.4896 7.8309 7.8309 9.1279 9.1279 10.2367 10.2367 10.7937 10.7937 10.8638 10.8638 11.4492 11.4629 k = 0.0000 0.0000 0.0737 ( 4435 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8499 -13.8499 -13.7682 -13.7682 -13.4929 -13.4929 -13.4497 -13.4497 -13.3954 -13.3954 -13.3829 -13.3829 -2.4512 -2.4512 -0.4359 -0.4359 2.5281 2.5281 4.3296 4.3296 4.9963 4.9963 5.0216 5.0216 5.2732 5.2732 5.2776 5.2776 5.4023 5.4023 5.9134 5.9134 6.0079 6.0079 6.5137 6.5137 6.7635 6.7635 7.2314 7.2314 7.4324 7.4324 7.4885 7.4885 7.7421 7.7421 9.2644 9.2644 10.2374 10.2374 10.8016 10.8016 10.8718 10.8718 11.4410 11.4412 k = 0.0000 0.0000 0.0859 ( 4432 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8498 -13.8498 -13.7682 -13.7682 -13.4928 -13.4928 -13.4497 -13.4497 -13.3955 -13.3955 -13.3829 -13.3829 -2.4469 -2.4469 -0.4490 -0.4490 2.5524 2.5524 4.3247 4.3247 4.9967 4.9967 5.0219 5.0219 5.2633 5.2633 5.2776 5.2776 5.4078 5.4078 5.9127 5.9127 6.0076 6.0076 6.5026 6.5026 6.7635 6.7635 7.2313 7.2313 7.4306 7.4306 7.4872 7.4872 7.6577 7.6577 9.4052 9.4052 10.2382 10.2382 10.8106 10.8106 10.8809 10.8809 11.4376 11.4390 k = 0.0000 0.0000 0.0982 ( 4432 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8498 -13.8498 -13.7683 -13.7683 -13.4927 -13.4927 -13.4497 -13.4497 -13.3956 -13.3956 -13.3829 -13.3829 -2.4422 -2.4422 -0.4632 -0.4632 2.5792 2.5792 4.3190 4.3190 4.9971 4.9971 5.0221 5.0221 5.2523 5.2523 5.2776 5.2776 5.4139 5.4139 5.9118 5.9118 6.0072 6.0072 6.4905 6.4905 6.7637 6.7637 7.2312 7.2312 7.4282 7.4282 7.4858 7.4858 7.5786 7.5786 9.5492 9.5492 10.2391 10.2391 10.8204 10.8204 10.8908 10.8908 11.4341 11.4341 k = 0.0000 0.0000 0.1105 ( 4424 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8497 -13.8497 -13.7683 -13.7683 -13.4926 -13.4926 -13.4497 -13.4497 -13.3957 -13.3957 -13.3829 -13.3829 -2.4372 -2.4372 -0.4782 -0.4782 2.6080 2.6080 4.3123 4.3123 4.9975 4.9975 5.0225 5.0225 5.2405 5.2405 5.2776 5.2776 5.4206 5.4206 5.9110 5.9110 6.0067 6.0067 6.4777 6.4777 6.7637 6.7637 7.2311 7.2311 7.4241 7.4241 7.4844 7.4844 7.5065 7.5065 9.6958 9.6958 10.2400 10.2400 10.8310 10.8310 10.9013 10.9013 11.4304 11.4339 k = 0.0000 0.0000 0.1228 ( 4416 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8496 -13.8496 -13.7683 -13.7683 -13.4925 -13.4925 -13.4497 -13.4497 -13.3957 -13.3957 -13.3828 -13.3828 -2.4319 -2.4319 -0.4936 -0.4936 2.6382 2.6382 4.3048 4.3048 4.9980 4.9980 5.0228 5.0228 5.2281 5.2281 5.2776 5.2776 5.4277 5.4277 5.9101 5.9101 6.0063 6.0063 6.4644 6.4644 6.7637 6.7637 7.2310 7.2310 7.4095 7.4095 7.4507 7.4507 7.4829 7.4829 9.8443 9.8443 10.2409 10.2409 10.8420 10.8420 10.9123 10.9123 11.4268 11.4277 k = 0.0000 0.0000 0.1350 ( 4412 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8496 -13.8496 -13.7684 -13.7684 -13.4924 -13.4924 -13.4497 -13.4497 -13.3958 -13.3958 -13.3828 -13.3828 -2.4266 -2.4266 -0.5091 -0.5091 2.6693 2.6693 4.2966 4.2966 4.9985 4.9985 5.0231 5.0231 5.2154 5.2154 5.2777 5.2777 5.4349 5.4349 5.9092 5.9092 6.0059 6.0059 6.4507 6.4507 6.7638 6.7638 7.2307 7.2307 7.3627 7.3627 7.4331 7.4331 7.4813 7.4813 9.9938 9.9938 10.2417 10.2417 10.8534 10.8534 10.9233 10.9233 11.4230 11.4232 k = 0.0000 0.0000 0.1473 ( 4428 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8495 -13.8495 -13.7685 -13.7685 -13.4923 -13.4923 -13.4497 -13.4497 -13.3960 -13.3960 -13.3829 -13.3829 -2.4212 -2.4212 -0.5244 -0.5244 2.7006 2.7006 4.2877 4.2877 4.9989 4.9989 5.0233 5.0233 5.2026 5.2026 5.2776 5.2776 5.4422 5.4422 5.9083 5.9083 6.0054 6.0054 6.4367 6.4367 6.7637 6.7637 7.2301 7.2301 7.3091 7.3091 7.4285 7.4285 7.4798 7.4798 10.1436 10.1436 10.2425 10.2425 10.8649 10.8649 10.9343 10.9343 11.4195 11.4195 k = 0.0000 0.0000 0.1596 ( 4428 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8495 -13.8495 -13.7685 -13.7685 -13.4922 -13.4922 -13.4497 -13.4497 -13.3961 -13.3961 -13.3829 -13.3829 -2.4160 -2.4160 -0.5390 -0.5390 2.7315 2.7315 4.2783 4.2783 4.9993 4.9993 5.0235 5.0235 5.1902 5.1902 5.2776 5.2776 5.4495 5.4495 5.9074 5.9074 6.0050 6.0050 6.4233 6.4233 6.7637 6.7637 7.2277 7.2277 7.2616 7.2616 7.4260 7.4260 7.4784 7.4784 10.2433 10.2433 10.2927 10.2927 10.8765 10.8765 10.9449 10.9449 11.4161 11.4162 k = 0.0000 0.0000 0.1719 ( 4436 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8494 -13.8494 -13.7686 -13.7686 -13.4922 -13.4922 -13.4497 -13.4497 -13.3962 -13.3962 -13.3829 -13.3829 -2.4110 -2.4110 -0.5528 -0.5528 2.7612 2.7612 4.2686 4.2686 4.9996 4.9996 5.0236 5.0236 5.1784 5.1784 5.2776 5.2776 5.4565 5.4565 5.9066 5.9066 6.0046 6.0046 6.4105 6.4105 6.7637 6.7637 7.2082 7.2082 7.2367 7.2367 7.4241 7.4241 7.4770 7.4770 10.2439 10.2439 10.4394 10.4394 10.8881 10.8881 10.9549 10.9549 11.4131 11.4133 k = 0.0000 0.0000 0.1841 ( 4436 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8494 -13.8494 -13.7686 -13.7686 -13.4921 -13.4921 -13.4497 -13.4497 -13.3963 -13.3963 -13.3829 -13.3829 -2.4064 -2.4064 -0.5654 -0.5654 2.7890 2.7890 4.2590 4.2590 5.0000 5.0000 5.0237 5.0237 5.1675 5.1675 5.2776 5.2776 5.4631 5.4631 5.9058 5.9058 6.0042 6.0042 6.3987 6.3987 6.7638 6.7638 7.1728 7.1728 7.2337 7.2337 7.4225 7.4225 7.4758 7.4758 10.2446 10.2446 10.5815 10.5815 10.9003 10.9003 10.9641 10.9641 11.4104 11.4105 k = 0.0000 0.0000 0.1964 ( 4432 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8493 -13.8493 -13.7687 -13.7687 -13.4920 -13.4920 -13.4497 -13.4497 -13.3964 -13.3964 -13.3829 -13.3829 -2.4023 -2.4023 -0.5766 -0.5766 2.8141 2.8141 4.2499 4.2499 5.0003 5.0003 5.0237 5.0237 5.1578 5.1578 5.2776 5.2776 5.4690 5.4690 5.9052 5.9052 6.0040 6.0040 6.3881 6.3881 6.7638 6.7638 7.1411 7.1411 7.2328 7.2328 7.4212 7.4212 7.4747 7.4747 10.2451 10.2451 10.7143 10.7143 10.9151 10.9151 10.9723 10.9723 11.4083 11.4084 k = 0.0000 0.0000 0.2087 ( 4444 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8493 -13.8493 -13.7687 -13.7687 -13.4920 -13.4920 -13.4497 -13.4497 -13.3965 -13.3965 -13.3829 -13.3829 -2.3988 -2.3988 -0.5861 -0.5861 2.8359 2.8359 4.2415 4.2415 5.0006 5.0006 5.0237 5.0237 5.1495 5.1495 5.2776 5.2776 5.4742 5.4742 5.9046 5.9046 6.0036 6.0036 6.3790 6.3790 6.7638 6.7638 7.1148 7.1148 7.2325 7.2325 7.4201 7.4201 7.4738 7.4738 10.2456 10.2456 10.8237 10.8237 10.9428 10.9428 10.9792 10.9792 11.4066 11.4067 k = 0.0000 0.0000 0.2210 ( 4440 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8493 -13.8493 -13.7688 -13.7688 -13.4919 -13.4919 -13.4497 -13.4497 -13.3966 -13.3966 -13.3829 -13.3829 -2.3959 -2.3959 -0.5937 -0.5937 2.8537 2.8537 4.2345 4.2345 5.0008 5.0008 5.0237 5.0237 5.1429 5.1429 5.2776 5.2776 5.4784 5.4784 5.9041 5.9041 6.0034 6.0034 6.3717 6.3717 6.7638 6.7638 7.0944 7.0944 7.2323 7.2323 7.4193 7.4193 7.4731 7.4731 10.2459 10.2459 10.8797 10.8797 10.9847 10.9847 11.0082 11.0082 11.4056 11.4056 k = 0.0000 0.0000 0.2333 ( 4440 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8493 -13.8493 -13.7688 -13.7688 -13.4919 -13.4919 -13.4497 -13.4497 -13.3966 -13.3966 -13.3829 -13.3829 -2.3938 -2.3938 -0.5992 -0.5992 2.8669 2.8669 4.2292 4.2292 5.0009 5.0009 5.0236 5.0236 5.1380 5.1380 5.2778 5.2778 5.4815 5.4815 5.9039 5.9039 6.0033 6.0033 6.3663 6.3663 6.7638 6.7638 7.0799 7.0799 7.2323 7.2323 7.4187 7.4187 7.4726 7.4726 10.2462 10.2462 10.8975 10.8975 10.9887 10.9887 11.0880 11.0880 11.4053 11.4053 k = 0.0000 0.0000 0.2455 ( 4472 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8493 -13.8493 -13.7689 -13.7689 -13.4920 -13.4920 -13.4498 -13.4498 -13.3967 -13.3967 -13.3829 -13.3829 -2.3925 -2.3925 -0.6026 -0.6026 2.8749 2.8749 4.2258 4.2258 5.0008 5.0008 5.0234 5.0234 5.1350 5.1350 5.2777 5.2777 5.4834 5.4834 5.9036 5.9036 6.0032 6.0032 6.3628 6.3628 6.7638 6.7638 7.0711 7.0711 7.2320 7.2320 7.4183 7.4183 7.4722 7.4722 10.2463 10.2463 10.9043 10.9043 10.9912 10.9912 11.1457 11.1457 11.4054 11.4054 k = 0.0000 0.0000 0.2578 ( 4472 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8493 -13.8493 -13.7689 -13.7689 -13.4919 -13.4919 -13.4498 -13.4498 -13.3967 -13.3967 -13.3829 -13.3829 -2.3921 -2.3921 -0.6037 -0.6037 2.8776 2.8776 4.2246 4.2246 5.0008 5.0008 5.0234 5.0234 5.1340 5.1340 5.2777 5.2777 5.4840 5.4840 5.9036 5.9036 6.0032 6.0032 6.3617 6.3617 6.7638 6.7638 7.0682 7.0682 7.2320 7.2320 7.4182 7.4182 7.4721 7.4721 10.2463 10.2463 10.9062 10.9062 10.9920 10.9920 11.1664 11.1664 11.4056 11.4056 k = 0.0000 0.0000 0.2578 ( 4472 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8493 -13.8493 -13.7689 -13.7689 -13.4919 -13.4919 -13.4498 -13.4498 -13.3967 -13.3967 -13.3829 -13.3829 -2.3921 -2.3921 -0.6037 -0.6037 2.8776 2.8776 4.2246 4.2246 5.0008 5.0008 5.0234 5.0234 5.1340 5.1340 5.2777 5.2777 5.4840 5.4840 5.9036 5.9036 6.0032 6.0032 6.3617 6.3617 6.7638 6.7638 7.0682 7.0682 7.2320 7.2320 7.4182 7.4182 7.4721 7.4721 10.2463 10.2463 10.9062 10.9062 10.9920 10.9920 11.1664 11.1664 11.4056 11.4056 k = 0.0000 0.0125 0.2578 ( 4460 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8493 -13.8493 -13.7689 -13.7689 -13.4919 -13.4919 -13.4498 -13.4498 -13.3967 -13.3967 -13.3830 -13.3830 -2.3909 -2.3909 -0.6031 -0.6031 2.8781 2.8781 4.2255 4.2255 5.0004 5.0004 5.0230 5.0230 5.1343 5.1343 5.2785 5.2785 5.4836 5.4836 5.9023 5.9023 6.0017 6.0017 6.3620 6.3620 6.7633 6.7633 7.0683 7.0683 7.2237 7.2237 7.4192 7.4192 7.4751 7.4751 10.2512 10.2512 10.8987 10.8987 10.9849 10.9849 11.1670 11.1670 11.4025 11.4026 k = 0.0000 0.0250 0.2578 ( 4454 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8493 -13.8493 -13.7691 -13.7691 -13.4918 -13.4918 -13.4500 -13.4500 -13.3967 -13.3967 -13.3832 -13.3832 -2.3872 -2.3872 -0.6012 -0.6012 2.8793 2.8793 4.2281 4.2281 4.9990 4.9990 5.0217 5.0217 5.1350 5.1350 5.2808 5.2808 5.4822 5.4822 5.8986 5.8986 5.9972 5.9972 6.3628 6.3628 6.7615 6.7615 7.0682 7.0682 7.2019 7.2019 7.4119 7.4119 7.4909 7.4909 10.2653 10.2653 10.8714 10.8714 10.9700 10.9700 11.1690 11.1690 11.3936 11.3938 k = 0.0000 0.0375 0.2578 ( 4444 PWs) bands (ev): -32.5503 -32.5503 -32.5272 -32.5272 -13.8493 -13.8493 -13.7695 -13.7695 -13.4918 -13.4918 -13.4503 -13.4503 -13.3967 -13.3967 -13.3834 -13.3834 -2.3812 -2.3812 -0.5982 -0.5982 2.8812 2.8812 4.2323 4.2323 4.9964 4.9964 5.0199 5.0199 5.1362 5.1362 5.2845 5.2845 5.4798 5.4798 5.8923 5.8923 5.9899 5.9899 6.3640 6.3640 6.7586 6.7586 7.0679 7.0679 7.1734 7.1734 7.3891 7.3891 7.5217 7.5217 10.2879 10.2879 10.8174 10.8174 10.9573 10.9573 11.1722 11.1722 11.3797 11.3797 k = 0.0000 0.0500 0.2578 ( 4436 PWs) bands (ev): -32.5502 -32.5502 -32.5272 -32.5272 -13.8493 -13.8493 -13.7700 -13.7700 -13.4916 -13.4916 -13.4508 -13.4508 -13.3967 -13.3967 -13.3839 -13.3839 -2.3727 -2.3727 -0.5939 -0.5939 2.8839 2.8839 4.2383 4.2383 4.9921 4.9921 5.0179 5.0179 5.1378 5.1378 5.2898 5.2898 5.4764 5.4764 5.8833 5.8833 5.9800 5.9800 6.3655 6.3655 6.7546 6.7546 7.0666 7.0666 7.1426 7.1426 7.3546 7.3546 7.5609 7.5609 10.3175 10.3175 10.7402 10.7402 10.9477 10.9477 11.1758 11.1758 11.3617 11.3617 k = 0.0000 0.0625 0.2578 ( 4440 PWs) bands (ev): -32.5501 -32.5501 -32.5273 -32.5273 -13.8494 -13.8494 -13.7706 -13.7706 -13.4915 -13.4915 -13.4514 -13.4514 -13.3968 -13.3968 -13.3844 -13.3844 -2.3618 -2.3618 -0.5885 -0.5885 2.8873 2.8873 4.2457 4.2457 4.9859 4.9859 5.0160 5.0160 5.1399 5.1399 5.2964 5.2964 5.4721 5.4721 5.8711 5.8711 5.9676 5.9676 6.3674 6.3674 6.7494 6.7494 7.0615 7.0615 7.1143 7.1143 7.3116 7.3116 7.6047 7.6047 10.3525 10.3525 10.6473 10.6473 10.9382 10.9382 11.1782 11.1782 11.3407 11.3407 k = 0.0000 0.0750 0.2578 ( 4434 PWs) bands (ev): -32.5499 -32.5499 -32.5273 -32.5273 -13.8494 -13.8494 -13.7714 -13.7714 -13.4914 -13.4914 -13.4520 -13.4520 -13.3969 -13.3969 -13.3850 -13.3850 -2.3485 -2.3485 -0.5820 -0.5820 2.8914 2.8914 4.2547 4.2547 4.9776 4.9776 5.0145 5.0145 5.1425 5.1425 5.3044 5.3044 5.4668 5.4668 5.8552 5.8552 5.9533 5.9533 6.3696 6.3696 6.7430 6.7430 7.0463 7.0463 7.0959 7.0959 7.2629 7.2629 7.6515 7.6515 10.3909 10.3909 10.5443 10.5443 10.9267 10.9267 11.1778 11.1778 11.3180 11.3180 k = 0.0000 0.0875 0.2578 ( 4438 PWs) bands (ev): -32.5497 -32.5497 -32.5273 -32.5273 -13.8495 -13.8495 -13.7724 -13.7724 -13.4913 -13.4913 -13.4528 -13.4528 -13.3971 -13.3971 -13.3856 -13.3856 -2.3329 -2.3329 -0.5745 -0.5745 2.8960 2.8960 4.2649 4.2649 4.9673 4.9673 5.0134 5.0134 5.1456 5.1456 5.3136 5.3136 5.4606 5.4606 5.8353 5.8353 5.9374 5.9374 6.3719 6.3719 6.7353 6.7353 7.0196 7.0196 7.0890 7.0890 7.2107 7.2107 7.7004 7.7004 10.4227 10.4227 10.4434 10.4434 10.9116 10.9116 11.1727 11.1727 11.2941 11.2941 k = 0.0000 0.1000 0.2578 ( 4446 PWs) bands (ev): -32.5495 -32.5495 -32.5274 -32.5274 -13.8495 -13.8495 -13.7735 -13.7735 -13.4911 -13.4911 -13.4537 -13.4537 -13.3974 -13.3974 -13.3863 -13.3863 -2.3149 -2.3149 -0.5661 -0.5661 2.9011 2.9011 4.2764 4.2764 4.9550 4.9550 5.0127 5.0127 5.1491 5.1491 5.3241 5.3241 5.4534 5.4534 5.8107 5.8107 5.9205 5.9205 6.3744 6.3744 6.7265 6.7265 6.9882 6.9882 7.0855 7.0855 7.1586 7.1586 7.7508 7.7508 10.3198 10.3198 10.4735 10.4735 10.8917 10.8917 11.1620 11.1620 11.2697 11.2697 k = 0.0000 0.1125 0.2578 ( 4444 PWs) bands (ev): -32.5492 -32.5492 -32.5274 -32.5274 -13.8496 -13.8496 -13.7747 -13.7747 -13.4910 -13.4910 -13.4546 -13.4546 -13.3978 -13.3978 -13.3870 -13.3870 -2.2946 -2.2946 -0.5568 -0.5568 2.9067 2.9067 4.2888 4.2888 4.9411 4.9411 5.0124 5.0124 5.1532 5.1532 5.3357 5.3357 5.4454 5.4454 5.7812 5.7812 5.9030 5.9030 6.3771 6.3771 6.7165 6.7165 6.9557 6.9557 7.0731 7.0731 7.1172 7.1172 7.8024 7.8024 10.2052 10.2052 10.5119 10.5119 10.8663 10.8663 11.1454 11.1454 11.2458 11.2458 k = 0.0000 0.1250 0.2578 ( 4438 PWs) bands (ev): -32.5490 -32.5490 -32.5275 -32.5275 -13.8496 -13.8496 -13.7761 -13.7761 -13.4908 -13.4908 -13.4556 -13.4556 -13.3983 -13.3983 -13.3876 -13.3876 -2.2719 -2.2719 -0.5468 -0.5468 2.9126 2.9126 4.3018 4.3018 4.9258 4.9258 5.0125 5.0125 5.1577 5.1577 5.3483 5.3483 5.4365 5.4365 5.7468 5.7468 5.8850 5.8850 6.3798 6.3798 6.7052 6.7052 6.9232 6.9232 7.0335 7.0335 7.1053 7.1053 7.8552 7.8552 10.0902 10.0902 10.5468 10.5468 10.8353 10.8353 11.1244 11.1244 11.2232 11.2232 k = 0.0000 0.1375 0.2578 ( 4428 PWs) bands (ev): -32.5486 -32.5486 -32.5275 -32.5275 -13.8497 -13.8497 -13.7776 -13.7776 -13.4906 -13.4906 -13.4565 -13.4565 -13.3990 -13.3990 -13.3882 -13.3882 -2.2470 -2.2470 -0.5363 -0.5363 2.9187 2.9187 4.3152 4.3152 4.9094 4.9094 5.0129 5.0129 5.1626 5.1626 5.3619 5.3619 5.4267 5.4267 5.7075 5.7075 5.8666 5.8666 6.3825 6.3825 6.6927 6.6927 6.8911 6.8911 6.9848 6.9848 7.1056 7.1056 7.9089 7.9089 9.9760 9.9760 10.5753 10.5753 10.7989 10.7989 11.1016 11.1016 11.2030 11.2030 k = 0.0000 0.1500 0.2578 ( 4428 PWs) bands (ev): -32.5483 -32.5483 -32.5276 -32.5276 -13.8498 -13.8498 -13.7792 -13.7792 -13.4905 -13.4905 -13.4575 -13.4575 -13.3999 -13.3999 -13.3887 -13.3887 -2.2198 -2.2198 -0.5252 -0.5252 2.9249 2.9249 4.3283 4.3283 4.8922 4.8922 5.0137 5.0137 5.1679 5.1679 5.3763 5.3763 5.4162 5.4162 5.6640 5.6640 5.8478 5.8478 6.3852 6.3852 6.6788 6.6788 6.8593 6.8593 6.9373 6.9373 7.1086 7.1086 7.9633 7.9633 9.8636 9.8636 10.5944 10.5944 10.7582 10.7582 11.0810 11.0810 11.1856 11.1856 k = 0.0000 0.1625 0.2578 ( 4424 PWs) bands (ev): -32.5480 -32.5480 -32.5277 -32.5277 -13.8498 -13.8498 -13.7809 -13.7809 -13.4904 -13.4904 -13.4585 -13.4585 -13.4009 -13.4009 -13.3892 -13.3892 -2.1905 -2.1905 -0.5139 -0.5139 2.9311 2.9311 4.3406 4.3406 4.8749 4.8749 5.0149 5.0149 5.1736 5.1736 5.3908 5.3908 5.4058 5.4058 5.6169 5.6169 5.8286 5.8286 6.3877 6.3877 6.6637 6.6637 6.8280 6.8280 6.8934 6.8934 7.1126 7.1126 8.0184 8.0184 9.7536 9.7536 10.6003 10.6003 10.7140 10.7140 11.0671 11.0671 11.1717 11.1717 k = 0.0000 0.1750 0.2578 ( 4412 PWs) bands (ev): -32.5476 -32.5476 -32.5278 -32.5278 -13.8499 -13.8499 -13.7827 -13.7827 -13.4902 -13.4902 -13.4595 -13.4595 -13.4020 -13.4020 -13.3896 -13.3896 -2.1589 -2.1589 -0.5025 -0.5025 2.9372 2.9372 4.3511 4.3511 4.8582 4.8582 5.0166 5.0166 5.1795 5.1795 5.3911 5.3911 5.4095 5.4095 5.5672 5.5672 5.8090 5.8090 6.3901 6.3901 6.6474 6.6474 6.7971 6.7971 6.8537 6.8537 7.1173 7.1173 8.0739 8.0739 9.6465 9.6465 10.5898 10.5898 10.6677 10.6677 11.0637 11.0637 11.1617 11.1617 k = 0.0000 0.1875 0.2578 ( 4420 PWs) bands (ev): -32.5472 -32.5472 -32.5279 -32.5279 -13.8500 -13.8500 -13.7847 -13.7847 -13.4902 -13.4902 -13.4605 -13.4605 -13.4032 -13.4032 -13.3899 -13.3899 -2.1252 -2.1252 -0.4912 -0.4912 2.9430 2.9430 4.3589 4.3589 4.8429 4.8429 5.0187 5.0187 5.1856 5.1856 5.3790 5.3790 5.4247 5.4247 5.5164 5.5164 5.7889 5.7889 6.3920 6.3920 6.6297 6.6297 6.7666 6.7666 6.8185 6.8185 7.1224 7.1224 8.1299 8.1299 9.5429 9.5429 10.5618 10.5618 10.6201 10.6201 11.0726 11.0726 11.1557 11.1557 k = 0.0000 0.2000 0.2578 ( 4426 PWs) bands (ev): -32.5468 -32.5468 -32.5280 -32.5280 -13.8501 -13.8501 -13.7867 -13.7867 -13.4903 -13.4903 -13.4615 -13.4615 -13.4045 -13.4045 -13.3903 -13.3903 -2.0895 -2.0895 -0.4801 -0.4801 2.9486 2.9486 4.3627 4.3627 4.8303 4.8303 5.0212 5.0212 5.1915 5.1915 5.3658 5.3658 5.4351 5.4351 5.4711 5.4711 5.7684 5.7684 6.3936 6.3936 6.6111 6.6111 6.7367 6.7367 6.7876 6.7876 7.1279 7.1279 8.1861 8.1861 9.4430 9.4430 10.5186 10.5186 10.5715 10.5715 11.0926 11.0926 11.1540 11.1540 k = 0.0000 0.2125 0.2578 ( 4414 PWs) bands (ev): -32.5464 -32.5464 -32.5281 -32.5281 -13.8501 -13.8501 -13.7888 -13.7888 -13.4903 -13.4903 -13.4624 -13.4624 -13.4057 -13.4057 -13.3906 -13.3906 -2.0517 -2.0517 -0.4695 -0.4695 2.9538 2.9538 4.3612 4.3612 4.8217 4.8217 5.0242 5.0242 5.1969 5.1969 5.3518 5.3518 5.4040 5.4040 5.4687 5.4687 5.7476 5.7476 6.3945 6.3945 6.5917 6.5917 6.7076 6.7076 6.7608 6.7608 7.1335 7.1335 8.2426 8.2426 9.3472 9.3472 10.4644 10.4644 10.5211 10.5211 11.1215 11.1215 11.1569 11.1569 k = 0.0000 0.2250 0.2578 ( 4414 PWs) bands (ev): -32.5459 -32.5459 -32.5282 -32.5282 -13.8502 -13.8502 -13.7910 -13.7910 -13.4904 -13.4904 -13.4634 -13.4634 -13.4070 -13.4070 -13.3909 -13.3909 -2.0120 -2.0120 -0.4597 -0.4597 2.9585 2.9585 4.3532 4.3532 4.8180 4.8180 5.0276 5.0276 5.2008 5.2008 5.3367 5.3367 5.3574 5.3574 5.4856 5.4856 5.7265 5.7265 6.3946 6.3946 6.5718 6.5718 6.6792 6.6792 6.7378 6.7378 7.1392 7.1392 8.2992 8.2992 9.2558 9.2558 10.4024 10.4024 10.4690 10.4690 11.1545 11.1545 11.1667 11.1667 k = 0.0000 0.2375 0.2578 ( 4418 PWs) bands (ev): -32.5455 -32.5455 -32.5284 -32.5284 -13.8502 -13.8502 -13.7933 -13.7933 -13.4905 -13.4905 -13.4643 -13.4643 -13.4083 -13.4083 -13.3913 -13.3913 -1.9704 -1.9704 -0.4508 -0.4508 2.9628 2.9628 4.3380 4.3380 4.8200 4.8200 5.0315 5.0315 5.2006 5.2006 5.3107 5.3107 5.3257 5.3257 5.5046 5.5046 5.7054 5.7054 6.3934 6.3934 6.5514 6.5514 6.6515 6.6515 6.7183 6.7183 7.1448 7.1448 8.3557 8.3557 9.1692 9.1692 10.3345 10.3345 10.4160 10.4160 11.1730 11.1730 11.2002 11.2002 k = 0.0000 0.2500 0.2578 ( 4414 PWs) bands (ev): -32.5450 -32.5450 -32.5285 -32.5285 -13.8502 -13.8502 -13.7957 -13.7957 -13.4907 -13.4907 -13.4652 -13.4652 -13.4094 -13.4094 -13.3916 -13.3916 -1.9270 -1.9270 -0.4432 -0.4432 2.9667 2.9667 4.3155 4.3155 4.8278 4.8278 5.0357 5.0357 5.1903 5.1903 5.2810 5.2810 5.3097 5.3097 5.5241 5.5241 5.6845 5.6845 6.3909 6.3909 6.5308 6.5308 6.6243 6.6243 6.7025 6.7025 7.1501 7.1501 8.4121 8.4121 9.0875 9.0875 10.2619 10.2619 10.3629 10.3629 11.1893 11.1893 11.2439 11.2439 k = 0.0000 0.2625 0.2578 ( 4422 PWs) bands (ev): -32.5445 -32.5445 -32.5287 -32.5287 -13.8503 -13.8503 -13.7981 -13.7981 -13.4909 -13.4909 -13.4661 -13.4661 -13.4105 -13.4105 -13.3920 -13.3920 -1.8818 -1.8818 -0.4371 -0.4371 2.9702 2.9702 4.2860 4.2860 4.8410 4.8410 5.0402 5.0402 5.1650 5.1650 5.2682 5.2682 5.2948 5.2948 5.5433 5.5433 5.6644 5.6644 6.3866 6.3866 6.5101 6.5101 6.5975 6.5975 6.6903 6.6903 7.1551 7.1551 8.4684 8.4684 9.0110 9.0110 10.1856 10.1856 10.3099 10.3099 11.2094 11.2094 11.2909 11.2909 k = 0.0000 0.2750 0.2578 ( 4424 PWs) bands (ev): -32.5440 -32.5440 -32.5289 -32.5289 -13.8503 -13.8503 -13.8005 -13.8005 -13.4912 -13.4912 -13.4671 -13.4671 -13.4114 -13.4114 -13.3925 -13.3925 -1.8349 -1.8349 -0.4328 -0.4328 2.9734 2.9734 4.2503 4.2503 4.8587 4.8587 5.0446 5.0446 5.1318 5.1318 5.2662 5.2662 5.2813 5.2813 5.5608 5.5608 5.6467 5.6467 6.3804 6.3804 6.4893 6.4893 6.5710 6.5710 6.6820 6.6820 7.1595 7.1595 8.5242 8.5242 8.9400 8.9400 10.1065 10.1065 10.2574 10.2574 11.2335 11.2335 11.3401 11.3401 k = 0.0000 0.2875 0.2578 ( 4418 PWs) bands (ev): -32.5435 -32.5435 -32.5291 -32.5291 -13.8503 -13.8503 -13.8029 -13.8029 -13.4914 -13.4914 -13.4680 -13.4680 -13.4122 -13.4122 -13.3929 -13.3929 -1.7865 -1.7865 -0.4305 -0.4305 2.9766 2.9766 4.2094 4.2094 4.8799 4.8799 5.0475 5.0475 5.0997 5.0997 5.2600 5.2600 5.2773 5.2773 5.5720 5.5720 5.6359 5.6359 6.3721 6.3721 6.4685 6.4685 6.5447 6.5447 6.6774 6.6774 7.1631 7.1631 8.5797 8.5797 8.8748 8.8748 10.0254 10.0254 10.2055 10.2055 11.2614 11.2614 11.3911 11.3911 k = 0.0000 0.3000 0.2578 ( 4422 PWs) bands (ev): -32.5430 -32.5430 -32.5293 -32.5293 -13.8502 -13.8502 -13.8054 -13.8054 -13.4916 -13.4916 -13.4690 -13.4690 -13.4129 -13.4129 -13.3934 -13.3934 -1.7366 -1.7366 -0.4306 -0.4306 2.9799 2.9799 4.1640 4.1640 4.9037 4.9037 5.0421 5.0421 5.0786 5.0786 5.2465 5.2465 5.2829 5.2829 5.5692 5.5692 5.6396 5.6396 6.3618 6.3618 6.4476 6.4476 6.5185 6.5185 6.6765 6.6765 7.1656 7.1656 8.6347 8.6347 8.8156 8.8156 9.9430 9.9430 10.1543 10.1543 11.2930 11.2930 11.4435 11.4435 k = 0.0000 0.3125 0.2578 ( 4422 PWs) bands (ev): -32.5424 -32.5424 -32.5295 -32.5295 -13.8501 -13.8501 -13.8079 -13.8079 -13.4918 -13.4918 -13.4700 -13.4700 -13.4135 -13.4135 -13.3940 -13.3940 -1.6854 -1.6854 -0.4333 -0.4333 2.9837 2.9837 4.1151 4.1151 4.9284 4.9284 5.0229 5.0229 5.0761 5.0761 5.2322 5.2322 5.2908 5.2908 5.5549 5.5549 5.6555 5.6555 6.3494 6.3494 6.4268 6.4268 6.4924 6.4924 6.6790 6.6790 7.1668 7.1668 8.6887 8.6887 8.7631 8.7631 9.8597 9.8597 10.1038 10.1038 11.3279 11.3279 11.4970 11.4970 k = 0.0000 0.3250 0.2578 ( 4424 PWs) bands (ev): -32.5419 -32.5419 -32.5298 -32.5298 -13.8499 -13.8499 -13.8104 -13.8104 -13.4919 -13.4919 -13.4710 -13.4710 -13.4138 -13.4138 -13.3946 -13.3946 -1.6329 -1.6329 -0.4387 -0.4387 2.9882 2.9882 4.0632 4.0632 4.9510 4.9510 5.0036 5.0036 5.0812 5.0812 5.2184 5.2184 5.2995 5.2995 5.5362 5.5362 5.6764 5.6764 6.3353 6.3353 6.4061 6.4061 6.4665 6.4665 6.6848 6.6848 7.1664 7.1664 8.7137 8.7137 8.7454 8.7454 9.7761 9.7761 10.0540 10.0540 11.3659 11.3659 11.5512 11.5512 k = 0.0000 0.3375 0.2578 ( 4416 PWs) bands (ev): -32.5414 -32.5414 -32.5300 -32.5300 -13.8497 -13.8497 -13.8128 -13.8128 -13.4920 -13.4920 -13.4721 -13.4721 -13.4140 -13.4140 -13.3952 -13.3952 -1.5793 -1.5793 -0.4473 -0.4473 2.9938 2.9938 4.0091 4.0091 4.9590 4.9590 5.0014 5.0014 5.0884 5.0884 5.2057 5.2057 5.3085 5.3085 5.5161 5.5161 5.6993 5.6993 6.3197 6.3197 6.3856 6.3856 6.4408 6.4408 6.6934 6.6934 7.1643 7.1643 8.6755 8.6755 8.7970 8.7970 9.6927 9.6927 10.0049 10.0049 11.4064 11.4064 11.6055 11.6055 k = 0.0000 0.3500 0.2578 ( 4418 PWs) bands (ev): -32.5408 -32.5408 -32.5303 -32.5303 -13.8494 -13.8494 -13.8153 -13.8153 -13.4921 -13.4921 -13.4732 -13.4732 -13.4141 -13.4141 -13.3959 -13.3959 -1.5247 -1.5247 -0.4590 -0.4590 3.0009 3.0009 3.9532 3.9532 4.9488 4.9488 5.0196 5.0196 5.0965 5.0965 5.1951 5.1951 5.3174 5.3174 5.4956 5.4956 5.7234 5.7234 6.3028 6.3028 6.3653 6.3653 6.4153 6.4153 6.7046 6.7046 7.1601 7.1601 8.6430 8.6430 8.8492 8.8492 9.6099 9.6099 9.9566 9.9566 11.4491 11.4491 11.6590 11.6592 k = 0.0000 0.3625 0.2578 ( 4414 PWs) bands (ev): -32.5403 -32.5403 -32.5305 -32.5305 -13.8491 -13.8491 -13.8177 -13.8177 -13.4921 -13.4921 -13.4744 -13.4744 -13.4140 -13.4140 -13.3966 -13.3966 -1.4693 -1.4693 -0.4741 -0.4741 3.0099 3.0099 3.8961 3.8961 4.9367 4.9367 5.0403 5.0403 5.1052 5.1052 5.1882 5.1882 5.3261 5.3261 5.4752 5.4752 5.7482 5.7482 6.2848 6.2848 6.3455 6.3455 6.3901 6.3901 6.7181 6.7181 7.1538 7.1538 8.6175 8.6175 8.9007 8.9007 9.5280 9.5280 9.9091 9.9091 11.4934 11.4934 11.7103 11.7107 k = 0.0000 0.3750 0.2578 ( 4414 PWs) bands (ev): -32.5398 -32.5398 -32.5308 -32.5308 -13.8486 -13.8486 -13.8201 -13.8201 -13.4920 -13.4920 -13.4756 -13.4756 -13.4138 -13.4138 -13.3974 -13.3974 -1.4132 -1.4132 -0.4927 -0.4927 3.0211 3.0211 3.8382 3.8382 4.9271 4.9271 5.0561 5.0561 5.1146 5.1146 5.1873 5.1873 5.3342 5.3342 5.4552 5.4552 5.7735 5.7735 6.2659 6.2659 6.3263 6.3263 6.3655 6.3655 6.7335 6.7335 7.1452 7.1452 8.5992 8.5992 8.9514 8.9514 9.4475 9.4475 9.8622 9.8622 11.5387 11.5387 11.7581 11.7583 k = 0.0000 0.3875 0.2578 ( 4416 PWs) bands (ev): -32.5392 -32.5392 -32.5312 -32.5312 -13.8482 -13.8482 -13.8223 -13.8223 -13.4919 -13.4919 -13.4768 -13.4768 -13.4134 -13.4134 -13.3982 -13.3982 -1.3566 -1.3566 -0.5148 -0.5148 3.0348 3.0348 3.7800 3.7800 4.9204 4.9204 5.0634 5.0634 5.1251 5.1251 5.1941 5.1941 5.3414 5.3414 5.4359 5.4359 5.7992 5.7992 6.2462 6.2462 6.3079 6.3079 6.3416 6.3416 6.7508 6.7508 7.1342 7.1342 8.5880 8.5880 9.0013 9.0013 9.3687 9.3687 9.8160 9.8160 11.5845 11.5845 11.8031 11.8036 k = 0.0000 0.4000 0.2578 ( 4416 PWs) bands (ev): -32.5387 -32.5387 -32.5315 -32.5315 -13.8476 -13.8476 -13.8246 -13.8246 -13.4917 -13.4917 -13.4780 -13.4780 -13.4129 -13.4129 -13.3990 -13.3990 -1.2997 -1.2997 -0.5405 -0.5405 3.0514 3.0514 3.7219 3.7219 4.9168 4.9168 5.0620 5.0620 5.1370 5.1370 5.2082 5.2082 5.3469 5.3469 5.4179 5.4179 5.8253 5.8253 6.2259 6.2259 6.2903 6.2903 6.3188 6.3188 6.7695 6.7695 7.1209 7.1209 8.5841 8.5841 9.0504 9.0504 9.2919 9.2919 9.7703 9.7703 11.6301 11.6301 11.8474 11.8478 k = 0.0000 0.4125 0.2578 ( 4420 PWs) bands (ev): -32.5382 -32.5382 -32.5319 -32.5319 -13.8470 -13.8470 -13.8267 -13.8267 -13.4914 -13.4914 -13.4793 -13.4793 -13.4124 -13.4124 -13.3999 -13.3999 -1.2427 -1.2427 -0.5697 -0.5697 3.0710 3.0710 3.6641 3.6641 4.9159 4.9159 5.0547 5.0547 5.1497 5.1497 5.2268 5.2268 5.3495 5.3495 5.4024 5.4024 5.8516 5.8516 6.2048 6.2048 6.2739 6.2739 6.2973 6.2973 6.7896 6.7896 7.1053 7.1053 8.5873 8.5873 9.0986 9.0986 9.2174 9.2174 9.7253 9.7253 11.6749 11.6749 11.8914 11.8914 k = 0.0000 0.4250 0.2578 ( 4420 PWs) bands (ev): -32.5376 -32.5376 -32.5322 -32.5322 -13.8462 -13.8462 -13.8288 -13.8288 -13.4911 -13.4911 -13.4805 -13.4805 -13.4117 -13.4117 -13.4008 -13.4008 -1.1858 -1.1858 -0.6023 -0.6023 3.0938 3.0938 3.6072 3.6072 4.9177 4.9177 5.0442 5.0442 5.1628 5.1628 5.2471 5.2471 5.3474 5.3474 5.3911 5.3911 5.8781 5.8781 6.1831 6.1831 6.2590 6.2590 6.2776 6.2776 6.8109 6.8109 7.0878 7.0878 8.5973 8.5973 9.1452 9.1452 9.1463 9.1463 9.6806 9.6806 11.7182 11.7182 11.9353 11.9353 k = 0.0000 0.4375 0.2578 ( 4424 PWs) bands (ev): -32.5371 -32.5371 -32.5326 -32.5326 -13.8454 -13.8454 -13.8309 -13.8309 -13.4906 -13.4906 -13.4817 -13.4817 -13.4110 -13.4110 -13.4017 -13.4017 -1.1293 -1.1293 -0.6382 -0.6382 3.1200 3.1200 3.5514 3.5514 4.9218 4.9218 5.0320 5.0320 5.1763 5.1763 5.2665 5.2665 5.3401 5.3401 5.3850 5.3850 5.9047 5.9047 6.1606 6.1606 6.2457 6.2457 6.2602 6.2602 6.8332 6.8332 7.0684 7.0684 8.6140 8.6140 9.0766 9.0766 9.1927 9.1927 9.6364 9.6364 11.7593 11.7593 11.9768 11.9775 k = 0.0000 0.4500 0.2578 ( 4430 PWs) bands (ev): -32.5366 -32.5366 -32.5330 -32.5330 -13.8444 -13.8444 -13.8328 -13.8328 -13.4901 -13.4901 -13.4828 -13.4828 -13.4102 -13.4102 -13.4027 -13.4027 -1.0733 -1.0733 -0.6772 -0.6772 3.1496 3.1496 3.4971 3.4971 4.9278 4.9278 5.0189 5.0189 5.1902 5.1902 5.2816 5.2816 5.3317 5.3317 5.3820 5.3820 5.9314 5.9314 6.1373 6.1373 6.2344 6.2344 6.2452 6.2452 6.8564 6.8564 7.0475 7.0475 8.6371 8.6371 9.0109 9.0109 9.2387 9.2387 9.5924 9.5924 11.7978 11.7978 11.9841 11.9842 k = 0.0000 0.4625 0.2578 ( 4426 PWs) bands (ev): -32.5361 -32.5361 -32.5334 -32.5334 -13.8433 -13.8433 -13.8346 -13.8346 -13.4894 -13.4894 -13.4840 -13.4840 -13.4094 -13.4094 -13.4036 -13.4036 -1.0181 -1.0181 -0.7192 -0.7192 3.1825 3.1825 3.4447 3.4447 4.9356 4.9356 5.0056 5.0056 5.2046 5.2046 5.2859 5.2859 5.3306 5.3306 5.3793 5.3793 5.9580 5.9580 6.1133 6.1133 6.2254 6.2254 6.2332 6.2332 6.8801 6.8801 7.0253 7.0253 8.6661 8.6661 8.9487 8.9487 9.2840 9.2840 9.5486 9.5486 11.8332 11.8332 11.9736 11.9736 k = 0.0000 0.4750 0.2578 ( 4440 PWs) bands (ev): -32.5357 -32.5357 -32.5338 -32.5338 -13.8422 -13.8422 -13.8364 -13.8364 -13.4887 -13.4887 -13.4851 -13.4851 -13.4085 -13.4085 -13.4046 -13.4046 -0.9640 -0.9640 -0.7638 -0.7638 3.2188 3.2188 3.3942 3.3942 4.9449 4.9449 4.9923 4.9923 5.2193 5.2193 5.2777 5.2777 5.3392 5.3392 5.3751 5.3751 5.9846 5.9846 6.0884 6.0884 6.2191 6.2191 6.2241 6.2241 6.9044 6.9044 7.0019 7.0019 8.7008 8.7008 8.8903 8.8903 9.3288 9.3288 9.5049 9.5049 11.8652 11.8652 11.9585 11.9585 k = 0.0000 0.4875 0.2578 ( 4440 PWs) bands (ev): -32.5352 -32.5352 -32.5343 -32.5343 -13.8409 -13.8409 -13.8380 -13.8380 -13.4879 -13.4879 -13.4861 -13.4861 -13.4076 -13.4076 -13.4056 -13.4056 -0.9112 -0.9112 -0.8109 -0.8109 3.2583 3.2583 3.3462 3.3462 4.9555 4.9555 4.9794 4.9794 5.2343 5.2343 5.2643 5.2643 5.3505 5.3505 5.3691 5.3691 6.0110 6.0110 6.0631 6.0631 6.2158 6.2158 6.2182 6.2182 6.9290 6.9290 6.9780 6.9780 8.7410 8.7410 8.8360 8.8360 9.3732 9.3732 9.4611 9.4611 11.8936 11.8936 11.9402 11.9402 k = 0.0000 0.5000 0.2578 ( 4440 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8395 -13.8395 -13.8395 -13.8395 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8601 -0.8601 -0.8601 -0.8601 3.3008 3.3008 3.3008 3.3008 4.9670 4.9670 4.9670 4.9670 5.2494 5.2494 5.2494 5.2494 5.3608 5.3608 5.3608 5.3608 6.0372 6.0372 6.0372 6.0372 6.2154 6.2154 6.2154 6.2154 6.9536 6.9536 6.9536 6.9536 8.7861 8.7861 8.7861 8.7861 9.4173 9.4173 9.4173 9.4173 11.9186 11.9186 11.9186 11.9186 k = 0.0000 0.5000 0.2578 ( 4440 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8395 -13.8395 -13.8395 -13.8395 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8601 -0.8601 -0.8601 -0.8601 3.3008 3.3008 3.3008 3.3008 4.9670 4.9670 4.9670 4.9670 5.2494 5.2494 5.2494 5.2494 5.3608 5.3608 5.3608 5.3608 6.0372 6.0372 6.0372 6.0372 6.2154 6.2154 6.2154 6.2154 6.9536 6.9536 6.9536 6.9536 8.7861 8.7861 8.7861 8.7861 9.4173 9.4173 9.4173 9.4173 11.9186 11.9186 11.9186 11.9186 k = 0.0125 0.5000 0.2578 ( 4452 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8398 -13.8398 -13.8392 -13.8392 -13.4884 -13.4884 -13.4857 -13.4857 -13.4077 -13.4077 -13.4057 -13.4057 -0.8593 -0.8593 -0.8592 -0.8592 3.3013 3.3013 3.3020 3.3020 4.9606 4.9606 4.9662 4.9662 5.2487 5.2487 5.2561 5.2561 5.3608 5.3608 5.3621 5.3621 6.0352 6.0352 6.0354 6.0354 6.2171 6.2171 6.2173 6.2173 6.9520 6.9520 6.9537 6.9537 8.7840 8.7840 8.7842 8.7842 9.4097 9.4097 9.4125 9.4125 11.9067 11.9067 11.9117 11.9117 k = 0.0250 0.5000 0.2578 ( 4436 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8401 -13.8401 -13.8389 -13.8389 -13.4897 -13.4897 -13.4844 -13.4844 -13.4089 -13.4089 -13.4048 -13.4048 -0.8567 -0.8567 -0.8565 -0.8565 3.3033 3.3033 3.3047 3.3047 4.9479 4.9479 4.9583 4.9583 5.2541 5.2541 5.2681 5.2681 5.3623 5.3623 5.3650 5.3650 6.0297 6.0297 6.0303 6.0303 6.2222 6.2222 6.2227 6.2227 6.9491 6.9491 6.9526 6.9526 8.7777 8.7777 8.7782 8.7782 9.3901 9.3901 9.3955 9.3955 11.8795 11.8795 11.8886 11.8886 k = 0.0375 0.5000 0.2578 ( 4428 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8405 -13.8405 -13.8387 -13.8387 -13.4911 -13.4911 -13.4831 -13.4831 -13.4102 -13.4102 -13.4041 -13.4041 -0.8525 -0.8525 -0.8522 -0.8522 3.3070 3.3070 3.3091 3.3091 4.9302 4.9302 4.9440 4.9440 5.2645 5.2645 5.2839 5.2839 5.3655 5.3655 5.3694 5.3694 6.0214 6.0214 6.0223 6.0223 6.2300 6.2300 6.2308 6.2308 6.9448 6.9448 6.9501 6.9501 8.7673 8.7673 8.7680 8.7680 9.3592 9.3592 9.3671 9.3672 11.8428 11.8428 11.8546 11.8546 k = 0.0500 0.5000 0.2578 ( 4420 PWs) bands (ev): -32.5346 -32.5346 -32.5346 -32.5346 -13.8409 -13.8409 -13.8384 -13.8384 -13.4924 -13.4924 -13.4818 -13.4818 -13.4116 -13.4116 -13.4035 -13.4035 -0.8465 -0.8465 -0.8461 -0.8461 3.3122 3.3122 3.3150 3.3150 4.9087 4.9087 4.9248 4.9248 5.2784 5.2784 5.3022 5.3022 5.3704 5.3704 5.3754 5.3754 6.0108 6.0108 6.0122 6.0122 6.2399 6.2399 6.2411 6.2411 6.9392 6.9392 6.9462 6.9462 8.7525 8.7525 8.7533 8.7533 9.3184 9.3184 9.3286 9.3286 11.8018 11.8018 11.8150 11.8150 k = 0.0625 0.5000 0.2578 ( 4424 PWs) bands (ev): -32.5346 -32.5346 -32.5346 -32.5346 -13.8413 -13.8413 -13.8383 -13.8383 -13.4938 -13.4938 -13.4806 -13.4806 -13.4132 -13.4132 -13.4031 -13.4031 -0.8388 -0.8388 -0.8383 -0.8383 3.3188 3.3188 3.3224 3.3224 4.8845 4.8845 4.9019 4.9019 5.2943 5.2943 5.3217 5.3217 5.3772 5.3772 5.3833 5.3833 5.9985 5.9985 6.0005 6.0005 6.2511 6.2511 6.2528 6.2528 6.9322 6.9322 6.9411 6.9411 8.7331 8.7331 8.7339 8.7339 9.2692 9.2692 9.2813 9.2813 11.7595 11.7596 11.7731 11.7731 k = 0.0750 0.5000 0.2578 ( 4436 PWs) bands (ev): -32.5345 -32.5345 -32.5345 -32.5345 -13.8418 -13.8418 -13.8381 -13.8381 -13.4952 -13.4952 -13.4794 -13.4794 -13.4149 -13.4149 -13.4028 -13.4028 -0.8295 -0.8295 -0.8289 -0.8289 3.3268 3.3268 3.3311 3.3311 4.8584 4.8584 4.8763 4.8763 5.3108 5.3108 5.3410 5.3410 5.3863 5.3863 5.3935 5.3935 5.9852 5.9852 5.9879 5.9879 6.2631 6.2631 6.2654 6.2654 6.9240 6.9240 6.9348 6.9348 8.7088 8.7088 8.7094 8.7094 9.2134 9.2134 9.2271 9.2271 11.7175 11.7175 11.7309 11.7309 k = 0.0875 0.5000 0.2578 ( 4440 PWs) bands (ev): -32.5344 -32.5344 -32.5344 -32.5344 -13.8422 -13.8422 -13.8380 -13.8380 -13.4966 -13.4966 -13.4782 -13.4782 -13.4167 -13.4167 -13.4026 -13.4026 -0.8185 -0.8185 -0.8178 -0.8178 3.3360 3.3360 3.3412 3.3412 4.8309 4.8309 4.8488 4.8488 5.3270 5.3270 5.3592 5.3592 5.3981 5.3981 5.4067 5.4067 5.9712 5.9712 5.9748 5.9748 6.2754 6.2754 6.2785 6.2785 6.9145 6.9145 6.9273 6.9273 8.6794 8.6794 8.6796 8.6796 9.1529 9.1529 9.1677 9.1677 11.6767 11.6767 11.6894 11.6894 k = 0.1000 0.5000 0.2578 ( 4436 PWs) bands (ev): -32.5343 -32.5343 -32.5343 -32.5343 -13.8427 -13.8427 -13.8380 -13.8380 -13.4980 -13.4980 -13.4771 -13.4771 -13.4186 -13.4186 -13.4026 -13.4026 -0.8059 -0.8059 -0.8052 -0.8052 3.3464 3.3464 3.3524 3.3524 4.8026 4.8026 4.8201 4.8201 5.3421 5.3421 5.3755 5.3755 5.4127 5.4127 5.4233 5.4233 5.9570 5.9570 5.9616 5.9616 6.2878 6.2878 6.2917 6.2917 6.9039 6.9039 6.9187 6.9187 8.6440 8.6440 8.6445 8.6445 9.0895 9.0895 9.1049 9.1049 11.6375 11.6375 11.6495 11.6495 k = 0.1125 0.5000 0.2578 ( 4440 PWs) bands (ev): -32.5342 -32.5342 -32.5342 -32.5342 -13.8432 -13.8432 -13.8380 -13.8380 -13.4993 -13.4993 -13.4760 -13.4760 -13.4206 -13.4206 -13.4026 -13.4026 -0.7918 -0.7918 -0.7909 -0.7909 3.3577 3.3577 3.3645 3.3645 4.7738 4.7738 4.7905 4.7905 5.3558 5.3558 5.3900 5.3900 5.4299 5.4299 5.4426 5.4426 5.9425 5.9425 5.9483 5.9483 6.2999 6.2999 6.3048 6.3048 6.8921 6.8921 6.9091 6.9091 8.6025 8.6025 8.6040 8.6040 9.0248 9.0248 9.0402 9.0402 11.6004 11.6004 11.6115 11.6115 k = 0.1250 0.5000 0.2578 ( 4440 PWs) bands (ev): -32.5341 -32.5341 -32.5341 -32.5341 -13.8437 -13.8437 -13.8380 -13.8380 -13.5007 -13.5007 -13.4749 -13.4749 -13.4227 -13.4227 -13.4028 -13.4028 -0.7761 -0.7761 -0.7752 -0.7752 3.3698 3.3698 3.3775 3.3775 4.7448 4.7448 4.7605 4.7605 5.3684 5.3684 5.4035 5.4035 5.4490 5.4490 5.4638 5.4638 5.9282 5.9282 5.9354 5.9354 6.3115 6.3115 6.3175 6.3175 6.8793 6.8793 6.8985 6.8985 8.5548 8.5548 8.5576 8.5576 8.9601 8.9601 8.9751 8.9751 11.5657 11.5657 11.5759 11.5759 k = 0.1375 0.5000 0.2578 ( 4436 PWs) bands (ev): -32.5340 -32.5340 -32.5340 -32.5340 -13.8442 -13.8442 -13.8380 -13.8380 -13.5020 -13.5020 -13.4739 -13.4739 -13.4248 -13.4248 -13.4030 -13.4030 -0.7590 -0.7590 -0.7579 -0.7579 3.3824 3.3824 3.3911 3.3911 4.7160 4.7160 4.7305 4.7305 5.3804 5.3804 5.4166 5.4166 5.4695 5.4695 5.4859 5.4859 5.9140 5.9140 5.9228 5.9228 6.3224 6.3224 6.3296 6.3296 6.8657 6.8657 6.8872 6.8872 8.5013 8.5013 8.5056 8.5056 8.8963 8.8963 8.9105 8.9105 11.5338 11.5338 11.5430 11.5430 k = 0.1500 0.5000 0.2578 ( 4424 PWs) bands (ev): -32.5339 -32.5339 -32.5339 -32.5339 -13.8446 -13.8446 -13.8381 -13.8381 -13.5032 -13.5032 -13.4729 -13.4729 -13.4270 -13.4270 -13.4033 -13.4033 -0.7404 -0.7404 -0.7393 -0.7393 3.3953 3.3953 3.4049 3.4049 4.6877 4.6877 4.7008 4.7008 5.3920 5.3920 5.4296 5.4296 5.4907 5.4907 5.5085 5.5085 5.9003 5.9003 5.9108 5.9108 6.3326 6.3326 6.3410 6.3410 6.8512 6.8512 6.8752 6.8752 8.4426 8.4426 8.4486 8.4486 8.8338 8.8338 8.8468 8.8468 11.5049 11.5049 11.5133 11.5133 k = 0.1625 0.5000 0.2578 ( 4416 PWs) bands (ev): -32.5337 -32.5337 -32.5337 -32.5337 -13.8452 -13.8452 -13.8383 -13.8383 -13.5044 -13.5044 -13.4720 -13.4720 -13.4292 -13.4292 -13.4038 -13.4038 -0.7205 -0.7205 -0.7193 -0.7193 3.4081 3.4081 3.4188 3.4188 4.6601 4.6601 4.6717 4.6717 5.4034 5.4034 5.4428 5.4428 5.5122 5.5122 5.5311 5.5311 5.8870 5.8870 5.8996 5.8996 6.3417 6.3417 6.3515 6.3515 6.8361 6.8361 6.8625 6.8625 8.3797 8.3797 8.3872 8.3872 8.7725 8.7725 8.7843 8.7843 11.4793 11.4793 11.4870 11.4870 k = 0.1750 0.5000 0.2578 ( 4416 PWs) bands (ev): -32.5336 -32.5336 -32.5336 -32.5336 -13.8457 -13.8457 -13.8385 -13.8385 -13.5056 -13.5056 -13.4711 -13.4711 -13.4314 -13.4314 -13.4043 -13.4043 -0.6993 -0.6993 -0.6980 -0.6980 3.4206 3.4206 3.4323 3.4323 4.6337 4.6337 4.6437 4.6437 5.4148 5.4148 5.4562 5.4562 5.5336 5.5336 5.5534 5.5534 5.8743 5.8743 5.8891 5.8891 6.3497 6.3497 6.3609 6.3609 6.8205 6.8205 6.8494 6.8494 8.3137 8.3137 8.3226 8.3226 8.7120 8.7120 8.7225 8.7225 11.4574 11.4574 11.4643 11.4643 k = 0.1875 0.5000 0.2578 ( 4420 PWs) bands (ev): -32.5335 -32.5335 -32.5335 -32.5335 -13.8463 -13.8463 -13.8388 -13.8388 -13.5067 -13.5067 -13.4703 -13.4703 -13.4336 -13.4336 -13.4049 -13.4049 -0.6770 -0.6770 -0.6756 -0.6756 3.4323 3.4323 3.4451 3.4451 4.6089 4.6089 4.6171 4.6171 5.4261 5.4261 5.4697 5.4697 5.5546 5.5546 5.5754 5.5754 5.8622 5.8622 5.8796 5.8796 6.3566 6.3566 6.3691 6.3691 6.8044 6.8044 6.8360 6.8360 8.2458 8.2458 8.2558 8.2558 8.6519 8.6519 8.6613 8.6613 11.4393 11.4393 11.4456 11.4456 k = 0.2000 0.5000 0.2578 ( 4424 PWs) bands (ev): -32.5333 -32.5333 -32.5333 -32.5333 -13.8468 -13.8468 -13.8391 -13.8391 -13.5078 -13.5078 -13.4696 -13.4696 -13.4358 -13.4358 -13.4056 -13.4056 -0.6535 -0.6535 -0.6520 -0.6520 3.4429 3.4429 3.4568 3.4568 4.5859 4.5859 4.5923 4.5923 5.4374 5.4374 5.4833 5.4833 5.5751 5.5751 5.5968 5.5968 5.8510 5.8510 5.8713 5.8713 6.3621 6.3621 6.3760 6.3760 6.7882 6.7882 6.8223 6.8223 8.1772 8.1772 8.1880 8.1880 8.5918 8.5918 8.6003 8.6003 11.4253 11.4253 11.4310 11.4310 k = 0.2125 0.5000 0.2578 ( 4424 PWs) bands (ev): -32.5332 -32.5332 -32.5332 -32.5332 -13.8474 -13.8474 -13.8395 -13.8395 -13.5088 -13.5088 -13.4691 -13.4691 -13.4379 -13.4379 -13.4063 -13.4063 -0.6290 -0.6290 -0.6275 -0.6275 3.4518 3.4518 3.4668 3.4668 4.5653 4.5653 4.5699 4.5699 5.4486 5.4486 5.4970 5.4970 5.5948 5.5948 5.6175 5.6175 5.8407 5.8407 5.8642 5.8642 6.3663 6.3663 6.3815 6.3815 6.7719 6.7719 6.8087 6.8087 8.1088 8.1088 8.1200 8.1200 8.5315 8.5315 8.5391 8.5391 11.4154 11.4154 11.4207 11.4207 k = 0.2250 0.5000 0.2578 ( 4416 PWs) bands (ev): -32.5330 -32.5330 -32.5330 -32.5330 -13.8480 -13.8480 -13.8399 -13.8399 -13.5097 -13.5097 -13.4686 -13.4686 -13.4399 -13.4399 -13.4071 -13.4071 -0.6036 -0.6036 -0.6020 -0.6020 3.4588 3.4588 3.4748 3.4748 4.5475 4.5475 4.5503 4.5503 5.4597 5.4597 5.5105 5.5105 5.6134 5.6134 5.6373 5.6373 5.8316 5.8316 5.8584 5.8584 6.3693 6.3693 6.3856 6.3856 6.7559 6.7559 6.7950 6.7950 8.0414 8.0414 8.0526 8.0526 8.4706 8.4706 8.4777 8.4777 11.4099 11.4099 11.4146 11.4146 k = 0.2375 0.5000 0.2578 ( 4428 PWs) bands (ev): -32.5329 -32.5329 -32.5329 -32.5329 -13.8486 -13.8486 -13.8404 -13.8404 -13.5105 -13.5105 -13.4684 -13.4684 -13.4418 -13.4418 -13.4080 -13.4080 -0.5774 -0.5774 -0.5758 -0.5758 3.4633 3.4633 3.4802 3.4802 4.5329 4.5329 4.5340 4.5340 5.4705 5.4705 5.5237 5.5237 5.6309 5.6309 5.6560 5.6560 5.8236 5.8236 5.8542 5.8542 6.3709 6.3709 6.3883 6.3883 6.7401 6.7401 6.7815 6.7815 7.9756 7.9756 7.9865 7.9865 8.4092 8.4092 8.4158 8.4158 11.4086 11.4086 11.4129 11.4129 k = 0.2500 0.5000 0.2578 ( 4424 PWs) bands (ev): -32.5327 -32.5327 -32.5327 -32.5327 -13.8491 -13.8491 -13.8409 -13.8409 -13.5112 -13.5112 -13.4684 -13.4684 -13.4434 -13.4434 -13.4089 -13.4089 -0.5506 -0.5506 -0.5489 -0.5489 3.4651 3.4651 3.4828 3.4828 4.5213 4.5213 4.5218 4.5218 5.4810 5.4810 5.5365 5.5365 5.6469 5.6469 5.6735 5.6735 5.8172 5.8172 5.8516 5.8516 6.3716 6.3716 6.3898 6.3898 6.7247 6.7247 6.7683 6.7683 7.9117 7.9117 7.9220 7.9220 8.3474 8.3474 8.3538 8.3538 11.4116 11.4116 11.4155 11.4155 k = 0.2625 0.5000 0.2578 ( 4428 PWs) bands (ev): -32.5325 -32.5325 -32.5325 -32.5325 -13.8497 -13.8497 -13.8415 -13.8415 -13.5119 -13.5119 -13.4687 -13.4687 -13.4447 -13.4447 -13.4099 -13.4099 -0.5232 -0.5232 -0.5215 -0.5215 3.4638 3.4638 3.4821 3.4821 4.5126 4.5126 4.5145 4.5145 5.4911 5.4911 5.5486 5.5486 5.6614 5.6614 5.6896 5.6896 5.8123 5.8123 5.8506 5.8506 6.3714 6.3714 6.3900 6.3900 6.7100 6.7100 6.7552 6.7552 7.8501 7.8501 7.8595 7.8595 8.2855 8.2855 8.2919 8.2919 11.4187 11.4187 11.4223 11.4223 k = 0.2750 0.5000 0.2578 ( 4432 PWs) bands (ev): -32.5324 -32.5324 -32.5324 -32.5324 -13.8503 -13.8503 -13.8422 -13.8422 -13.5124 -13.5124 -13.4694 -13.4694 -13.4457 -13.4457 -13.4109 -13.4109 -0.4954 -0.4954 -0.4937 -0.4937 3.4592 3.4592 3.4779 3.4779 4.5081 4.5081 4.5113 4.5113 5.5006 5.5006 5.5600 5.5600 5.6743 5.6743 5.7038 5.7038 5.8093 5.8093 5.8512 5.8512 6.3705 6.3705 6.3893 6.3893 6.6958 6.6958 6.7425 6.7425 7.7908 7.7908 7.7990 7.7990 8.2239 8.2239 8.2303 8.2303 11.4299 11.4299 11.4332 11.4332 k = 0.2875 0.5000 0.2578 ( 4428 PWs) bands (ev): -32.5322 -32.5322 -32.5322 -32.5322 -13.8508 -13.8508 -13.8428 -13.8428 -13.5129 -13.5129 -13.4703 -13.4703 -13.4463 -13.4463 -13.4119 -13.4119 -0.4675 -0.4675 -0.4657 -0.4657 3.4514 3.4514 3.4703 3.4703 4.5079 4.5079 4.5121 4.5121 5.5097 5.5097 5.5704 5.5704 5.6856 5.6856 5.7161 5.7161 5.8084 5.8084 5.8533 5.8533 6.3694 6.3694 6.3881 6.3881 6.6823 6.6823 6.7301 6.7301 7.7338 7.7338 7.7406 7.7406 8.1629 8.1629 8.1695 8.1695 11.4450 11.4450 11.4481 11.4481 k = 0.3000 0.5000 0.2578 ( 4420 PWs) bands (ev): -32.5321 -32.5321 -32.5321 -32.5321 -13.8513 -13.8513 -13.8435 -13.8435 -13.5132 -13.5132 -13.4715 -13.4715 -13.4467 -13.4467 -13.4130 -13.4130 -0.4394 -0.4394 -0.4377 -0.4377 3.4405 3.4405 3.4593 3.4593 4.5119 4.5119 4.5168 4.5168 5.5182 5.5182 5.5798 5.5798 5.6952 5.6952 5.7262 5.7262 5.8095 5.8095 5.8565 5.8565 6.3684 6.3684 6.3867 6.3867 6.6695 6.6695 6.7180 6.7180 7.6790 7.6790 7.6841 7.6841 8.1031 8.1031 8.1100 8.1100 11.4637 11.4637 11.4665 11.4665 k = 0.3125 0.5000 0.2578 ( 4424 PWs) bands (ev): -32.5319 -32.5319 -32.5319 -32.5319 -13.8518 -13.8518 -13.8442 -13.8442 -13.5134 -13.5134 -13.4731 -13.4731 -13.4467 -13.4467 -13.4141 -13.4141 -0.4115 -0.4115 -0.4098 -0.4098 3.4267 3.4267 3.4451 3.4451 4.5198 4.5198 4.5252 4.5252 5.5261 5.5261 5.5880 5.5880 5.7033 5.7033 5.7342 5.7342 5.8125 5.8125 5.8605 5.8605 6.3678 6.3678 6.3856 6.3856 6.6572 6.6572 6.7062 6.7062 7.6260 7.6260 7.6292 7.6292 8.0450 8.0450 8.0522 8.0522 11.4858 11.4858 11.4884 11.4884 k = 0.3250 0.5000 0.2578 ( 4436 PWs) bands (ev): -32.5318 -32.5318 -32.5318 -32.5318 -13.8523 -13.8523 -13.8450 -13.8450 -13.5135 -13.5135 -13.4748 -13.4748 -13.4465 -13.4465 -13.4153 -13.4153 -0.3840 -0.3840 -0.3822 -0.3822 3.4103 3.4103 3.4282 3.4282 4.5312 4.5312 4.5368 4.5368 5.5334 5.5334 5.5951 5.5951 5.7100 5.7100 5.7400 5.7400 5.8170 5.8170 5.8649 5.8649 6.3681 6.3681 6.3852 6.3852 6.6456 6.6456 6.6946 6.6946 7.5745 7.5745 7.5758 7.5758 7.9894 7.9894 7.9970 7.9970 11.5108 11.5108 11.5133 11.5133 k = 0.3375 0.5000 0.2578 ( 4440 PWs) bands (ev): -32.5317 -32.5317 -32.5317 -32.5317 -13.8527 -13.8527 -13.8457 -13.8457 -13.5134 -13.5134 -13.4767 -13.4767 -13.4461 -13.4461 -13.4165 -13.4165 -0.3569 -0.3569 -0.3552 -0.3552 3.3919 3.3919 3.4091 3.4091 4.5457 4.5457 4.5514 4.5514 5.5404 5.5404 5.6012 5.6012 5.7154 5.7154 5.7439 5.7439 5.8226 5.8226 5.8694 5.8694 6.3697 6.3697 6.3859 6.3859 6.6346 6.6346 6.6834 6.6834 7.5235 7.5235 7.5242 7.5242 7.9368 7.9368 7.9449 7.9449 11.5386 11.5386 11.5409 11.5409 k = 0.3500 0.5000 0.2578 ( 4432 PWs) bands (ev): -32.5315 -32.5315 -32.5315 -32.5315 -13.8531 -13.8531 -13.8465 -13.8465 -13.5133 -13.5133 -13.4787 -13.4787 -13.4454 -13.4454 -13.4177 -13.4177 -0.3306 -0.3306 -0.3289 -0.3289 3.3721 3.3721 3.3882 3.3882 4.5627 4.5627 4.5682 4.5682 5.5470 5.5470 5.6064 5.6064 5.7195 5.7195 5.7461 5.7461 5.8288 5.8288 5.8739 5.8739 6.3726 6.3726 6.3881 6.3881 6.6243 6.6243 6.6727 6.6727 7.4719 7.4719 7.4746 7.4746 7.8880 7.8880 7.8963 7.8963 11.5687 11.5687 11.5708 11.5708 k = 0.3625 0.5000 0.2578 ( 4428 PWs) bands (ev): -32.5314 -32.5314 -32.5314 -32.5314 -13.8535 -13.8535 -13.8472 -13.8472 -13.5130 -13.5130 -13.4807 -13.4807 -13.4447 -13.4447 -13.4189 -13.4189 -0.3052 -0.3052 -0.3036 -0.3036 3.3512 3.3512 3.3663 3.3663 4.5816 4.5816 4.5867 4.5867 5.5535 5.5535 5.6109 5.6109 5.7223 5.7223 5.7465 5.7465 5.8354 5.8354 5.8779 5.8779 6.3772 6.3772 6.3920 6.3920 6.6148 6.6148 6.6627 6.6627 7.4210 7.4210 7.4255 7.4255 7.8434 7.8434 7.8519 7.8519 11.6005 11.6005 11.6024 11.6024 k = 0.3750 0.5000 0.2578 ( 4428 PWs) bands (ev): -32.5313 -32.5313 -32.5313 -32.5313 -13.8538 -13.8538 -13.8480 -13.8480 -13.5125 -13.5125 -13.4828 -13.4828 -13.4439 -13.4439 -13.4201 -13.4201 -0.2810 -0.2810 -0.2795 -0.2795 3.3300 3.3300 3.3439 3.3439 4.6016 4.6016 4.6064 4.6064 5.5599 5.5599 5.6150 5.6150 5.7237 5.7237 5.7450 5.7450 5.8422 5.8422 5.8816 5.8816 6.3833 6.3833 6.3975 6.3975 6.6063 6.6063 6.6534 6.6534 7.3706 7.3706 7.3768 7.3768 7.8033 7.8033 7.8118 7.8118 11.6334 11.6334 11.6353 11.6353 k = 0.3875 0.5000 0.2578 ( 4428 PWs) bands (ev): -32.5312 -32.5312 -32.5312 -32.5312 -13.8541 -13.8541 -13.8487 -13.8487 -13.5120 -13.5120 -13.4850 -13.4850 -13.4430 -13.4430 -13.4214 -13.4214 -0.2582 -0.2582 -0.2567 -0.2567 3.3089 3.3089 3.3216 3.3216 4.6222 4.6222 4.6265 4.6265 5.5665 5.5665 5.6189 5.6189 5.7237 5.7237 5.7416 5.7416 5.8491 5.8491 5.8848 5.8848 6.3908 6.3908 6.4045 6.4045 6.5992 6.5992 6.6452 6.6452 7.3208 7.3208 7.3285 7.3285 7.7680 7.7680 7.7763 7.7763 11.6669 11.6669 11.6687 11.6687 k = 0.4000 0.5000 0.2578 ( 4436 PWs) bands (ev): -32.5311 -32.5311 -32.5311 -32.5311 -13.8543 -13.8543 -13.8495 -13.8495 -13.5114 -13.5114 -13.4871 -13.4871 -13.4420 -13.4420 -13.4227 -13.4227 -0.2370 -0.2370 -0.2357 -0.2357 3.2885 3.2885 3.2999 3.2999 4.6428 4.6428 4.6465 4.6465 5.5733 5.5733 5.6228 5.6228 5.7222 5.7222 5.7362 5.7362 5.8560 5.8560 5.8877 5.8877 6.3994 6.3994 6.4127 6.4127 6.5938 6.5938 6.6383 6.6383 7.2720 7.2720 7.2809 7.2809 7.7373 7.7373 7.7452 7.7452 11.7003 11.7003 11.7018 11.7018 k = 0.4125 0.5000 0.2578 ( 4436 PWs) bands (ev): -32.5310 -32.5310 -32.5310 -32.5310 -13.8545 -13.8545 -13.8502 -13.8502 -13.5106 -13.5106 -13.4891 -13.4891 -13.4410 -13.4410 -13.4239 -13.4239 -0.2177 -0.2177 -0.2165 -0.2165 3.2693 3.2693 3.2793 3.2793 4.6626 4.6626 4.6659 4.6659 5.5805 5.5805 5.6269 5.6269 5.7192 5.7192 5.7291 5.7291 5.8628 5.8628 5.8903 5.8903 6.4085 6.4085 6.4214 6.4214 6.5906 6.5906 6.6332 6.6332 7.2248 7.2248 7.2345 7.2345 7.7113 7.7113 7.7186 7.7186 11.7327 11.7327 11.7341 11.7341 k = 0.4250 0.5000 0.2578 ( 4432 PWs) bands (ev): -32.5309 -32.5309 -32.5309 -32.5309 -13.8546 -13.8546 -13.8508 -13.8508 -13.5097 -13.5097 -13.4912 -13.4912 -13.4399 -13.4399 -13.4252 -13.4252 -0.2004 -0.2004 -0.1993 -0.1993 3.2518 3.2518 3.2604 3.2604 4.6813 4.6813 4.6839 4.6839 5.5882 5.5882 5.6314 5.6314 5.7150 5.7150 5.7205 5.7205 5.8694 5.8694 5.8926 5.8926 6.4177 6.4177 6.4298 6.4298 6.5901 6.5901 6.6300 6.6300 7.1798 7.1798 7.1900 7.1900 7.6897 7.6897 7.6962 7.6962 11.7633 11.7633 11.7645 11.7645 k = 0.4375 0.5000 0.2578 ( 4444 PWs) bands (ev): -32.5308 -32.5308 -32.5308 -32.5308 -13.8546 -13.8546 -13.8515 -13.8515 -13.5087 -13.5087 -13.4932 -13.4932 -13.4388 -13.4388 -13.4265 -13.4265 -0.1854 -0.1854 -0.1845 -0.1845 3.2363 3.2363 3.2436 3.2436 4.6980 4.6980 4.7002 4.7002 5.5965 5.5965 5.6362 5.6362 5.7095 5.7095 5.7106 5.7106 5.8755 5.8755 5.8945 5.8945 6.4262 6.4262 6.4372 6.4372 6.5928 6.5928 6.6290 6.6290 7.1382 7.1382 7.1484 7.1484 7.6720 7.6720 7.6776 7.6776 11.7912 11.7912 11.7922 11.7922 k = 0.4500 0.5000 0.2578 ( 4444 PWs) bands (ev): -32.5308 -32.5308 -32.5308 -32.5308 -13.8546 -13.8546 -13.8520 -13.8520 -13.5076 -13.5076 -13.4951 -13.4951 -13.4377 -13.4377 -13.4278 -13.4278 -0.1728 -0.1728 -0.1721 -0.1721 3.2233 3.2233 3.2291 3.2291 4.7126 4.7126 4.7142 4.7142 5.6055 5.6055 5.6415 5.6415 5.6999 5.6999 5.7031 5.7031 5.8811 5.8811 5.8960 5.8960 6.4336 6.4336 6.4429 6.4429 6.5985 6.5985 6.6297 6.6297 7.1011 7.1011 7.1107 7.1107 7.6582 7.6582 7.6628 7.6628 11.8155 11.8155 11.8164 11.8164 k = 0.4625 0.5000 0.2578 ( 4444 PWs) bands (ev): -32.5308 -32.5308 -32.5308 -32.5308 -13.8545 -13.8545 -13.8526 -13.8526 -13.5064 -13.5064 -13.4970 -13.4970 -13.4365 -13.4365 -13.4290 -13.4290 -0.1628 -0.1628 -0.1623 -0.1623 3.2131 3.2131 3.2174 3.2174 4.7243 4.7243 4.7256 4.7256 5.6152 5.6152 5.6469 5.6469 5.6889 5.6889 5.6961 5.6961 5.8860 5.8860 5.8969 5.8969 6.4395 6.4395 6.4467 6.4467 6.6066 6.6066 6.6315 6.6315 7.0699 7.0699 7.0783 7.0783 7.6479 7.6479 7.6514 7.6514 11.8355 11.8355 11.8362 11.8362 k = 0.4750 0.5000 0.2578 ( 4444 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8543 -13.8543 -13.8531 -13.8531 -13.5051 -13.5051 -13.4988 -13.4988 -13.4353 -13.4353 -13.4303 -13.4303 -0.1556 -0.1556 -0.1552 -0.1552 3.2057 3.2057 3.2087 3.2087 4.7331 4.7331 4.7338 4.7338 5.6254 5.6254 5.6518 5.6518 5.6787 5.6787 5.6887 5.6887 5.8900 5.8900 5.8972 5.8972 6.4439 6.4439 6.4488 6.4488 6.6156 6.6156 6.6331 6.6331 7.0465 7.0465 7.0528 7.0528 7.6409 7.6409 7.6433 7.6433 11.8504 11.8504 11.8508 11.8508 k = 0.4875 0.5000 0.2578 ( 4452 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8541 -13.8541 -13.8535 -13.8535 -13.5036 -13.5036 -13.5005 -13.5005 -13.4341 -13.4341 -13.4316 -13.4316 -0.1512 -0.1512 -0.1510 -0.1510 3.2016 3.2016 3.2030 3.2030 4.7385 4.7385 4.7388 4.7388 5.6358 5.6358 5.6527 5.6527 5.6728 5.6728 5.6814 5.6814 5.8932 5.8932 5.8967 5.8967 6.4469 6.4469 6.4493 6.4493 6.6239 6.6239 6.6330 6.6330 7.0323 7.0323 7.0357 7.0357 7.6370 7.6370 7.6382 7.6382 11.8596 11.8596 11.8598 11.8598 k = 0.5000 0.5000 0.2578 ( 4456 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5021 -13.5021 -13.5021 -13.5021 -13.4328 -13.4328 -13.4328 -13.4328 -0.1496 -0.1496 -0.1496 -0.1496 3.2007 3.2007 3.2007 3.2007 4.7404 4.7404 4.7404 4.7404 5.6459 5.6459 5.6459 5.6459 5.6752 5.6752 5.6752 5.6752 5.8954 5.8954 5.8954 5.8954 6.4487 6.4487 6.4487 6.4487 6.6300 6.6300 6.6300 6.6300 7.0287 7.0287 7.0287 7.0287 7.6361 7.6361 7.6361 7.6361 11.8627 11.8627 11.8627 11.8627 k = 0.5000 0.5000 0.2578 ( 4456 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5021 -13.5021 -13.5021 -13.5021 -13.4328 -13.4328 -13.4328 -13.4328 -0.1496 -0.1496 -0.1496 -0.1496 3.2007 3.2007 3.2007 3.2007 4.7404 4.7404 4.7404 4.7404 5.6459 5.6459 5.6459 5.6459 5.6752 5.6752 5.6752 5.6752 5.8954 5.8954 5.8954 5.8954 6.4487 6.4487 6.4487 6.4487 6.6300 6.6300 6.6300 6.6300 7.0287 7.0287 7.0287 7.0287 7.6361 7.6361 7.6361 7.6361 11.8627 11.8627 11.8627 11.8627 k = 0.4911 0.4911 0.2578 ( 4452 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8541 -13.8541 -13.8535 -13.8535 -13.5037 -13.5037 -13.5005 -13.5005 -13.4341 -13.4341 -13.4316 -13.4316 -0.1525 -0.1525 -0.1497 -0.1497 3.2016 3.2016 3.2031 3.2031 4.7365 4.7365 4.7408 4.7408 5.6354 5.6354 5.6537 5.6537 5.6714 5.6714 5.6823 5.6823 5.8929 5.8929 5.8970 5.8970 6.4463 6.4463 6.4500 6.4500 6.6236 6.6236 6.6332 6.6332 7.0324 7.0324 7.0360 7.0360 7.6360 7.6360 7.6392 7.6392 11.8548 11.8548 11.8644 11.8644 k = 0.4821 0.4821 0.2578 ( 4436 PWs) bands (ev): -32.5308 -32.5308 -32.5307 -32.5307 -13.8543 -13.8543 -13.8530 -13.8530 -13.5051 -13.5051 -13.4987 -13.4987 -13.4353 -13.4353 -13.4303 -13.4303 -0.1611 -0.1611 -0.1500 -0.1500 3.2057 3.2057 3.2090 3.2090 4.7248 4.7248 4.7419 4.7419 5.6237 5.6237 5.6588 5.6588 5.6692 5.6692 5.6931 5.6931 5.8883 5.8883 5.8988 5.8988 6.4406 6.4406 6.4525 6.4525 6.6132 6.6132 6.6346 6.6346 7.0464 7.0464 7.0541 7.0541 7.6363 7.6363 7.6481 7.6481 11.8320 11.8320 11.8694 11.8694 k = 0.4732 0.4732 0.2578 ( 4440 PWs) bands (ev): -32.5308 -32.5308 -32.5307 -32.5307 -13.8545 -13.8545 -13.8525 -13.8525 -13.5064 -13.5064 -13.4969 -13.4969 -13.4365 -13.4365 -13.4290 -13.4290 -0.1752 -0.1752 -0.1504 -0.1504 3.2130 3.2130 3.2184 3.2184 4.7055 4.7055 4.7436 4.7436 5.6116 5.6116 5.6625 5.6625 5.6675 5.6675 5.7058 5.7058 5.8813 5.8813 5.9014 5.9014 6.4319 6.4319 6.4566 6.4566 6.5988 6.5988 6.6349 6.6349 7.0692 7.0692 7.0825 7.0825 7.6366 7.6366 7.6628 7.6628 11.7961 11.7961 11.8777 11.8777 k = 0.4643 0.4643 0.2578 ( 4440 PWs) bands (ev): -32.5309 -32.5309 -32.5307 -32.5307 -13.8547 -13.8547 -13.8519 -13.8519 -13.5077 -13.5077 -13.4950 -13.4950 -13.4377 -13.4377 -13.4277 -13.4277 -0.1949 -0.1949 -0.1511 -0.1511 3.2234 3.2234 3.2312 3.2312 4.6792 4.6792 4.7461 4.7461 5.5998 5.5998 5.6651 5.6651 5.6664 5.6664 5.7195 5.7195 5.8718 5.8718 5.9049 5.9049 6.4211 6.4211 6.4623 6.4623 6.5817 6.5817 6.6348 6.6348 7.0990 7.0990 7.1205 7.1205 7.6371 7.6371 7.6832 7.6832 11.7500 11.7500 11.8892 11.8892 k = 0.4554 0.4554 0.2578 ( 4434 PWs) bands (ev): -32.5311 -32.5311 -32.5306 -32.5306 -13.8547 -13.8547 -13.8512 -13.8512 -13.5088 -13.5088 -13.4930 -13.4930 -13.4389 -13.4389 -13.4264 -13.4264 -0.2197 -0.2197 -0.1519 -0.1519 3.2367 3.2367 3.2473 3.2473 4.6463 4.6463 4.7493 4.7493 5.5883 5.5883 5.6633 5.6633 5.6695 5.6695 5.7333 5.7333 5.8603 5.8603 5.9094 5.9094 6.4090 6.4090 6.4695 6.4695 6.5628 6.5628 6.6345 6.6345 7.1342 7.1342 7.1671 7.1671 7.6378 7.6378 7.7094 7.7094 11.6965 11.6965 11.9039 11.9039 k = 0.4464 0.4464 0.2578 ( 4420 PWs) bands (ev): -32.5312 -32.5312 -32.5306 -32.5306 -13.8547 -13.8547 -13.8505 -13.8505 -13.5098 -13.5098 -13.4910 -13.4910 -13.4400 -13.4400 -13.4250 -13.4250 -0.2495 -0.2495 -0.1530 -0.1530 3.2531 3.2531 3.2667 3.2667 4.6076 4.6076 4.7532 4.7532 5.5773 5.5773 5.6607 5.6607 5.6730 5.6730 5.7463 5.7463 5.8473 5.8473 5.9148 5.9148 6.3964 6.3964 6.4781 6.4781 6.5432 6.5432 6.6342 6.6342 7.1738 7.1738 7.2211 7.2211 7.6386 7.6386 7.7410 7.7410 11.6381 11.6381 11.9215 11.9215 k = 0.4375 0.4375 0.2578 ( 4428 PWs) bands (ev): -32.5314 -32.5314 -32.5305 -32.5305 -13.8548 -13.8548 -13.8496 -13.8496 -13.5106 -13.5106 -13.4889 -13.4889 -13.4412 -13.4412 -13.4237 -13.4237 -0.2840 -0.2840 -0.1543 -0.1543 3.2723 3.2723 3.2890 3.2890 4.5636 4.5636 4.7578 4.7578 5.5667 5.5667 5.6574 5.6574 5.6763 5.6763 5.7573 5.7573 5.8343 5.8343 5.9211 5.9211 6.3837 6.3837 6.4880 6.4880 6.5237 6.5237 6.6340 6.6340 7.2169 7.2169 7.2814 7.2814 7.6397 7.6397 7.7777 7.7777 11.5770 11.5770 11.9418 11.9418 k = 0.4286 0.4286 0.2578 ( 4436 PWs) bands (ev): -32.5317 -32.5317 -32.5305 -32.5305 -13.8548 -13.8548 -13.8487 -13.8487 -13.5114 -13.5114 -13.4868 -13.4868 -13.4423 -13.4423 -13.4224 -13.4224 -0.3228 -0.3228 -0.1559 -0.1559 3.2946 3.2946 3.3142 3.3142 4.5151 4.5151 4.7630 4.7630 5.5563 5.5563 5.6535 5.6535 5.6794 5.6794 5.7626 5.7626 5.8249 5.8249 5.9283 5.9283 6.3715 6.3715 6.4986 6.4986 6.5050 6.5050 6.6341 6.6341 7.2629 7.2629 7.3471 7.3471 7.6410 7.6410 7.8195 7.8195 11.5151 11.5151 11.9647 11.9647 k = 0.4196 0.4196 0.2578 ( 4436 PWs) bands (ev): -32.5319 -32.5319 -32.5305 -32.5305 -13.8547 -13.8547 -13.8477 -13.8477 -13.5121 -13.5121 -13.4846 -13.4846 -13.4434 -13.4434 -13.4211 -13.4211 -0.3655 -0.3655 -0.1578 -0.1578 3.3197 3.3197 3.3420 3.3420 4.4629 4.4629 4.7689 4.7689 5.5463 5.5463 5.6488 5.6488 5.6819 5.6819 5.7574 5.7574 5.8245 5.8245 5.9364 5.9364 6.3599 6.3599 6.4865 6.4865 6.5113 6.5113 6.6345 6.6345 7.3116 7.3116 7.4173 7.4173 7.6428 7.6428 7.8660 7.8660 11.4539 11.4539 11.9900 11.9900 k = 0.4107 0.4107 0.2578 ( 4438 PWs) bands (ev): -32.5322 -32.5322 -32.5304 -32.5304 -13.8547 -13.8547 -13.8466 -13.8466 -13.5126 -13.5126 -13.4824 -13.4824 -13.4445 -13.4445 -13.4198 -13.4198 -0.4118 -0.4118 -0.1600 -0.1600 3.3476 3.3476 3.3722 3.3722 4.4075 4.4075 4.7755 4.7755 5.5363 5.5363 5.6432 5.6432 5.6834 5.6834 5.7424 5.7424 5.8327 5.8327 5.9453 5.9453 6.3493 6.3493 6.4702 6.4702 6.5241 6.5241 6.6356 6.6356 7.3626 7.3626 7.4910 7.4910 7.6455 7.6455 7.9167 7.9167 11.3946 11.3946 12.0173 12.0173 k = 0.4018 0.4018 0.2578 ( 4438 PWs) bands (ev): -32.5325 -32.5325 -32.5304 -32.5304 -13.8546 -13.8546 -13.8454 -13.8454 -13.5130 -13.5130 -13.4801 -13.4801 -13.4455 -13.4455 -13.4185 -13.4185 -0.4613 -0.4613 -0.1625 -0.1625 3.3784 3.3784 3.4046 3.4046 4.3496 4.3496 4.7826 4.7826 5.5265 5.5265 5.6366 5.6366 5.6826 5.6826 5.7231 5.7231 5.8452 5.8452 5.9550 5.9550 6.3397 6.3397 6.4554 6.4554 6.5372 6.5372 6.6378 6.6378 7.4158 7.4158 7.5652 7.5652 7.6514 7.6514 7.9714 7.9714 11.3385 11.3385 12.0464 12.0464 k = 0.3929 0.3929 0.2578 ( 4434 PWs) bands (ev): -32.5328 -32.5328 -32.5303 -32.5303 -13.8544 -13.8544 -13.8441 -13.8441 -13.5133 -13.5133 -13.4778 -13.4778 -13.4465 -13.4465 -13.4172 -13.4172 -0.5137 -0.5137 -0.1654 -0.1654 3.4120 3.4120 3.4390 3.4390 4.2897 4.2897 4.7904 4.7904 5.5165 5.5165 5.6288 5.6288 5.6758 5.6758 5.7059 5.7059 5.8594 5.8594 5.9654 5.9654 6.3314 6.3314 6.4426 6.4426 6.5499 6.5499 6.6418 6.6418 7.4709 7.4709 7.6218 7.6218 7.6785 7.6785 8.0294 8.0294 11.2864 11.2864 12.0769 12.0769 k = 0.3839 0.3839 0.2578 ( 4438 PWs) bands (ev): -32.5332 -32.5332 -32.5302 -32.5302 -13.8543 -13.8543 -13.8427 -13.8427 -13.5134 -13.5134 -13.4755 -13.4755 -13.4474 -13.4474 -13.4159 -13.4159 -0.5686 -0.5686 -0.1688 -0.1688 3.4482 3.4482 3.4754 3.4754 4.2285 4.2285 4.7988 4.7988 5.5064 5.5064 5.6191 5.6191 5.6580 5.6580 5.6973 5.6973 5.8745 5.8745 5.9766 5.9766 6.3245 6.3245 6.4316 6.4316 6.5613 6.5613 6.6483 6.6483 7.5279 7.5279 7.6370 7.6370 7.7499 7.7499 8.0902 8.0902 11.2393 11.2393 12.1084 12.1084 k = 0.3750 0.3750 0.2578 ( 4444 PWs) bands (ev): -32.5336 -32.5336 -32.5302 -32.5302 -13.8542 -13.8542 -13.8412 -13.8412 -13.5135 -13.5135 -13.4732 -13.4732 -13.4483 -13.4483 -13.4146 -13.4146 -0.6256 -0.6256 -0.1725 -0.1725 3.4869 3.4869 3.5135 3.5135 4.1663 4.1663 4.8078 4.8078 5.4961 5.4961 5.6058 5.6058 5.6355 5.6355 5.6933 5.6933 5.8898 5.8898 5.9884 5.9884 6.3193 6.3193 6.4226 6.4226 6.5705 6.5705 6.6582 6.6582 7.5866 7.5866 7.6416 7.6416 7.8349 7.8349 8.1532 8.1532 11.1979 11.1979 12.1405 12.1405 k = 0.3661 0.3661 0.2578 ( 4438 PWs) bands (ev): -32.5340 -32.5340 -32.5301 -32.5301 -13.8540 -13.8540 -13.8397 -13.8397 -13.5133 -13.5133 -13.4709 -13.4709 -13.4491 -13.4491 -13.4133 -13.4133 -0.6844 -0.6844 -0.1767 -0.1767 3.5281 3.5281 3.5533 3.5533 4.1037 4.1037 4.8173 4.8173 5.4855 5.4855 5.5850 5.5850 5.6162 5.6162 5.6899 5.6899 5.9052 5.9052 6.0010 6.0010 6.3158 6.3158 6.4158 6.4158 6.5770 6.5770 6.6720 6.6720 7.6430 7.6430 7.6485 7.6485 7.9243 7.9243 8.2178 8.2178 11.1629 11.1629 12.1725 12.1726 k = 0.3571 0.3571 0.2578 ( 4438 PWs) bands (ev): -32.5344 -32.5344 -32.5300 -32.5300 -13.8539 -13.8539 -13.8380 -13.8380 -13.5131 -13.5131 -13.4687 -13.4687 -13.4497 -13.4497 -13.4121 -13.4121 -0.7446 -0.7446 -0.1815 -0.1815 3.5712 3.5712 3.5951 3.5951 4.0409 4.0409 4.8273 4.8273 5.4743 5.4743 5.5570 5.5570 5.6017 5.6017 5.6860 5.6860 5.9204 5.9204 6.0142 6.0142 6.3143 6.3143 6.4110 6.4110 6.5812 6.5812 6.6894 6.6894 7.6463 7.6463 7.7097 7.7097 8.0165 8.0165 8.2832 8.2832 11.1348 11.1348 12.2011 12.2030 k = 0.3482 0.3482 0.2578 ( 4434 PWs) bands (ev): -32.5348 -32.5348 -32.5299 -32.5299 -13.8537 -13.8537 -13.8363 -13.8363 -13.5127 -13.5127 -13.4666 -13.4666 -13.4502 -13.4502 -13.4109 -13.4109 -0.8061 -0.8061 -0.1867 -0.1867 3.6156 3.6156 3.6391 3.6391 3.9785 3.9785 4.8377 4.8377 5.4624 5.4624 5.5256 5.5256 5.5889 5.5889 5.6812 5.6812 5.9351 5.9351 6.0279 6.0279 6.3150 6.3150 6.4083 6.4083 6.5835 6.5835 6.7095 6.7095 7.6483 7.6483 7.7736 7.7736 8.1111 8.1111 8.3487 8.3487 11.1141 11.1141 12.1571 12.1600 k = 0.3393 0.3393 0.2578 ( 4434 PWs) bands (ev): -32.5353 -32.5353 -32.5299 -32.5299 -13.8535 -13.8535 -13.8345 -13.8345 -13.5122 -13.5122 -13.4648 -13.4648 -13.4504 -13.4504 -13.4096 -13.4096 -0.8685 -0.8685 -0.1926 -0.1926 3.6606 3.6606 3.6860 3.6860 3.9166 3.9166 4.8486 4.8486 5.4489 5.4489 5.4933 5.4933 5.5762 5.5762 5.6754 5.6754 5.9490 5.9490 6.0422 6.0422 6.3181 6.3181 6.4075 6.4075 6.5846 6.5846 6.7318 6.7318 7.6502 7.6502 7.8391 7.8391 8.2078 8.2078 8.4137 8.4137 11.1011 11.1011 12.1179 12.1185 k = 0.3304 0.3304 0.2578 ( 4430 PWs) bands (ev): -32.5358 -32.5358 -32.5298 -32.5298 -13.8533 -13.8533 -13.8326 -13.8326 -13.5116 -13.5116 -13.4632 -13.4632 -13.4502 -13.4502 -13.4084 -13.4084 -0.9314 -0.9314 -0.1990 -0.1990 3.7055 3.7055 3.7360 3.7360 3.8559 3.8559 4.8599 4.8599 5.4311 5.4311 5.4635 5.4635 5.5634 5.5634 5.6687 5.6687 5.9619 5.9619 6.0570 6.0570 6.3238 6.3238 6.4086 6.4086 6.5849 6.5849 6.7555 6.7555 7.6521 7.6521 7.9064 7.9064 8.3064 8.3064 8.4777 8.4777 11.0958 11.0958 12.0790 12.0965 k = 0.3214 0.3214 0.2578 ( 4434 PWs) bands (ev): -32.5363 -32.5363 -32.5297 -32.5297 -13.8532 -13.8532 -13.8307 -13.8307 -13.5109 -13.5109 -13.4622 -13.4622 -13.4496 -13.4496 -13.4073 -13.4073 -0.9948 -0.9948 -0.2061 -0.2061 3.7499 3.7499 3.7829 3.7829 3.8027 3.8027 4.8716 4.8716 5.4043 5.4043 5.4414 5.4414 5.5502 5.5502 5.6610 5.6610 5.9736 5.9736 6.0724 6.0724 6.3320 6.3320 6.4116 6.4116 6.5848 6.5848 6.7803 6.7803 7.6539 7.6539 7.9753 7.9753 8.4067 8.4067 8.5401 8.5401 11.0979 11.0979 12.0407 12.0655 k = 0.3125 0.3125 0.2578 ( 4430 PWs) bands (ev): -32.5368 -32.5368 -32.5296 -32.5296 -13.8530 -13.8530 -13.8287 -13.8287 -13.5101 -13.5101 -13.4616 -13.4616 -13.4483 -13.4483 -13.4062 -13.4062 -1.0583 -1.0583 -0.2138 -0.2138 3.7354 3.7354 3.7943 3.7943 3.8481 3.8481 4.8836 4.8836 5.3703 5.3703 5.4256 5.4256 5.5368 5.5368 5.6525 5.6525 5.9839 5.9839 6.0883 6.0883 6.3428 6.3428 6.4165 6.4165 6.5844 6.5844 6.8056 6.8056 7.6557 7.6557 8.0458 8.0458 8.5084 8.5084 8.6008 8.6008 11.1067 11.1067 12.0018 12.0021 k = 0.3036 0.3036 0.2578 ( 4434 PWs) bands (ev): -32.5373 -32.5373 -32.5295 -32.5295 -13.8528 -13.8528 -13.8266 -13.8266 -13.5091 -13.5091 -13.4615 -13.4615 -13.4467 -13.4467 -13.4051 -13.4051 -1.1218 -1.1218 -0.2222 -0.2222 3.6787 3.6787 3.8383 3.8383 3.9072 3.9072 4.8957 4.8957 5.3333 5.3333 5.4117 5.4117 5.5232 5.5232 5.6431 5.6431 5.9927 5.9927 6.1047 6.1047 6.3560 6.3560 6.4234 6.4234 6.5842 6.5842 6.8312 6.8312 7.6575 7.6575 8.1180 8.1180 8.6108 8.6108 8.6602 8.6602 11.1210 11.1210 11.9634 11.9634 k = 0.2946 0.2946 0.2578 ( 4424 PWs) bands (ev): -32.5378 -32.5378 -32.5294 -32.5294 -13.8526 -13.8526 -13.8245 -13.8245 -13.5081 -13.5081 -13.4617 -13.4617 -13.4446 -13.4446 -13.4040 -13.4040 -1.1850 -1.1850 -0.2312 -0.2312 3.6233 3.6233 3.8822 3.8822 3.9691 3.9691 4.9081 4.9081 5.2952 5.2952 5.3986 5.3986 5.5097 5.5097 5.6329 5.6329 5.9998 5.9998 6.1218 6.1218 6.3712 6.3712 6.4324 6.4324 6.5843 6.5843 6.8568 6.8568 7.6592 7.6592 8.1918 8.1918 8.7043 8.7043 8.7278 8.7278 11.1395 11.1395 11.9250 11.9250 k = 0.2857 0.2857 0.2578 ( 4416 PWs) bands (ev): -32.5383 -32.5383 -32.5293 -32.5293 -13.8524 -13.8524 -13.8223 -13.8223 -13.5070 -13.5070 -13.4620 -13.4620 -13.4424 -13.4424 -13.4030 -13.4030 -1.2477 -1.2477 -0.2409 -0.2409 3.5696 3.5696 3.9257 3.9257 4.0335 4.0335 4.9206 4.9206 5.2565 5.2565 5.3855 5.3855 5.4962 5.4962 5.6221 5.6221 6.0055 6.0055 6.1392 6.1392 6.3875 6.3875 6.4439 6.4439 6.5848 6.5848 6.8821 6.8821 7.6610 7.6610 8.2672 8.2672 8.7649 8.7649 8.8276 8.8276 11.1601 11.1601 11.8865 11.8865 k = 0.2768 0.2768 0.2578 ( 4416 PWs) bands (ev): -32.5389 -32.5389 -32.5292 -32.5292 -13.8523 -13.8523 -13.8201 -13.8201 -13.5058 -13.5058 -13.4624 -13.4624 -13.4400 -13.4400 -13.4020 -13.4020 -1.3098 -1.3098 -0.2513 -0.2513 3.5179 3.5179 3.9687 3.9687 4.1001 4.1001 4.9331 4.9331 5.2176 5.2176 5.3726 5.3726 5.4829 5.4829 5.6107 5.6107 6.0098 6.0098 6.1571 6.1571 6.4041 6.4041 6.4584 6.4584 6.5862 6.5862 6.9068 6.9068 7.6627 7.6627 8.3442 8.3442 8.8181 8.8181 8.9344 8.9344 11.1809 11.1809 11.8477 11.8477 k = 0.2679 0.2679 0.2578 ( 4416 PWs) bands (ev): -32.5394 -32.5394 -32.5291 -32.5291 -13.8521 -13.8521 -13.8179 -13.8179 -13.5046 -13.5046 -13.4629 -13.4629 -13.4375 -13.4375 -13.4011 -13.4011 -1.3711 -1.3711 -0.2624 -0.2624 3.4682 3.4682 4.0111 4.0111 4.1688 4.1688 4.9454 4.9454 5.1788 5.1788 5.3597 5.3597 5.4699 5.4699 5.5987 5.5987 6.0128 6.0128 6.1751 6.1751 6.4199 6.4199 6.4762 6.4762 6.5887 6.5887 6.9306 6.9306 7.6642 7.6642 8.4229 8.4229 8.8695 8.8695 9.0430 9.0430 11.1999 11.1999 11.8085 11.8085 k = 0.2589 0.2589 0.2578 ( 4426 PWs) bands (ev): -32.5400 -32.5400 -32.5290 -32.5290 -13.8519 -13.8519 -13.8156 -13.8156 -13.5033 -13.5033 -13.4634 -13.4634 -13.4351 -13.4351 -13.4003 -13.4003 -1.4315 -1.4315 -0.2741 -0.2741 3.4207 3.4207 4.0528 4.0528 4.2395 4.2395 4.9576 4.9576 5.1403 5.1403 5.3469 5.3469 5.4575 5.4575 5.5863 5.5863 6.0146 6.0146 6.1934 6.1934 6.4344 6.4344 6.4967 6.4967 6.5933 6.5933 6.9533 6.9533 7.6657 7.6657 8.5032 8.5032 8.9202 8.9202 9.1528 9.1528 11.2158 11.2158 11.7685 11.7685 k = 0.2500 0.2500 0.2578 ( 4424 PWs) bands (ev): -32.5405 -32.5405 -32.5289 -32.5289 -13.8518 -13.8518 -13.8133 -13.8133 -13.5020 -13.5020 -13.4639 -13.4639 -13.4325 -13.4325 -13.3994 -13.3994 -1.4909 -1.4909 -0.2864 -0.2864 3.3754 3.3754 4.0934 4.0934 4.3120 4.3120 4.9695 4.9695 5.1025 5.1025 5.3341 5.3341 5.4457 5.4457 5.5736 5.5736 6.0156 6.0156 6.2118 6.2118 6.4478 6.4478 6.5186 6.5186 6.6011 6.6011 6.9748 6.9748 7.6670 7.6670 8.5851 8.5851 8.9710 8.9710 9.2636 9.2636 11.2278 11.2278 11.7277 11.7277 k = 0.2411 0.2411 0.2578 ( 4424 PWs) bands (ev): -32.5411 -32.5411 -32.5288 -32.5288 -13.8516 -13.8516 -13.8110 -13.8110 -13.5007 -13.5007 -13.4644 -13.4644 -13.4300 -13.4300 -13.3986 -13.3986 -1.5490 -1.5490 -0.2994 -0.2994 3.3323 3.3323 4.1327 4.1327 4.3861 4.3861 4.9810 4.9810 5.0656 5.0656 5.3215 5.3215 5.4347 5.4347 5.5605 5.5605 6.0157 6.0157 6.2301 6.2301 6.4604 6.4604 6.5393 6.5393 6.6141 6.6141 6.9947 6.9947 7.6682 7.6682 8.6686 8.6686 9.0225 9.0225 9.3752 9.3752 11.2357 11.2357 11.6858 11.6858 k = 0.2321 0.2321 0.2578 ( 4424 PWs) bands (ev): -32.5416 -32.5416 -32.5287 -32.5287 -13.8515 -13.8515 -13.8087 -13.8087 -13.4994 -13.4994 -13.4647 -13.4647 -13.4274 -13.4274 -13.3979 -13.3979 -1.6058 -1.6058 -0.3129 -0.3129 3.2915 3.2915 4.1704 4.1704 4.4618 4.4618 4.9918 4.9918 5.0300 5.0300 5.3091 5.3091 5.4247 5.4247 5.5472 5.5472 6.0151 6.0151 6.2482 6.2482 6.4724 6.4724 6.5566 6.5566 6.6342 6.6342 7.0130 7.0130 7.6692 7.6692 8.7537 8.7537 9.0755 9.0755 9.4874 9.4874 11.2399 11.2399 11.6425 11.6425 k = 0.2232 0.2232 0.2578 ( 4418 PWs) bands (ev): -32.5422 -32.5422 -32.5286 -32.5286 -13.8513 -13.8513 -13.8063 -13.8063 -13.4981 -13.4981 -13.4650 -13.4650 -13.4249 -13.4249 -13.3972 -13.3972 -1.6612 -1.6612 -0.3268 -0.3268 3.2530 3.2530 4.2063 4.2063 4.5388 4.5388 4.9958 4.9958 5.0022 5.0022 5.2969 5.2969 5.4158 5.4158 5.5338 5.5338 6.0141 6.0141 6.2658 6.2658 6.4839 6.4839 6.5703 6.5703 6.6611 6.6611 7.0295 7.0295 7.6701 7.6701 8.8405 8.8405 9.1305 9.1305 9.6000 9.6000 11.2410 11.2410 11.5976 11.5976 k = 0.2143 0.2143 0.2578 ( 4414 PWs) bands (ev): -32.5427 -32.5427 -32.5285 -32.5285 -13.8511 -13.8511 -13.8040 -13.8040 -13.4968 -13.4968 -13.4652 -13.4652 -13.4224 -13.4224 -13.3965 -13.3965 -1.7151 -1.7151 -0.3413 -0.3413 3.2168 3.2168 4.2399 4.2399 4.6170 4.6170 4.9640 4.9640 5.0114 5.0114 5.2849 5.2849 5.4081 5.4081 5.5202 5.5202 6.0125 6.0125 6.2828 6.2828 6.4952 6.4952 6.5823 6.5823 6.6931 6.6931 7.0442 7.0442 7.6707 7.6707 8.9287 8.9287 9.1882 9.1882 9.7128 9.7128 11.2398 11.2398 11.5508 11.5508 k = 0.2054 0.2054 0.2578 ( 4414 PWs) bands (ev): -32.5433 -32.5433 -32.5284 -32.5284 -13.8510 -13.8510 -13.8017 -13.8017 -13.4956 -13.4956 -13.4653 -13.4653 -13.4199 -13.4199 -13.3959 -13.3959 -1.7674 -1.7674 -0.3561 -0.3561 3.1829 3.1829 4.2707 4.2707 4.6960 4.6960 4.9346 4.9346 5.0197 5.0197 5.2733 5.2733 5.4019 5.4019 5.5065 5.5065 6.0105 6.0105 6.2989 6.2989 6.5065 6.5065 6.5938 6.5938 6.7283 6.7283 7.0570 7.0570 7.6710 7.6710 9.0185 9.0185 9.2489 9.2489 9.8255 9.8255 11.2369 11.2369 11.5018 11.5018 k = 0.1964 0.1964 0.2578 ( 4410 PWs) bands (ev): -32.5438 -32.5438 -32.5283 -32.5283 -13.8508 -13.8508 -13.7994 -13.7994 -13.4945 -13.4945 -13.4653 -13.4653 -13.4175 -13.4175 -13.3953 -13.3953 -1.8180 -1.8180 -0.3712 -0.3712 3.1512 3.1512 4.2983 4.2983 4.7757 4.7757 4.9083 4.9083 5.0269 5.0269 5.2620 5.2620 5.3972 5.3972 5.4929 5.4929 6.0081 6.0081 6.3138 6.3138 6.5181 6.5181 6.6057 6.6057 6.7658 6.7658 7.0680 7.0680 7.6711 7.6711 9.1098 9.1098 9.3131 9.3131 9.9380 9.9380 11.2329 11.2329 11.4505 11.4505 k = 0.1875 0.1875 0.2578 ( 4420 PWs) bands (ev): -32.5443 -32.5443 -32.5282 -32.5282 -13.8507 -13.8507 -13.7971 -13.7971 -13.4936 -13.4936 -13.4652 -13.4652 -13.4152 -13.4152 -13.3948 -13.3948 -1.8668 -1.8668 -0.3865 -0.3865 3.1217 3.1217 4.3220 4.3220 4.8558 4.8558 4.8857 4.8857 5.0329 5.0329 5.2511 5.2511 5.3940 5.3940 5.4793 5.4793 6.0055 6.0055 6.3273 6.3273 6.5303 6.5303 6.6184 6.6184 6.8048 6.8048 7.0772 7.0772 7.6707 7.6707 9.2025 9.2025 9.3808 9.3808 10.0498 10.0498 11.2284 11.2284 11.3965 11.3966 k = 0.1786 0.1786 0.2578 ( 4428 PWs) bands (ev): -32.5448 -32.5448 -32.5282 -32.5282 -13.8506 -13.8506 -13.7949 -13.7949 -13.4928 -13.4928 -13.4649 -13.4649 -13.4129 -13.4129 -13.3943 -13.3943 -1.9138 -1.9138 -0.4020 -0.4020 3.0944 3.0944 4.3412 4.3412 4.8674 4.8674 4.9359 4.9359 5.0375 5.0375 5.2406 5.2406 5.3925 5.3925 5.4659 5.4659 6.0027 6.0027 6.3391 6.3391 6.5436 6.5436 6.6320 6.6320 6.8449 6.8449 7.0847 7.0847 7.6699 7.6699 9.2966 9.2966 9.4525 9.4525 10.1606 10.1606 11.2237 11.2237 11.3399 11.3399 k = 0.1696 0.1696 0.2578 ( 4432 PWs) bands (ev): -32.5453 -32.5453 -32.5281 -32.5281 -13.8505 -13.8505 -13.7927 -13.7927 -13.4920 -13.4920 -13.4644 -13.4644 -13.4108 -13.4108 -13.3939 -13.3939 -1.9588 -1.9588 -0.4175 -0.4175 3.0691 3.0691 4.3555 4.3555 4.8540 4.8540 5.0156 5.0156 5.0410 5.0410 5.2307 5.2307 5.3926 5.3926 5.4526 5.4526 5.9997 5.9997 6.3492 6.3492 6.5582 6.5582 6.6467 6.6467 6.8856 6.8856 7.0907 7.0907 7.6686 7.6686 9.3919 9.3919 9.5281 9.5281 10.2700 10.2700 11.2192 11.2192 11.2805 11.2805 k = 0.1607 0.1607 0.2578 ( 4436 PWs) bands (ev): -32.5458 -32.5458 -32.5280 -32.5280 -13.8504 -13.8504 -13.7906 -13.7906 -13.4915 -13.4915 -13.4638 -13.4638 -13.4087 -13.4087 -13.3935 -13.3935 -2.0019 -2.0019 -0.4329 -0.4329 3.0459 3.0459 4.3645 4.3645 4.8459 4.8459 5.0431 5.0431 5.0943 5.0943 5.2215 5.2215 5.3942 5.3942 5.4397 5.4397 5.9965 5.9965 6.3574 6.3574 6.5740 6.5740 6.6625 6.6625 6.9267 6.9267 7.0953 7.0953 7.6667 7.6667 9.4884 9.4884 9.6077 9.6077 10.3775 10.3775 11.2152 11.2152 11.2184 11.2184 k = 0.1518 0.1518 0.2578 ( 4428 PWs) bands (ev): -32.5463 -32.5463 -32.5279 -32.5279 -13.8502 -13.8502 -13.7885 -13.7885 -13.4910 -13.4910 -13.4631 -13.4631 -13.4067 -13.4067 -13.3930 -13.3930 -2.0430 -2.0430 -0.4483 -0.4483 3.0246 3.0246 4.3683 4.3683 4.8430 4.8430 5.0442 5.0442 5.1695 5.1695 5.2150 5.2150 5.3971 5.3971 5.4273 5.4273 5.9934 5.9934 6.3639 6.3639 6.5911 6.5911 6.6796 6.6796 6.9678 6.9678 7.0989 7.0989 7.6642 7.6642 9.5859 9.5859 9.6911 9.6911 10.4825 10.4825 11.1536 11.1536 11.2119 11.2119 k = 0.1429 0.1429 0.2578 ( 4420 PWs) bands (ev): -32.5467 -32.5467 -32.5278 -32.5278 -13.8501 -13.8501 -13.7864 -13.7864 -13.4907 -13.4907 -13.4622 -13.4622 -13.4048 -13.4048 -13.3925 -13.3925 -2.0819 -2.0819 -0.4634 -0.4634 3.0051 3.0051 4.3672 4.3672 4.8451 4.8451 5.0442 5.0442 5.1987 5.1987 5.2529 5.2529 5.4012 5.4012 5.4161 5.4161 5.9902 5.9902 6.3688 6.3688 6.6091 6.6091 6.6983 6.6983 7.0083 7.0083 7.1020 7.1020 7.6609 7.6609 9.6843 9.6843 9.7782 9.7782 10.5844 10.5844 11.0865 11.0865 11.2095 11.2095 k = 0.1339 0.1339 0.2578 ( 4436 PWs) bands (ev): -32.5471 -32.5471 -32.5278 -32.5278 -13.8500 -13.8500 -13.7845 -13.7845 -13.4905 -13.4905 -13.4613 -13.4613 -13.4032 -13.4032 -13.3921 -13.3921 -2.1187 -2.1187 -0.4782 -0.4782 2.9874 2.9874 4.3619 4.3619 4.8514 4.8514 5.0432 5.0432 5.1924 5.1924 5.3218 5.3218 5.4046 5.4046 5.4095 5.4095 5.9870 5.9870 6.3723 6.3723 6.6272 6.6272 6.7190 6.7190 7.0464 7.0464 7.1059 7.1059 7.6567 7.6567 9.7834 9.7834 9.8687 9.8687 10.6823 10.6823 11.0173 11.0173 11.2079 11.2079 k = 0.1250 0.1250 0.2578 ( 4426 PWs) bands (ev): -32.5475 -32.5475 -32.5277 -32.5277 -13.8499 -13.8499 -13.7826 -13.7826 -13.4904 -13.4904 -13.4602 -13.4602 -13.4017 -13.4017 -13.3915 -13.3915 -2.1533 -2.1533 -0.4925 -0.4925 2.9714 2.9714 4.3533 4.3533 4.8611 4.8611 5.0417 5.0417 5.1851 5.1851 5.3680 5.3680 5.4133 5.4133 5.4210 5.4210 5.9840 5.9840 6.3745 6.3745 6.6449 6.6449 6.7423 6.7423 7.0765 7.0765 7.1166 7.1166 7.6516 7.6516 9.8830 9.8830 9.9624 9.9624 10.7752 10.7752 10.9466 10.9466 11.2075 11.2075 k = 0.1161 0.1161 0.2578 ( 4430 PWs) bands (ev): -32.5479 -32.5479 -32.5276 -32.5276 -13.8498 -13.8498 -13.7809 -13.7809 -13.4904 -13.4904 -13.4591 -13.4591 -13.4004 -13.4004 -13.3909 -13.3909 -2.1857 -2.1857 -0.5063 -0.5063 2.9569 2.9569 4.3423 4.3423 4.8732 4.8732 5.0396 5.0396 5.1781 5.1781 5.3684 5.3684 5.4200 5.4200 5.4783 5.4783 5.9811 5.9811 6.3758 6.3758 6.6618 6.6618 6.7687 6.7687 7.0885 7.0885 7.1437 7.1437 7.6453 7.6453 9.9829 9.9829 10.0586 10.0586 10.8606 10.8606 10.8762 10.8762 11.2083 11.2083 k = 0.1071 0.1071 0.2578 ( 4426 PWs) bands (ev): -32.5483 -32.5483 -32.5276 -32.5276 -13.8497 -13.8497 -13.7792 -13.7792 -13.4905 -13.4905 -13.4581 -13.4581 -13.3994 -13.3994 -13.3901 -13.3901 -2.2159 -2.2159 -0.5195 -0.5195 2.9439 2.9439 4.3298 4.3298 4.8871 4.8871 5.0372 5.0372 5.1715 5.1715 5.3594 5.3594 5.4271 5.4271 5.5420 5.5420 5.9784 5.9784 6.3762 6.3762 6.6775 6.6775 6.7983 6.7983 7.0910 7.0910 7.1788 7.1788 7.6377 7.6377 10.0827 10.0827 10.1569 10.1569 10.8027 10.8027 10.9412 10.9412 11.2104 11.2104 k = 0.0982 0.0982 0.2578 ( 4426 PWs) bands (ev): -32.5486 -32.5486 -32.5275 -32.5275 -13.8497 -13.8497 -13.7776 -13.7776 -13.4906 -13.4906 -13.4570 -13.4570 -13.3985 -13.3985 -13.3893 -13.3893 -2.2437 -2.2437 -0.5320 -0.5320 2.9324 2.9324 4.3165 4.3165 4.9018 4.9018 5.0345 5.0345 5.1654 5.1654 5.3493 5.3493 5.4343 5.4343 5.6032 5.6032 5.9761 5.9761 6.3759 6.3759 6.6917 6.6917 6.8311 6.8311 7.0908 7.0908 7.2147 7.2147 7.6287 7.6287 10.1821 10.1821 10.2563 10.2563 10.7313 10.7313 11.0107 11.0107 11.2141 11.2141 k = 0.0893 0.0893 0.2578 ( 4434 PWs) bands (ev): -32.5489 -32.5489 -32.5275 -32.5275 -13.8496 -13.8496 -13.7761 -13.7761 -13.4907 -13.4907 -13.4559 -13.4559 -13.3979 -13.3979 -13.3884 -13.3884 -2.2693 -2.2693 -0.5438 -0.5438 2.9221 2.9221 4.3030 4.3030 4.9169 4.9169 5.0316 5.0316 5.1597 5.1597 5.3391 5.3391 5.4415 5.4415 5.6602 5.6602 5.9741 5.9741 6.3751 6.3751 6.7046 6.7046 6.8669 6.8669 7.0897 7.0897 7.2495 7.2495 7.6181 7.6181 10.2805 10.2805 10.3560 10.3560 10.6615 10.6615 11.0688 11.0688 11.2196 11.2196 k = 0.0804 0.0804 0.2578 ( 4436 PWs) bands (ev): -32.5492 -32.5492 -32.5274 -32.5274 -13.8496 -13.8496 -13.7748 -13.7748 -13.4909 -13.4909 -13.4548 -13.4548 -13.3975 -13.3975 -13.3876 -13.3876 -2.2924 -2.2924 -0.5546 -0.5546 2.9131 2.9131 4.2898 4.2898 4.9318 4.9318 5.0289 5.0289 5.1548 5.1548 5.3292 5.3292 5.4486 5.4486 5.7122 5.7122 5.9729 5.9729 6.3739 6.3739 6.7160 6.7160 6.9053 6.9053 7.0883 7.0883 7.2826 7.2826 7.6058 7.6058 10.3771 10.3771 10.4542 10.4542 10.5947 10.5947 11.1140 11.1140 11.2273 11.2273 k = 0.0714 0.0714 0.2578 ( 4448 PWs) bands (ev): -32.5495 -32.5495 -32.5274 -32.5274 -13.8495 -13.8495 -13.7736 -13.7736 -13.4911 -13.4911 -13.4539 -13.4539 -13.3972 -13.3972 -13.3867 -13.3867 -2.3132 -2.3132 -0.5646 -0.5646 2.9053 2.9053 4.2773 4.2773 4.9460 4.9460 5.0263 5.0263 5.1502 5.1502 5.3198 5.3198 5.4553 5.4553 5.7586 5.7586 5.9724 5.9724 6.3723 6.3723 6.7261 6.7261 6.9455 6.9455 7.0872 7.0872 7.3134 7.3134 7.5916 7.5916 10.4707 10.4707 10.5208 10.5208 10.5607 10.5607 11.1458 11.1458 11.2379 11.2379 k = 0.0625 0.0625 0.2578 ( 4432 PWs) bands (ev): -32.5497 -32.5497 -32.5273 -32.5273 -13.8494 -13.8494 -13.7724 -13.7724 -13.4912 -13.4912 -13.4529 -13.4529 -13.3970 -13.3970 -13.3859 -13.3859 -2.3316 -2.3316 -0.5735 -0.5735 2.8986 2.8986 4.2657 4.2657 4.9593 4.9593 5.0241 5.0241 5.1464 5.1464 5.3111 5.3111 5.4616 5.4616 5.7988 5.7988 5.9732 5.9732 6.3707 6.3707 6.7350 6.7350 6.9866 6.9866 7.0870 7.0870 7.3414 7.3414 7.5756 7.5756 10.4662 10.4662 10.5615 10.5615 10.6467 10.6467 11.1651 11.1651 11.2522 11.2522 k = 0.0536 0.0536 0.2578 ( 4436 PWs) bands (ev): -32.5499 -32.5499 -32.5273 -32.5273 -13.8494 -13.8494 -13.7715 -13.7715 -13.4914 -13.4914 -13.4521 -13.4521 -13.3968 -13.3968 -13.3851 -13.3851 -2.3476 -2.3476 -0.5813 -0.5813 2.8928 2.8928 4.2552 4.2552 4.9713 4.9713 5.0222 5.0222 5.1430 5.1430 5.3030 5.3030 5.4673 5.4673 5.8322 5.8322 5.9754 5.9754 6.3689 6.3689 6.7426 6.7426 7.0256 7.0256 7.0896 7.0896 7.3663 7.3663 7.5577 7.5577 10.4122 10.4122 10.6456 10.6456 10.7318 10.7318 11.1742 11.1742 11.2713 11.2713 k = 0.0446 0.0446 0.2578 ( 4440 PWs) bands (ev): -32.5501 -32.5501 -32.5273 -32.5273 -13.8493 -13.8493 -13.7707 -13.7707 -13.4915 -13.4915 -13.4514 -13.4514 -13.3968 -13.3968 -13.3845 -13.3845 -2.3612 -2.3612 -0.5881 -0.5881 2.8881 2.8881 4.2461 4.2461 4.9815 4.9815 5.0210 5.0210 5.1402 5.1402 5.2958 5.2958 5.4722 5.4722 5.8585 5.8585 5.9794 5.9794 6.3670 6.3670 6.7491 6.7491 7.0544 7.0544 7.1025 7.1025 7.3875 7.3875 7.5382 7.5382 10.3640 10.3640 10.7218 10.7218 10.8080 10.8080 11.1764 11.1764 11.2960 11.2960 k = 0.0357 0.0357 0.2578 ( 4444 PWs) bands (ev): -32.5502 -32.5502 -32.5272 -32.5272 -13.8493 -13.8493 -13.7700 -13.7700 -13.4917 -13.4917 -13.4508 -13.4508 -13.3967 -13.3967 -13.3839 -13.3839 -2.3723 -2.3723 -0.5936 -0.5936 2.8843 2.8843 4.2385 4.2385 4.9896 4.9896 5.0205 5.0205 5.1379 5.1379 5.2896 5.2896 5.4764 5.4764 5.8776 5.8776 5.9850 5.9850 6.3654 6.3654 6.7544 6.7544 7.0651 7.0651 7.1325 7.1325 7.4044 7.4044 7.5179 7.5179 10.3229 10.3229 10.7875 10.7875 10.8725 10.8725 11.1747 11.1747 11.3257 11.3257 k = 0.0268 0.0268 0.2578 ( 4446 PWs) bands (ev): -32.5503 -32.5503 -32.5272 -32.5272 -13.8493 -13.8493 -13.7695 -13.7695 -13.4918 -13.4918 -13.4504 -13.4504 -13.3967 -13.3967 -13.3835 -13.3835 -2.3809 -2.3809 -0.5980 -0.5980 2.8814 2.8814 4.2325 4.2325 4.9954 4.9954 5.0209 5.0209 5.1362 5.1362 5.2845 5.2845 5.4797 5.4797 5.8904 5.8904 5.9915 5.9915 6.3639 6.3639 6.7586 6.7586 7.0677 7.0677 7.1680 7.1680 7.4161 7.4161 7.4984 7.4984 10.2900 10.2900 10.8399 10.8399 10.9238 10.9238 11.1717 11.1717 11.3577 11.3577 k = 0.0179 0.0179 0.2578 ( 4448 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8493 -13.8493 -13.7691 -13.7691 -13.4918 -13.4918 -13.4500 -13.4500 -13.3967 -13.3967 -13.3831 -13.3831 -2.3871 -2.3871 -0.6012 -0.6012 2.8793 2.8793 4.2281 4.2281 4.9988 4.9988 5.0220 5.0220 5.1350 5.1350 5.2808 5.2808 5.4821 5.4821 5.8982 5.8982 5.9975 5.9975 6.3628 6.3628 6.7615 6.7615 7.0682 7.0682 7.2002 7.2002 7.4212 7.4212 7.4829 7.4829 10.2660 10.2660 10.8772 10.8772 10.9613 10.9613 11.1689 11.1689 11.3859 11.3859 k = 0.0089 0.0089 0.2578 ( 4456 PWs) bands (ev): -32.5504 -32.5504 -32.5272 -32.5272 -13.8493 -13.8493 -13.7689 -13.7689 -13.4919 -13.4919 -13.4498 -13.4498 -13.3967 -13.3967 -13.3830 -13.3830 -2.3909 -2.3909 -0.6031 -0.6031 2.8781 2.8781 4.2255 4.2255 5.0004 5.0004 5.0230 5.0230 5.1343 5.1343 5.2785 5.2785 5.4836 5.4836 5.9023 5.9023 6.0017 6.0017 6.3620 6.3620 6.7633 6.7633 7.0683 7.0683 7.2234 7.2234 7.4200 7.4200 7.4744 7.4744 10.2513 10.2513 10.8990 10.8990 10.9842 10.9842 11.1670 11.1670 11.4018 11.4019 k = 0.0000 0.0000 0.2578 ( 4472 PWs) bands (ev): -32.5505 -32.5505 -32.5272 -32.5272 -13.8493 -13.8493 -13.7689 -13.7689 -13.4919 -13.4919 -13.4498 -13.4498 -13.3967 -13.3967 -13.3829 -13.3829 -2.3921 -2.3921 -0.6037 -0.6037 2.8776 2.8776 4.2246 4.2246 5.0008 5.0008 5.0234 5.0234 5.1340 5.1340 5.2777 5.2777 5.4840 5.4840 5.9036 5.9036 6.0032 6.0032 6.3617 6.3617 6.7638 6.7638 7.0682 7.0682 7.2320 7.2320 7.4182 7.4182 7.4721 7.4721 10.2463 10.2463 10.9062 10.9062 10.9920 10.9920 11.1664 11.1664 11.4056 11.4057 k = 0.0000 0.5000-0.0000 ( 4420 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4867 -13.4867 -13.4867 -13.4867 -13.4070 -13.4070 -13.4070 -13.4070 -0.8756 -0.8756 -0.8756 -0.8756 3.6885 3.6885 3.6885 3.6885 4.3025 4.3025 4.3025 4.3025 5.2523 5.2523 5.2523 5.2523 5.6210 5.6210 5.6210 5.6210 6.0408 6.0408 6.0408 6.0408 6.2316 6.2316 6.2316 6.2316 6.6780 6.6780 6.6780 6.6780 9.5423 9.5423 9.5423 9.5423 9.7882 9.7882 9.7882 9.7882 10.8894 10.8894 10.8894 10.8894 k = 0.0000 0.5000 0.0123 ( 4424 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4868 -13.4868 -13.4868 -13.4868 -13.4070 -13.4070 -13.4070 -13.4070 -0.8756 -0.8756 -0.8756 -0.8756 3.6846 3.6846 3.6846 3.6846 4.3074 4.3074 4.3074 4.3074 5.2523 5.2523 5.2523 5.2523 5.6201 5.6201 5.6201 5.6201 6.0407 6.0407 6.0407 6.0407 6.2315 6.2315 6.2315 6.2315 6.6793 6.6793 6.6793 6.6793 9.5415 9.5415 9.5415 9.5415 9.7787 9.7787 9.7787 9.7787 10.8997 10.8997 10.8997 10.8997 k = 0.0000 0.5000 0.0246 ( 4424 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4868 -13.4868 -13.4868 -13.4868 -13.4070 -13.4070 -13.4070 -13.4070 -0.8753 -0.8753 -0.8753 -0.8753 3.6733 3.6733 3.6733 3.6733 4.3216 4.3216 4.3216 4.3216 5.2523 5.2523 5.2523 5.2523 5.6173 5.6173 5.6173 5.6173 6.0407 6.0407 6.0407 6.0407 6.2311 6.2311 6.2311 6.2311 6.6833 6.6833 6.6833 6.6833 9.5389 9.5389 9.5389 9.5389 9.7516 9.7516 9.7516 9.7516 10.9293 10.9293 10.9293 10.9293 k = 0.0000 0.5000 0.0368 ( 4424 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4868 -13.4868 -13.4868 -13.4868 -13.4070 -13.4070 -13.4070 -13.4070 -0.8749 -0.8749 -0.8749 -0.8749 3.6559 3.6559 3.6559 3.6559 4.3440 4.3440 4.3440 4.3440 5.2523 5.2523 5.2523 5.2523 5.6127 5.6127 5.6127 5.6127 6.0405 6.0405 6.0405 6.0405 6.2304 6.2304 6.2304 6.2304 6.6898 6.6898 6.6898 6.6898 9.5347 9.5347 9.5347 9.5347 9.7095 9.7095 9.7095 9.7095 10.9755 10.9755 10.9755 10.9755 k = 0.0000 0.5000 0.0491 ( 4418 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4868 -13.4868 -13.4868 -13.4868 -13.4069 -13.4069 -13.4069 -13.4069 -0.8743 -0.8743 -0.8743 -0.8743 3.6335 3.6335 3.6335 3.6335 4.3732 4.3732 4.3732 4.3732 5.2523 5.2523 5.2523 5.2523 5.6063 5.6063 5.6063 5.6063 6.0403 6.0403 6.0403 6.0403 6.2296 6.2296 6.2296 6.2296 6.6988 6.6988 6.6988 6.6988 9.5288 9.5288 9.5288 9.5288 9.6562 9.6562 9.6562 9.6562 11.0345 11.0345 11.0345 11.0345 k = 0.0000 0.5000 0.0614 ( 4414 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8392 -13.8392 -13.8392 -13.8392 -13.4868 -13.4868 -13.4868 -13.4868 -13.4069 -13.4069 -13.4069 -13.4069 -0.8736 -0.8736 -0.8736 -0.8736 3.6078 3.6078 3.6078 3.6078 4.4077 4.4077 4.4077 4.4077 5.2523 5.2523 5.2523 5.2523 5.5981 5.5981 5.5981 5.5981 6.0401 6.0401 6.0401 6.0401 6.2286 6.2286 6.2286 6.2286 6.7101 6.7101 6.7101 6.7101 9.5205 9.5205 9.5205 9.5205 9.5959 9.5959 9.5959 9.5959 11.1030 11.1030 11.1030 11.1030 k = 0.0000 0.5000 0.0737 ( 4418 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8393 -13.8393 -13.8393 -13.8393 -13.4868 -13.4868 -13.4868 -13.4868 -13.4069 -13.4069 -13.4069 -13.4069 -0.8727 -0.8727 -0.8727 -0.8727 3.5799 3.5799 3.5799 3.5799 4.4461 4.4461 4.4461 4.4461 5.2523 5.2523 5.2523 5.2523 5.5882 5.5882 5.5882 5.5882 6.0399 6.0399 6.0399 6.0399 6.2275 6.2275 6.2275 6.2275 6.7235 6.7235 6.7235 6.7235 9.5034 9.5034 9.5034 9.5034 9.5381 9.5381 9.5381 9.5381 11.1778 11.1778 11.1778 11.1778 k = 0.0000 0.5000 0.0859 ( 4414 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8393 -13.8393 -13.8393 -13.8393 -13.4868 -13.4868 -13.4868 -13.4868 -13.4069 -13.4069 -13.4069 -13.4069 -0.8718 -0.8718 -0.8718 -0.8718 3.5509 3.5509 3.5509 3.5509 4.4874 4.4874 4.4874 4.4874 5.2523 5.2523 5.2523 5.2523 5.5766 5.5766 5.5766 5.5766 6.0396 6.0396 6.0396 6.0396 6.2263 6.2263 6.2263 6.2263 6.7388 6.7388 6.7388 6.7388 9.4493 9.4493 9.4493 9.4493 9.5134 9.5134 9.5134 9.5134 11.2564 11.2564 11.2564 11.2564 k = 0.0000 0.5000 0.0982 ( 4408 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8393 -13.8393 -13.8393 -13.8393 -13.4868 -13.4868 -13.4868 -13.4868 -13.4068 -13.4068 -13.4068 -13.4068 -0.8707 -0.8707 -0.8707 -0.8707 3.5218 3.5218 3.5218 3.5218 4.5306 4.5306 4.5306 4.5306 5.2523 5.2523 5.2523 5.2523 5.5634 5.5634 5.5634 5.5634 6.0394 6.0394 6.0394 6.0394 6.2251 6.2251 6.2251 6.2251 6.7558 6.7558 6.7558 6.7558 9.3799 9.3799 9.3799 9.3799 9.5020 9.5020 9.5020 9.5020 11.3369 11.3369 11.3369 11.3369 k = 0.0000 0.5000 0.1105 ( 4408 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8393 -13.8393 -13.8393 -13.8393 -13.4868 -13.4868 -13.4868 -13.4868 -13.4068 -13.4068 -13.4068 -13.4068 -0.8696 -0.8696 -0.8696 -0.8696 3.4930 3.4930 3.4930 3.4930 4.5750 4.5750 4.5750 4.5750 5.2523 5.2523 5.2523 5.2523 5.5488 5.5488 5.5488 5.5488 6.0391 6.0391 6.0391 6.0391 6.2239 6.2239 6.2239 6.2239 6.7742 6.7742 6.7742 6.7742 9.3090 9.3090 9.3090 9.3090 9.4918 9.4918 9.4918 9.4918 11.4171 11.4171 11.4171 11.4172 k = 0.0000 0.5000 0.1228 ( 4422 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8393 -13.8393 -13.8393 -13.8393 -13.4869 -13.4869 -13.4869 -13.4869 -13.4068 -13.4068 -13.4068 -13.4068 -0.8685 -0.8685 -0.8685 -0.8685 3.4652 3.4652 3.4652 3.4652 4.6198 4.6198 4.6198 4.6198 5.2522 5.2522 5.2522 5.2522 5.5328 5.5328 5.5328 5.5328 6.0388 6.0388 6.0388 6.0388 6.2226 6.2226 6.2226 6.2226 6.7936 6.7936 6.7936 6.7936 9.2389 9.2389 9.2389 9.2389 9.4819 9.4819 9.4819 9.4819 11.4956 11.4956 11.4956 11.4956 k = 0.0000 0.5000 0.1350 ( 4422 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8393 -13.8393 -13.8393 -13.8393 -13.4869 -13.4869 -13.4869 -13.4869 -13.4068 -13.4068 -13.4068 -13.4068 -0.8673 -0.8673 -0.8673 -0.8673 3.4387 3.4387 3.4387 3.4387 4.6645 4.6645 4.6645 4.6645 5.2522 5.2522 5.2522 5.2522 5.5155 5.5155 5.5155 5.5155 6.0385 6.0385 6.0385 6.0385 6.2215 6.2215 6.2215 6.2215 6.8137 6.8137 6.8137 6.8137 9.1710 9.1710 9.1710 9.1710 9.4723 9.4723 9.4723 9.4723 11.5705 11.5705 11.5705 11.5706 k = 0.0000 0.5000 0.1473 ( 4416 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8393 -13.8393 -13.8393 -13.8393 -13.4869 -13.4869 -13.4869 -13.4869 -13.4067 -13.4067 -13.4067 -13.4067 -0.8662 -0.8662 -0.8662 -0.8662 3.4140 3.4140 3.4140 3.4140 4.7087 4.7087 4.7087 4.7087 5.2521 5.2521 5.2521 5.2521 5.4973 5.4973 5.4973 5.4973 6.0383 6.0383 6.0383 6.0383 6.2204 6.2204 6.2204 6.2204 6.8342 6.8342 6.8342 6.8342 9.1060 9.1060 9.1060 9.1060 9.4631 9.4631 9.4631 9.4631 11.6405 11.6405 11.6405 11.6405 k = 0.0000 0.5000 0.1596 ( 4422 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8394 -13.8394 -13.8394 -13.8394 -13.4869 -13.4869 -13.4869 -13.4869 -13.4067 -13.4067 -13.4067 -13.4067 -0.8651 -0.8651 -0.8651 -0.8651 3.3912 3.3912 3.3912 3.3912 4.7517 4.7517 4.7517 4.7517 5.2520 5.2520 5.2520 5.2520 5.4782 5.4782 5.4782 5.4782 6.0381 6.0381 6.0381 6.0381 6.2194 6.2194 6.2194 6.2194 6.8545 6.8545 6.8545 6.8545 9.0450 9.0450 9.0450 9.0450 9.4543 9.4543 9.4543 9.4543 11.7040 11.7040 11.7040 11.7040 k = 0.0000 0.5000 0.1719 ( 4416 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8394 -13.8394 -13.8394 -13.8394 -13.4869 -13.4869 -13.4869 -13.4869 -13.4066 -13.4066 -13.4066 -13.4066 -0.8640 -0.8640 -0.8640 -0.8640 3.3707 3.3707 3.3707 3.3707 4.7931 4.7931 4.7931 4.7931 5.2519 5.2519 5.2519 5.2519 5.4585 5.4585 5.4585 5.4585 6.0379 6.0379 6.0379 6.0379 6.2185 6.2185 6.2185 6.2185 6.8743 6.8743 6.8743 6.8743 8.9887 8.9887 8.9887 8.9887 9.4462 9.4462 9.4462 9.4462 11.7597 11.7597 11.7598 11.7598 k = 0.0000 0.5000 0.1841 ( 4408 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8394 -13.8394 -13.8394 -13.8394 -13.4869 -13.4869 -13.4869 -13.4869 -13.4066 -13.4066 -13.4066 -13.4066 -0.8630 -0.8630 -0.8630 -0.8630 3.3526 3.3526 3.3526 3.3526 4.8322 4.8322 4.8322 4.8322 5.2517 5.2517 5.2517 5.2517 5.4388 5.4388 5.4388 5.4388 6.0378 6.0378 6.0378 6.0378 6.2177 6.2177 6.2177 6.2177 6.8929 6.8929 6.8929 6.8929 8.9380 8.9380 8.9380 8.9380 9.4389 9.4389 9.4389 9.4389 11.8067 11.8067 11.8067 11.8067 k = 0.0000 0.5000 0.1964 ( 4424 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8394 -13.8394 -13.8394 -13.8394 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8622 -0.8622 -0.8622 -0.8622 3.3370 3.3370 3.3370 3.3370 4.8683 4.8683 4.8683 4.8683 5.2513 5.2513 5.2513 5.2513 5.4193 5.4193 5.4193 5.4193 6.0376 6.0376 6.0376 6.0376 6.2170 6.2170 6.2170 6.2170 6.9099 6.9099 6.9099 6.9099 8.8934 8.8934 8.8934 8.8934 9.4325 9.4325 9.4325 9.4325 11.8443 11.8443 11.8443 11.8443 k = 0.0000 0.5000 0.2087 ( 4420 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8394 -13.8394 -13.8394 -13.8394 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8614 -0.8614 -0.8614 -0.8614 3.3241 3.3241 3.3241 3.3241 4.9006 4.9006 4.9006 4.9006 5.2510 5.2510 5.2510 5.2510 5.4011 5.4011 5.4011 5.4011 6.0375 6.0375 6.0375 6.0375 6.2164 6.2164 6.2164 6.2164 6.9248 6.9248 6.9248 6.9248 8.8558 8.8558 8.8558 8.8558 9.4271 9.4271 9.4271 9.4271 11.8731 11.8731 11.8731 11.8731 k = 0.0000 0.5000 0.2210 ( 4430 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8395 -13.8395 -13.8395 -13.8395 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8609 -0.8609 -0.8609 -0.8609 3.3140 3.3140 3.3140 3.3140 4.9279 4.9279 4.9279 4.9279 5.2505 5.2505 5.2505 5.2505 5.3849 5.3849 5.3849 5.3849 6.0374 6.0374 6.0374 6.0374 6.2160 6.2160 6.2160 6.2160 6.9370 6.9370 6.9370 6.9370 8.8258 8.8258 8.8258 8.8258 9.4229 9.4229 9.4229 9.4229 11.8940 11.8940 11.8940 11.8940 k = 0.0000 0.5000 0.2333 ( 4432 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8395 -13.8395 -13.8395 -13.8395 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8604 -0.8604 -0.8604 -0.8604 3.3067 3.3067 3.3067 3.3067 4.9490 4.9490 4.9490 4.9490 5.2500 5.2500 5.2500 5.2500 5.3721 5.3721 5.3721 5.3721 6.0373 6.0373 6.0373 6.0373 6.2157 6.2157 6.2157 6.2157 6.9461 6.9461 6.9461 6.9461 8.8039 8.8039 8.8039 8.8039 9.4198 9.4198 9.4198 9.4198 11.9080 11.9080 11.9080 11.9080 k = 0.0000 0.5000 0.2455 ( 4448 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8395 -13.8395 -13.8395 -13.8395 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8602 -0.8602 -0.8602 -0.8602 3.3023 3.3023 3.3023 3.3023 4.9624 4.9624 4.9624 4.9624 5.2495 5.2495 5.2495 5.2495 5.3637 5.3637 5.3637 5.3637 6.0372 6.0372 6.0372 6.0372 6.2154 6.2154 6.2154 6.2154 6.9517 6.9517 6.9517 6.9517 8.7906 8.7906 8.7906 8.7906 9.4179 9.4179 9.4179 9.4179 11.9160 11.9160 11.9160 11.9160 k = 0.0000 0.5000 0.2578 ( 4440 PWs) bands (ev): -32.5347 -32.5347 -32.5347 -32.5347 -13.8395 -13.8395 -13.8395 -13.8395 -13.4870 -13.4870 -13.4870 -13.4870 -13.4066 -13.4066 -13.4066 -13.4066 -0.8601 -0.8601 -0.8601 -0.8601 3.3008 3.3008 3.3008 3.3008 4.9670 4.9670 4.9670 4.9670 5.2494 5.2494 5.2494 5.2494 5.3608 5.3608 5.3608 5.3608 6.0372 6.0372 6.0372 6.0372 6.2154 6.2154 6.2154 6.2154 6.9536 6.9536 6.9536 6.9536 8.7861 8.7861 8.7861 8.7861 9.4173 9.4173 9.4173 9.4173 11.9186 11.9186 11.9186 11.9186 k = 0.5000 0.5000-0.0000 ( 4440 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1581 -0.1581 -0.1581 -0.1581 3.1936 3.1936 3.1936 3.1936 4.8467 4.8467 4.8467 4.8467 5.5485 5.5485 5.5485 5.5485 5.7005 5.7005 5.7005 5.7005 5.9346 5.9346 5.9346 5.9346 6.5547 6.5547 6.5547 6.5547 6.6292 6.6292 6.6292 6.6292 6.9147 6.9147 6.9147 6.9147 7.6557 7.6557 7.6557 7.6557 10.6918 10.6918 10.6918 10.6918 k = 0.5000 0.5000 0.0123 ( 4432 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1580 -0.1580 -0.1580 -0.1580 3.1936 3.1936 3.1936 3.1936 4.8461 4.8461 4.8461 4.8461 5.5492 5.5492 5.5492 5.5492 5.7003 5.7003 5.7003 5.7003 5.9345 5.9345 5.9345 5.9345 6.5540 6.5540 6.5540 6.5540 6.6292 6.6292 6.6292 6.6292 6.9153 6.9153 6.9153 6.9153 7.6557 7.6557 7.6557 7.6557 10.6961 10.6961 10.6961 10.6961 k = 0.5000 0.5000 0.0246 ( 4448 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1579 -0.1579 -0.1579 -0.1579 3.1937 3.1937 3.1937 3.1937 4.8440 4.8440 4.8440 4.8440 5.5512 5.5512 5.5512 5.5512 5.6996 5.6996 5.6996 5.6996 5.9339 5.9339 5.9339 5.9339 6.5520 6.5520 6.5520 6.5520 6.6292 6.6292 6.6292 6.6292 6.9171 6.9171 6.9171 6.9171 7.6553 7.6553 7.6553 7.6553 10.7088 10.7088 10.7088 10.7088 k = 0.5000 0.5000 0.0368 ( 4440 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1577 -0.1577 -0.1577 -0.1577 3.1939 3.1939 3.1939 3.1939 4.8407 4.8407 4.8407 4.8407 5.5545 5.5545 5.5545 5.5545 5.6986 5.6986 5.6986 5.6986 5.9330 5.9330 5.9330 5.9330 6.5487 6.5487 6.5487 6.5487 6.6292 6.6292 6.6292 6.6292 6.9200 6.9200 6.9200 6.9200 7.6549 7.6549 7.6549 7.6549 10.7299 10.7299 10.7299 10.7299 k = 0.5000 0.5000 0.0491 ( 4444 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1573 -0.1573 -0.1573 -0.1573 3.1942 3.1942 3.1942 3.1942 4.8362 4.8362 4.8362 4.8362 5.5591 5.5591 5.5591 5.5591 5.6972 5.6972 5.6972 5.6972 5.9318 5.9318 5.9318 5.9318 6.5443 6.5443 6.5443 6.5443 6.6293 6.6293 6.6293 6.6293 6.9240 6.9240 6.9240 6.9240 7.6543 7.6543 7.6543 7.6543 10.7592 10.7592 10.7592 10.7592 k = 0.5000 0.5000 0.0614 ( 4452 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1570 -0.1570 -0.1570 -0.1570 3.1945 3.1945 3.1945 3.1945 4.8307 4.8307 4.8307 4.8307 5.5647 5.5647 5.5647 5.5647 5.6954 5.6954 5.6954 5.6954 5.9302 5.9302 5.9302 5.9302 6.5388 6.5388 6.5388 6.5388 6.6292 6.6292 6.6292 6.6292 6.9291 6.9291 6.9291 6.9291 7.6535 7.6535 7.6535 7.6535 10.7965 10.7965 10.7965 10.7965 k = 0.5000 0.5000 0.0737 ( 4444 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4326 -13.4326 -13.4326 -13.4326 -0.1565 -0.1565 -0.1565 -0.1565 3.1949 3.1949 3.1949 3.1949 4.8243 4.8243 4.8243 4.8243 5.5712 5.5712 5.5712 5.5712 5.6933 5.6933 5.6933 5.6933 5.9283 5.9283 5.9283 5.9283 6.5325 6.5325 6.5325 6.5325 6.6294 6.6294 6.6294 6.6294 6.9351 6.9351 6.9351 6.9351 7.6526 7.6526 7.6526 7.6526 10.8414 10.8414 10.8414 10.8414 k = 0.5000 0.5000 0.0859 ( 4444 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4327 -13.4327 -13.4327 -13.4327 -0.1560 -0.1560 -0.1560 -0.1560 3.1953 3.1953 3.1953 3.1953 4.8173 4.8173 4.8173 4.8173 5.5784 5.5784 5.5784 5.5784 5.6910 5.6910 5.6910 5.6910 5.9261 5.9261 5.9261 5.9261 6.5255 6.5255 6.5255 6.5255 6.6294 6.6294 6.6294 6.6294 6.9419 6.9419 6.9419 6.9419 7.6515 7.6515 7.6515 7.6515 10.8936 10.8936 10.8936 10.8936 k = 0.5000 0.5000 0.0982 ( 4440 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4327 -13.4327 -13.4327 -13.4327 -0.1554 -0.1554 -0.1554 -0.1554 3.1958 3.1958 3.1958 3.1958 4.8098 4.8098 4.8098 4.8098 5.5861 5.5861 5.5861 5.5861 5.6884 5.6884 5.6884 5.6884 5.9238 5.9238 5.9238 5.9238 6.5179 6.5179 6.5179 6.5179 6.6295 6.6295 6.6295 6.6295 6.9493 6.9493 6.9493 6.9493 7.6503 7.6503 7.6503 7.6503 10.9526 10.9526 10.9526 10.9526 k = 0.5000 0.5000 0.1105 ( 4448 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4327 -13.4327 -13.4327 -13.4327 -0.1548 -0.1548 -0.1548 -0.1548 3.1963 3.1963 3.1963 3.1963 4.8019 4.8019 4.8019 4.8019 5.5941 5.5941 5.5941 5.5941 5.6857 5.6857 5.6857 5.6857 5.9211 5.9211 5.9211 5.9211 6.5101 6.5101 6.5101 6.5101 6.6295 6.6295 6.6295 6.6295 6.9574 6.9574 6.9574 6.9574 7.6490 7.6490 7.6490 7.6490 11.0180 11.0180 11.0180 11.0180 k = 0.5000 0.5000 0.1228 ( 4460 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4327 -13.4327 -13.4327 -13.4327 -0.1542 -0.1542 -0.1542 -0.1542 3.1968 3.1968 3.1968 3.1968 4.7940 4.7940 4.7940 4.7940 5.6022 5.6022 5.6022 5.6022 5.6829 5.6829 5.6829 5.6829 5.9183 5.9183 5.9183 5.9183 6.5021 6.5021 6.5021 6.5021 6.6295 6.6295 6.6295 6.6295 6.9657 6.9657 6.9657 6.9657 7.6476 7.6476 7.6476 7.6476 11.0891 11.0891 11.0891 11.0891 k = 0.5000 0.5000 0.1350 ( 4460 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5022 -13.5022 -13.5022 -13.5022 -13.4328 -13.4328 -13.4328 -13.4328 -0.1535 -0.1535 -0.1535 -0.1535 3.1973 3.1973 3.1973 3.1973 4.7861 4.7861 4.7861 4.7861 5.6103 5.6103 5.6103 5.6103 5.6801 5.6801 5.6801 5.6801 5.9154 5.9154 5.9154 5.9154 6.4942 6.4942 6.4942 6.4942 6.6296 6.6296 6.6296 6.6296 6.9742 6.9742 6.9742 6.9742 7.6461 7.6461 7.6461 7.6461 11.1654 11.1654 11.1654 11.1654 k = 0.5000 0.5000 0.1473 ( 4440 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4327 -13.4327 -13.4327 -13.4327 -0.1529 -0.1529 -0.1529 -0.1529 3.1978 3.1978 3.1978 3.1978 4.7785 4.7785 4.7785 4.7785 5.6180 5.6180 5.6180 5.6180 5.6776 5.6776 5.6776 5.6776 5.9126 5.9126 5.9126 5.9126 6.4866 6.4866 6.4866 6.4866 6.6297 6.6297 6.6297 6.6297 6.9827 6.9827 6.9827 6.9827 7.6447 7.6447 7.6447 7.6447 11.2461 11.2461 11.2461 11.2461 k = 0.5000 0.5000 0.1596 ( 4428 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4327 -13.4327 -13.4327 -13.4327 -0.1523 -0.1523 -0.1523 -0.1523 3.1984 3.1984 3.1984 3.1984 4.7713 4.7713 4.7713 4.7713 5.6252 5.6252 5.6252 5.6252 5.6753 5.6753 5.6753 5.6753 5.9097 5.9097 5.9097 5.9097 6.4794 6.4794 6.4794 6.4794 6.6298 6.6298 6.6298 6.6298 6.9910 6.9910 6.9910 6.9910 7.6433 7.6433 7.6433 7.6433 11.3302 11.3302 11.3302 11.3302 k = 0.5000 0.5000 0.1719 ( 4436 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4327 -13.4327 -13.4327 -13.4327 -0.1517 -0.1517 -0.1517 -0.1517 3.1989 3.1989 3.1989 3.1989 4.7645 4.7645 4.7645 4.7645 5.6315 5.6315 5.6315 5.6315 5.6734 5.6734 5.6734 5.6734 5.9069 5.9069 5.9069 5.9069 6.4726 6.4726 6.4726 6.4726 6.6297 6.6297 6.6297 6.6297 6.9988 6.9988 6.9988 6.9988 7.6418 7.6418 7.6418 7.6418 11.4166 11.4166 11.4166 11.4166 k = 0.5000 0.5000 0.1841 ( 4428 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4327 -13.4327 -13.4327 -13.4327 -0.1512 -0.1512 -0.1512 -0.1512 3.1993 3.1993 3.1993 3.1993 4.7585 4.7585 4.7585 4.7585 5.6368 5.6368 5.6368 5.6368 5.6722 5.6722 5.6722 5.6722 5.9042 5.9042 5.9042 5.9042 6.4666 6.4666 6.4666 6.4666 6.6298 6.6298 6.6298 6.6298 7.0061 7.0061 7.0061 7.0061 7.6405 7.6405 7.6405 7.6405 11.5038 11.5038 11.5038 11.5038 k = 0.5000 0.5000 0.1964 ( 4428 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4327 -13.4327 -13.4327 -13.4327 -0.1507 -0.1507 -0.1507 -0.1507 3.1997 3.1997 3.1997 3.1997 4.7531 4.7531 4.7531 4.7531 5.6408 5.6408 5.6408 5.6408 5.6718 5.6718 5.6718 5.6718 5.9018 5.9018 5.9018 5.9018 6.4613 6.4613 6.4613 6.4613 6.6299 6.6299 6.6299 6.6299 7.0126 7.0126 7.0126 7.0126 7.6393 7.6393 7.6393 7.6393 11.5899 11.5899 11.5899 11.5899 k = 0.5000 0.5000 0.2087 ( 4432 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4328 -13.4328 -13.4328 -13.4328 -0.1503 -0.1503 -0.1503 -0.1503 3.2000 3.2000 3.2000 3.2000 4.7487 4.7487 4.7487 4.7487 5.6435 5.6435 5.6435 5.6435 5.6722 5.6722 5.6722 5.6722 5.8996 5.8996 5.8996 5.8996 6.4569 6.4569 6.4569 6.4569 6.6299 6.6299 6.6299 6.6299 7.0182 7.0182 7.0182 7.0182 7.6382 7.6382 7.6382 7.6382 11.6720 11.6720 11.6720 11.6720 k = 0.5000 0.5000 0.2210 ( 4432 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4328 -13.4328 -13.4328 -13.4328 -0.1500 -0.1500 -0.1500 -0.1500 3.2003 3.2003 3.2003 3.2003 4.7451 4.7451 4.7451 4.7451 5.6450 5.6450 5.6450 5.6450 5.6731 5.6731 5.6731 5.6731 5.8979 5.8979 5.8979 5.8979 6.4533 6.4533 6.4533 6.4533 6.6299 6.6299 6.6299 6.6299 7.0227 7.0227 7.0227 7.0227 7.6373 7.6373 7.6373 7.6373 11.7463 11.7463 11.7463 11.7463 k = 0.5000 0.5000 0.2333 ( 4440 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8538 -13.8538 -13.8538 -13.8538 -13.5021 -13.5021 -13.5021 -13.5021 -13.4328 -13.4328 -13.4328 -13.4328 -0.1498 -0.1498 -0.1498 -0.1498 3.2005 3.2005 3.2005 3.2005 4.7425 4.7425 4.7425 4.7425 5.6456 5.6456 5.6456 5.6456 5.6741 5.6741 5.6741 5.6741 5.8966 5.8966 5.8966 5.8966 6.4508 6.4508 6.4508 6.4508 6.6300 6.6300 6.6300 6.6300 7.0260 7.0260 7.0260 7.0260 7.6367 7.6367 7.6367 7.6367 11.8073 11.8073 11.8073 11.8073 k = 0.5000 0.5000 0.2455 ( 4456 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5021 -13.5021 -13.5021 -13.5021 -13.4328 -13.4328 -13.4328 -13.4328 -0.1497 -0.1497 -0.1497 -0.1497 3.2006 3.2006 3.2006 3.2006 4.7409 4.7409 4.7409 4.7409 5.6458 5.6458 5.6458 5.6458 5.6749 5.6749 5.6749 5.6749 5.8957 5.8957 5.8957 5.8957 6.4492 6.4492 6.4492 6.4492 6.6300 6.6300 6.6300 6.6300 7.0280 7.0280 7.0280 7.0280 7.6362 7.6362 7.6362 7.6362 11.8482 11.8482 11.8482 11.8482 k = 0.5000 0.5000 0.2578 ( 4456 PWs) bands (ev): -32.5307 -32.5307 -32.5307 -32.5307 -13.8539 -13.8539 -13.8539 -13.8539 -13.5021 -13.5021 -13.5021 -13.5021 -13.4328 -13.4328 -13.4328 -13.4328 -0.1496 -0.1496 -0.1496 -0.1496 3.2007 3.2007 3.2007 3.2007 4.7404 4.7404 4.7404 4.7404 5.6459 5.6459 5.6459 5.6459 5.6752 5.6752 5.6752 5.6752 5.8954 5.8954 5.8954 5.8954 6.4487 6.4487 6.4487 6.4487 6.6300 6.6300 6.6300 6.6300 7.0287 7.0287 7.0287 7.0287 7.6361 7.6361 7.6361 7.6361 11.8627 11.8627 11.8627 11.8627 Writing output data file CaNiGeH.save init_run : 0.33s CPU 0.52s WALL ( 1 calls) electrons : 361.18s CPU 367.68s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.03s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 361.18s CPU 367.67s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.07s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.09s WALL ( 344 calls) cegterg : 344.61s CPU 349.59s WALL ( 1080 calls) Called by sum_band: Called by *egterg: h_psi : 145.05s CPU 148.17s WALL ( 19837 calls) s_psi : 13.39s CPU 13.37s WALL ( 19837 calls) g_psi : 0.48s CPU 0.53s WALL ( 18413 calls) cdiaghg : 155.61s CPU 157.09s WALL ( 18757 calls) cegterg:over : 14.68s CPU 15.10s WALL ( 18413 calls) cegterg:upda : 14.89s CPU 15.23s WALL ( 18413 calls) cegterg:last : 6.65s CPU 6.74s WALL ( 2372 calls) cdiaghg:chol : 9.16s CPU 8.89s WALL ( 18757 calls) cdiaghg:inve : 5.83s CPU 5.94s WALL ( 18757 calls) cdiaghg:para : 9.39s CPU 9.70s WALL ( 37514 calls) Called by h_psi: h_psi:vloc : 115.18s CPU 117.97s WALL ( 19837 calls) h_psi:vnl : 29.25s CPU 29.61s WALL ( 19837 calls) add_vuspsi : 15.42s CPU 15.52s WALL ( 19837 calls) General routines calbec : 13.76s CPU 14.03s WALL ( 19837 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 107.31s CPU 109.96s WALL ( 1639464 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.17s CPU 0.29s WALL ( 688 calls) Parallel routines fft_scatter : 43.79s CPU 45.25s WALL ( 1639487 calls) PWSCF : 6m20.48s CPU 6m57.73s WALL This run was terminated on: 16:46:46 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=