Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 20:37:36 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: ./MgCuAs.save/ file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P renormalized file Cu.rel-pbe-dn-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 47 29 8 2345 1117 176 Max 48 30 9 2352 1130 183 Sum 1725 1049 305 84613 40409 6391 bravais-lattice index = 14 lattice parameter (alat) = 7.4852 a.u. unit-cell volume = 660.4677 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.485205 celldm(2)= 1.000000 celldm(3)= 1.574855 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 1.574855 ) 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 0.634979 ) PseudoPot. # 1 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 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 Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 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 1129 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. # 3 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) Mg 10.00 24.30500 Mg( 1.00) Cu 11.00 63.54600 Cu( 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= 361 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0027701 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0027701 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0027701 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0027701 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0027701 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0027701 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0027701 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0027701 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0027701 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0027701 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0027701 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0027701 k( 14) = ( 0.0000000 0.1625000 -0.0000000), wk = 0.0027701 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0027701 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0027701 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0027701 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0027701 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0027701 k( 20) = ( 0.0000000 0.2375000 -0.0000000), wk = 0.0027701 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0027701 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0027701 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0027701 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0027701 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0027701 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0027701 k( 27) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0027701 k( 28) = ( 0.0000000 0.3375000 -0.0000000), wk = 0.0027701 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0027701 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0027701 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0027701 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0027701 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0027701 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0027701 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0027701 k( 36) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0027701 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0027701 k( 38) = ( 0.0000000 0.4625000 -0.0000000), wk = 0.0027701 k( 39) = ( 0.0000000 0.4750000 -0.0000000), wk = 0.0027701 k( 40) = ( 0.0000000 0.4875000 -0.0000000), wk = 0.0027701 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027701 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027701 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0027701 k( 44) = ( 0.0250000 0.5000000 -0.0000000), wk = 0.0027701 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0027701 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0027701 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0027701 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0027701 k( 49) = ( 0.0875000 0.5000000 -0.0000000), wk = 0.0027701 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0027701 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0027701 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0027701 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0027701 k( 54) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0027701 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0027701 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0027701 k( 57) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0027701 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0027701 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0027701 k( 60) = ( 0.2250000 0.5000000 -0.0000000), wk = 0.0027701 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0027701 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0027701 k( 63) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0027701 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0027701 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0027701 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0027701 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0027701 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0027701 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0027701 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0027701 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0027701 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0027701 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0027701 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0027701 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0027701 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0027701 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0027701 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0027701 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0027701 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0027701 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0027701 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 84) = ( 0.4912281 0.4912281 -0.0000000), wk = 0.0027701 k( 85) = ( 0.4824561 0.4824561 -0.0000000), wk = 0.0027701 k( 86) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0027701 k( 87) = ( 0.4649123 0.4649123 -0.0000000), wk = 0.0027701 k( 88) = ( 0.4561404 0.4561403 -0.0000000), wk = 0.0027701 k( 89) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0027701 k( 90) = ( 0.4385965 0.4385965 -0.0000000), wk = 0.0027701 k( 91) = ( 0.4298246 0.4298246 -0.0000000), wk = 0.0027701 k( 92) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0027701 k( 93) = ( 0.4122807 0.4122807 -0.0000000), wk = 0.0027701 k( 94) = ( 0.4035088 0.4035088 -0.0000000), wk = 0.0027701 k( 95) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0027701 k( 96) = ( 0.3859649 0.3859649 -0.0000000), wk = 0.0027701 k( 97) = ( 0.3771930 0.3771930 -0.0000000), wk = 0.0027701 k( 98) = ( 0.3684211 0.3684210 -0.0000000), wk = 0.0027701 k( 99) = ( 0.3596491 0.3596491 -0.0000000), wk = 0.0027701 k( 100) = ( 0.3508772 0.3508772 -0.0000000), wk = 0.0027701 k( 101) = ( 0.3421053 0.3421053 -0.0000000), wk = 0.0027701 k( 102) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0027701 k( 103) = ( 0.3245614 0.3245614 -0.0000000), wk = 0.0027701 k( 104) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0027701 k( 105) = ( 0.3070175 0.3070175 -0.0000000), wk = 0.0027701 k( 106) = ( 0.2982456 0.2982456 -0.0000000), wk = 0.0027701 k( 107) = ( 0.2894737 0.2894737 -0.0000000), wk = 0.0027701 k( 108) = ( 0.2807018 0.2807017 -0.0000000), wk = 0.0027701 k( 109) = ( 0.2719298 0.2719298 -0.0000000), wk = 0.0027701 k( 110) = ( 0.2631579 0.2631579 -0.0000000), wk = 0.0027701 k( 111) = ( 0.2543860 0.2543860 -0.0000000), wk = 0.0027701 k( 112) = ( 0.2456140 0.2456140 -0.0000000), wk = 0.0027701 k( 113) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0027701 k( 114) = ( 0.2280702 0.2280702 -0.0000000), wk = 0.0027701 k( 115) = ( 0.2192983 0.2192982 -0.0000000), wk = 0.0027701 k( 116) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0027701 k( 117) = ( 0.2017544 0.2017544 -0.0000000), wk = 0.0027701 k( 118) = ( 0.1929825 0.1929825 -0.0000000), wk = 0.0027701 k( 119) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0027701 k( 120) = ( 0.1754386 0.1754386 -0.0000000), wk = 0.0027701 k( 121) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0027701 k( 122) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0027701 k( 123) = ( 0.1491228 0.1491228 -0.0000000), wk = 0.0027701 k( 124) = ( 0.1403509 0.1403509 -0.0000000), wk = 0.0027701 k( 125) = ( 0.1315790 0.1315790 -0.0000000), wk = 0.0027701 k( 126) = ( 0.1228070 0.1228070 -0.0000000), wk = 0.0027701 k( 127) = ( 0.1140351 0.1140351 -0.0000000), wk = 0.0027701 k( 128) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0027701 k( 129) = ( 0.0964912 0.0964912 -0.0000000), wk = 0.0027701 k( 130) = ( 0.0877193 0.0877193 -0.0000000), wk = 0.0027701 k( 131) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0027701 k( 132) = ( 0.0701754 0.0701754 -0.0000000), wk = 0.0027701 k( 133) = ( 0.0614035 0.0614035 -0.0000000), wk = 0.0027701 k( 134) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0027701 k( 135) = ( 0.0438597 0.0438596 -0.0000000), wk = 0.0027701 k( 136) = ( 0.0350877 0.0350877 -0.0000000), wk = 0.0027701 k( 137) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0027701 k( 138) = ( 0.0175439 0.0175439 -0.0000000), wk = 0.0027701 k( 139) = ( 0.0087719 0.0087719 -0.0000000), wk = 0.0027701 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 142) = ( 0.0000000 0.0000000 0.0122111), wk = 0.0027701 k( 143) = ( 0.0000000 0.0000000 0.0244223), wk = 0.0027701 k( 144) = ( 0.0000000 0.0000000 0.0366334), wk = 0.0027701 k( 145) = ( 0.0000000 0.0000000 0.0488446), wk = 0.0027701 k( 146) = ( 0.0000000 0.0000000 0.0610557), wk = 0.0027701 k( 147) = ( 0.0000000 0.0000000 0.0732668), wk = 0.0027701 k( 148) = ( 0.0000000 0.0000000 0.0854780), wk = 0.0027701 k( 149) = ( 0.0000000 0.0000000 0.0976891), wk = 0.0027701 k( 150) = ( 0.0000000 0.0000000 0.1099002), wk = 0.0027701 k( 151) = ( 0.0000000 0.0000000 0.1221114), wk = 0.0027701 k( 152) = ( 0.0000000 0.0000000 0.1343225), wk = 0.0027701 k( 153) = ( 0.0000000 0.0000000 0.1465337), wk = 0.0027701 k( 154) = ( 0.0000000 0.0000000 0.1587448), wk = 0.0027701 k( 155) = ( 0.0000000 0.0000000 0.1709559), wk = 0.0027701 k( 156) = ( 0.0000000 0.0000000 0.1831671), wk = 0.0027701 k( 157) = ( 0.0000000 0.0000000 0.1953782), wk = 0.0027701 k( 158) = ( 0.0000000 0.0000000 0.2075893), wk = 0.0027701 k( 159) = ( 0.0000000 0.0000000 0.2198005), wk = 0.0027701 k( 160) = ( 0.0000000 0.0000000 0.2320116), wk = 0.0027701 k( 161) = ( 0.0000000 0.0000000 0.2442228), wk = 0.0027701 k( 162) = ( 0.0000000 0.0000000 0.2564339), wk = 0.0027701 k( 163) = ( 0.0000000 0.0000000 0.2686450), wk = 0.0027701 k( 164) = ( 0.0000000 0.0000000 0.2808562), wk = 0.0027701 k( 165) = ( 0.0000000 0.0000000 0.2930673), wk = 0.0027701 k( 166) = ( 0.0000000 0.0000000 0.3052784), wk = 0.0027701 k( 167) = ( 0.0000000 0.0000000 0.3174896), wk = 0.0027701 k( 168) = ( 0.0000000 0.0000000 0.3174896), wk = 0.0027701 k( 169) = ( 0.0000000 0.0125000 0.3174896), wk = 0.0027701 k( 170) = ( 0.0000000 0.0250000 0.3174896), wk = 0.0027701 k( 171) = ( 0.0000000 0.0375000 0.3174896), wk = 0.0027701 k( 172) = ( 0.0000000 0.0500000 0.3174896), wk = 0.0027701 k( 173) = ( 0.0000000 0.0625000 0.3174896), wk = 0.0027701 k( 174) = ( 0.0000000 0.0750000 0.3174896), wk = 0.0027701 k( 175) = ( 0.0000000 0.0875000 0.3174896), wk = 0.0027701 k( 176) = ( 0.0000000 0.1000000 0.3174896), wk = 0.0027701 k( 177) = ( 0.0000000 0.1125000 0.3174896), wk = 0.0027701 k( 178) = ( 0.0000000 0.1250000 0.3174896), wk = 0.0027701 k( 179) = ( 0.0000000 0.1375000 0.3174896), wk = 0.0027701 k( 180) = ( 0.0000000 0.1500000 0.3174896), wk = 0.0027701 k( 181) = ( 0.0000000 0.1625000 0.3174896), wk = 0.0027701 k( 182) = ( 0.0000000 0.1750000 0.3174896), wk = 0.0027701 k( 183) = ( 0.0000000 0.1875000 0.3174896), wk = 0.0027701 k( 184) = ( 0.0000000 0.2000000 0.3174896), wk = 0.0027701 k( 185) = ( 0.0000000 0.2125000 0.3174896), wk = 0.0027701 k( 186) = ( 0.0000000 0.2250000 0.3174896), wk = 0.0027701 k( 187) = ( 0.0000000 0.2375000 0.3174896), wk = 0.0027701 k( 188) = ( 0.0000000 0.2500000 0.3174896), wk = 0.0027701 k( 189) = ( 0.0000000 0.2625000 0.3174896), wk = 0.0027701 k( 190) = ( 0.0000000 0.2750000 0.3174896), wk = 0.0027701 k( 191) = ( 0.0000000 0.2875000 0.3174896), wk = 0.0027701 k( 192) = ( 0.0000000 0.3000000 0.3174896), wk = 0.0027701 k( 193) = ( 0.0000000 0.3125000 0.3174896), wk = 0.0027701 k( 194) = ( 0.0000000 0.3250000 0.3174896), wk = 0.0027701 k( 195) = ( 0.0000000 0.3375000 0.3174896), wk = 0.0027701 k( 196) = ( 0.0000000 0.3500000 0.3174896), wk = 0.0027701 k( 197) = ( 0.0000000 0.3625000 0.3174896), wk = 0.0027701 k( 198) = ( 0.0000000 0.3750000 0.3174896), wk = 0.0027701 k( 199) = ( 0.0000000 0.3875000 0.3174896), wk = 0.0027701 k( 200) = ( 0.0000000 0.4000000 0.3174896), wk = 0.0027701 k( 201) = ( 0.0000000 0.4125000 0.3174896), wk = 0.0027701 k( 202) = ( 0.0000000 0.4250000 0.3174896), wk = 0.0027701 k( 203) = ( 0.0000000 0.4375000 0.3174896), wk = 0.0027701 k( 204) = ( 0.0000000 0.4500000 0.3174896), wk = 0.0027701 k( 205) = ( 0.0000000 0.4625000 0.3174896), wk = 0.0027701 k( 206) = ( 0.0000000 0.4750000 0.3174896), wk = 0.0027701 k( 207) = ( 0.0000000 0.4875000 0.3174896), wk = 0.0027701 k( 208) = ( 0.0000000 0.5000000 0.3174896), wk = 0.0027701 k( 209) = ( 0.0000000 0.5000000 0.3174896), wk = 0.0027701 k( 210) = ( 0.0125000 0.5000000 0.3174896), wk = 0.0027701 k( 211) = ( 0.0250000 0.5000000 0.3174896), wk = 0.0027701 k( 212) = ( 0.0375000 0.5000000 0.3174896), wk = 0.0027701 k( 213) = ( 0.0500000 0.5000000 0.3174896), wk = 0.0027701 k( 214) = ( 0.0625000 0.5000000 0.3174896), wk = 0.0027701 k( 215) = ( 0.0750000 0.5000000 0.3174896), wk = 0.0027701 k( 216) = ( 0.0875000 0.5000000 0.3174896), wk = 0.0027701 k( 217) = ( 0.1000000 0.5000000 0.3174896), wk = 0.0027701 k( 218) = ( 0.1125000 0.5000000 0.3174896), wk = 0.0027701 k( 219) = ( 0.1250000 0.5000000 0.3174896), wk = 0.0027701 k( 220) = ( 0.1375000 0.5000000 0.3174896), wk = 0.0027701 k( 221) = ( 0.1500000 0.5000000 0.3174896), wk = 0.0027701 k( 222) = ( 0.1625000 0.5000000 0.3174896), wk = 0.0027701 k( 223) = ( 0.1750000 0.5000000 0.3174896), wk = 0.0027701 k( 224) = ( 0.1875000 0.5000000 0.3174896), wk = 0.0027701 k( 225) = ( 0.2000000 0.5000000 0.3174896), wk = 0.0027701 k( 226) = ( 0.2125000 0.5000000 0.3174896), wk = 0.0027701 k( 227) = ( 0.2250000 0.5000000 0.3174896), wk = 0.0027701 k( 228) = ( 0.2375000 0.5000000 0.3174896), wk = 0.0027701 k( 229) = ( 0.2500000 0.5000000 0.3174896), wk = 0.0027701 k( 230) = ( 0.2625000 0.5000000 0.3174896), wk = 0.0027701 k( 231) = ( 0.2750000 0.5000000 0.3174896), wk = 0.0027701 k( 232) = ( 0.2875000 0.5000000 0.3174896), wk = 0.0027701 k( 233) = ( 0.3000000 0.5000000 0.3174896), wk = 0.0027701 k( 234) = ( 0.3125000 0.5000000 0.3174896), wk = 0.0027701 k( 235) = ( 0.3250000 0.5000000 0.3174896), wk = 0.0027701 k( 236) = ( 0.3375000 0.5000000 0.3174896), wk = 0.0027701 k( 237) = ( 0.3500000 0.5000000 0.3174896), wk = 0.0027701 k( 238) = ( 0.3625000 0.5000000 0.3174896), wk = 0.0027701 k( 239) = ( 0.3750000 0.5000000 0.3174896), wk = 0.0027701 k( 240) = ( 0.3875000 0.5000000 0.3174896), wk = 0.0027701 k( 241) = ( 0.4000000 0.5000000 0.3174896), wk = 0.0027701 k( 242) = ( 0.4125000 0.5000000 0.3174896), wk = 0.0027701 k( 243) = ( 0.4250000 0.5000000 0.3174896), wk = 0.0027701 k( 244) = ( 0.4375000 0.5000000 0.3174896), wk = 0.0027701 k( 245) = ( 0.4500000 0.5000000 0.3174896), wk = 0.0027701 k( 246) = ( 0.4625000 0.5000000 0.3174896), wk = 0.0027701 k( 247) = ( 0.4750000 0.5000000 0.3174896), wk = 0.0027701 k( 248) = ( 0.4875000 0.5000000 0.3174896), wk = 0.0027701 k( 249) = ( 0.5000000 0.5000000 0.3174896), wk = 0.0027701 k( 250) = ( 0.5000000 0.5000000 0.3174896), wk = 0.0027701 k( 251) = ( 0.4912281 0.4912281 0.3174896), wk = 0.0027701 k( 252) = ( 0.4824561 0.4824561 0.3174896), wk = 0.0027701 k( 253) = ( 0.4736842 0.4736842 0.3174896), wk = 0.0027701 k( 254) = ( 0.4649123 0.4649123 0.3174896), wk = 0.0027701 k( 255) = ( 0.4561404 0.4561403 0.3174896), wk = 0.0027701 k( 256) = ( 0.4473684 0.4473684 0.3174896), wk = 0.0027701 k( 257) = ( 0.4385965 0.4385965 0.3174896), wk = 0.0027701 k( 258) = ( 0.4298246 0.4298246 0.3174896), wk = 0.0027701 k( 259) = ( 0.4210526 0.4210526 0.3174896), wk = 0.0027701 k( 260) = ( 0.4122807 0.4122807 0.3174896), wk = 0.0027701 k( 261) = ( 0.4035088 0.4035088 0.3174896), wk = 0.0027701 k( 262) = ( 0.3947368 0.3947368 0.3174896), wk = 0.0027701 k( 263) = ( 0.3859649 0.3859649 0.3174896), wk = 0.0027701 k( 264) = ( 0.3771930 0.3771930 0.3174896), wk = 0.0027701 k( 265) = ( 0.3684211 0.3684210 0.3174896), wk = 0.0027701 k( 266) = ( 0.3596491 0.3596491 0.3174896), wk = 0.0027701 k( 267) = ( 0.3508772 0.3508772 0.3174896), wk = 0.0027701 k( 268) = ( 0.3421053 0.3421053 0.3174896), wk = 0.0027701 k( 269) = ( 0.3333333 0.3333333 0.3174896), wk = 0.0027701 k( 270) = ( 0.3245614 0.3245614 0.3174896), wk = 0.0027701 k( 271) = ( 0.3157895 0.3157895 0.3174896), wk = 0.0027701 k( 272) = ( 0.3070175 0.3070175 0.3174896), wk = 0.0027701 k( 273) = ( 0.2982456 0.2982456 0.3174896), wk = 0.0027701 k( 274) = ( 0.2894737 0.2894737 0.3174896), wk = 0.0027701 k( 275) = ( 0.2807018 0.2807017 0.3174896), wk = 0.0027701 k( 276) = ( 0.2719298 0.2719298 0.3174896), wk = 0.0027701 k( 277) = ( 0.2631579 0.2631579 0.3174896), wk = 0.0027701 k( 278) = ( 0.2543860 0.2543860 0.3174896), wk = 0.0027701 k( 279) = ( 0.2456140 0.2456140 0.3174896), wk = 0.0027701 k( 280) = ( 0.2368421 0.2368421 0.3174896), wk = 0.0027701 k( 281) = ( 0.2280702 0.2280702 0.3174896), wk = 0.0027701 k( 282) = ( 0.2192983 0.2192982 0.3174896), wk = 0.0027701 k( 283) = ( 0.2105263 0.2105263 0.3174896), wk = 0.0027701 k( 284) = ( 0.2017544 0.2017544 0.3174896), wk = 0.0027701 k( 285) = ( 0.1929825 0.1929825 0.3174896), wk = 0.0027701 k( 286) = ( 0.1842105 0.1842105 0.3174896), wk = 0.0027701 k( 287) = ( 0.1754386 0.1754386 0.3174896), wk = 0.0027701 k( 288) = ( 0.1666667 0.1666667 0.3174896), wk = 0.0027701 k( 289) = ( 0.1578947 0.1578947 0.3174896), wk = 0.0027701 k( 290) = ( 0.1491228 0.1491228 0.3174896), wk = 0.0027701 k( 291) = ( 0.1403509 0.1403509 0.3174896), wk = 0.0027701 k( 292) = ( 0.1315790 0.1315790 0.3174896), wk = 0.0027701 k( 293) = ( 0.1228070 0.1228070 0.3174896), wk = 0.0027701 k( 294) = ( 0.1140351 0.1140351 0.3174896), wk = 0.0027701 k( 295) = ( 0.1052632 0.1052632 0.3174896), wk = 0.0027701 k( 296) = ( 0.0964912 0.0964912 0.3174896), wk = 0.0027701 k( 297) = ( 0.0877193 0.0877193 0.3174896), wk = 0.0027701 k( 298) = ( 0.0789474 0.0789474 0.3174896), wk = 0.0027701 k( 299) = ( 0.0701754 0.0701754 0.3174896), wk = 0.0027701 k( 300) = ( 0.0614035 0.0614035 0.3174896), wk = 0.0027701 k( 301) = ( 0.0526316 0.0526316 0.3174896), wk = 0.0027701 k( 302) = ( 0.0438597 0.0438596 0.3174896), wk = 0.0027701 k( 303) = ( 0.0350877 0.0350877 0.3174896), wk = 0.0027701 k( 304) = ( 0.0263158 0.0263158 0.3174896), wk = 0.0027701 k( 305) = ( 0.0175439 0.0175439 0.3174896), wk = 0.0027701 k( 306) = ( 0.0087719 0.0087719 0.3174896), wk = 0.0027701 k( 307) = ( 0.0000000 0.0000000 0.3174896), wk = 0.0027701 k( 308) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027701 k( 309) = ( 0.0000000 0.5000000 0.0122111), wk = 0.0027701 k( 310) = ( 0.0000000 0.5000000 0.0244223), wk = 0.0027701 k( 311) = ( 0.0000000 0.5000000 0.0366334), wk = 0.0027701 k( 312) = ( 0.0000000 0.5000000 0.0488446), wk = 0.0027701 k( 313) = ( 0.0000000 0.5000000 0.0610557), wk = 0.0027701 k( 314) = ( 0.0000000 0.5000000 0.0732668), wk = 0.0027701 k( 315) = ( 0.0000000 0.5000000 0.0854780), wk = 0.0027701 k( 316) = ( 0.0000000 0.5000000 0.0976891), wk = 0.0027701 k( 317) = ( 0.0000000 0.5000000 0.1099002), wk = 0.0027701 k( 318) = ( 0.0000000 0.5000000 0.1221114), wk = 0.0027701 k( 319) = ( 0.0000000 0.5000000 0.1343225), wk = 0.0027701 k( 320) = ( 0.0000000 0.5000000 0.1465337), wk = 0.0027701 k( 321) = ( 0.0000000 0.5000000 0.1587448), wk = 0.0027701 k( 322) = ( 0.0000000 0.5000000 0.1709559), wk = 0.0027701 k( 323) = ( 0.0000000 0.5000000 0.1831671), wk = 0.0027701 k( 324) = ( 0.0000000 0.5000000 0.1953782), wk = 0.0027701 k( 325) = ( 0.0000000 0.5000000 0.2075893), wk = 0.0027701 k( 326) = ( 0.0000000 0.5000000 0.2198005), wk = 0.0027701 k( 327) = ( 0.0000000 0.5000000 0.2320116), wk = 0.0027701 k( 328) = ( 0.0000000 0.5000000 0.2442228), wk = 0.0027701 k( 329) = ( 0.0000000 0.5000000 0.2564339), wk = 0.0027701 k( 330) = ( 0.0000000 0.5000000 0.2686450), wk = 0.0027701 k( 331) = ( 0.0000000 0.5000000 0.2808562), wk = 0.0027701 k( 332) = ( 0.0000000 0.5000000 0.2930673), wk = 0.0027701 k( 333) = ( 0.0000000 0.5000000 0.3052784), wk = 0.0027701 k( 334) = ( 0.0000000 0.5000000 0.3174896), wk = 0.0027701 k( 335) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 336) = ( 0.5000000 0.5000000 0.0122111), wk = 0.0027701 k( 337) = ( 0.5000000 0.5000000 0.0244223), wk = 0.0027701 k( 338) = ( 0.5000000 0.5000000 0.0366334), wk = 0.0027701 k( 339) = ( 0.5000000 0.5000000 0.0488446), wk = 0.0027701 k( 340) = ( 0.5000000 0.5000000 0.0610557), wk = 0.0027701 k( 341) = ( 0.5000000 0.5000000 0.0732668), wk = 0.0027701 k( 342) = ( 0.5000000 0.5000000 0.0854780), wk = 0.0027701 k( 343) = ( 0.5000000 0.5000000 0.0976891), wk = 0.0027701 k( 344) = ( 0.5000000 0.5000000 0.1099002), wk = 0.0027701 k( 345) = ( 0.5000000 0.5000000 0.1221114), wk = 0.0027701 k( 346) = ( 0.5000000 0.5000000 0.1343225), wk = 0.0027701 k( 347) = ( 0.5000000 0.5000000 0.1465337), wk = 0.0027701 k( 348) = ( 0.5000000 0.5000000 0.1587448), wk = 0.0027701 k( 349) = ( 0.5000000 0.5000000 0.1709559), wk = 0.0027701 k( 350) = ( 0.5000000 0.5000000 0.1831671), wk = 0.0027701 k( 351) = ( 0.5000000 0.5000000 0.1953782), wk = 0.0027701 k( 352) = ( 0.5000000 0.5000000 0.2075893), wk = 0.0027701 k( 353) = ( 0.5000000 0.5000000 0.2198005), wk = 0.0027701 k( 354) = ( 0.5000000 0.5000000 0.2320116), wk = 0.0027701 k( 355) = ( 0.5000000 0.5000000 0.2442228), wk = 0.0027701 k( 356) = ( 0.5000000 0.5000000 0.2564339), wk = 0.0027701 k( 357) = ( 0.5000000 0.5000000 0.2686450), wk = 0.0027701 k( 358) = ( 0.5000000 0.5000000 0.2808562), wk = 0.0027701 k( 359) = ( 0.5000000 0.5000000 0.2930673), wk = 0.0027701 k( 360) = ( 0.5000000 0.5000000 0.3052784), wk = 0.0027701 k( 361) = ( 0.5000000 0.5000000 0.3174896), wk = 0.0027701 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 2) = ( 0.0000000 0.0125000 0.0000000), wk = 0.0027701 k( 3) = ( 0.0000000 0.0250000 0.0000000), wk = 0.0027701 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0027701 k( 5) = ( 0.0000000 0.0500000 0.0000000), wk = 0.0027701 k( 6) = ( 0.0000000 0.0625000 0.0000000), wk = 0.0027701 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0027701 k( 8) = ( 0.0000000 0.0875000 0.0000000), wk = 0.0027701 k( 9) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0027701 k( 10) = ( 0.0000000 0.1125000 0.0000000), wk = 0.0027701 k( 11) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0027701 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0027701 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0027701 k( 14) = ( 0.0000000 0.1625000 0.0000000), wk = 0.0027701 k( 15) = ( 0.0000000 0.1750000 0.0000000), wk = 0.0027701 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0027701 k( 17) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0027701 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0027701 k( 19) = ( 0.0000000 0.2250000 0.0000000), wk = 0.0027701 k( 20) = ( 0.0000000 0.2375000 0.0000000), wk = 0.0027701 k( 21) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0027701 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0027701 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0027701 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0027701 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0027701 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0027701 k( 27) = ( 0.0000000 0.3250000 0.0000000), wk = 0.0027701 k( 28) = ( 0.0000000 0.3375000 0.0000000), wk = 0.0027701 k( 29) = ( 0.0000000 0.3500000 0.0000000), wk = 0.0027701 k( 30) = ( 0.0000000 0.3625000 0.0000000), wk = 0.0027701 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0027701 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0027701 k( 33) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0027701 k( 34) = ( 0.0000000 0.4125000 0.0000000), wk = 0.0027701 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0027701 k( 36) = ( 0.0000000 0.4375000 0.0000000), wk = 0.0027701 k( 37) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0027701 k( 38) = ( 0.0000000 0.4625000 0.0000000), wk = 0.0027701 k( 39) = ( 0.0000000 0.4750000 0.0000000), wk = 0.0027701 k( 40) = ( 0.0000000 0.4875000 -0.0000000), wk = 0.0027701 k( 41) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027701 k( 42) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027701 k( 43) = ( 0.0125000 0.5000000 0.0000000), wk = 0.0027701 k( 44) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0027701 k( 45) = ( 0.0375000 0.5000000 0.0000000), wk = 0.0027701 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0027701 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0027701 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0027701 k( 49) = ( 0.0875000 0.5000000 0.0000000), wk = 0.0027701 k( 50) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0027701 k( 51) = ( 0.1125000 0.5000000 0.0000000), wk = 0.0027701 k( 52) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0027701 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0027701 k( 54) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0027701 k( 55) = ( 0.1625000 0.5000000 0.0000000), wk = 0.0027701 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0027701 k( 57) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0027701 k( 58) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0027701 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0027701 k( 60) = ( 0.2250000 0.5000000 0.0000000), wk = 0.0027701 k( 61) = ( 0.2375000 0.5000000 0.0000000), wk = 0.0027701 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0027701 k( 63) = ( 0.2625000 0.5000000 0.0000000), wk = 0.0027701 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0027701 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0027701 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0027701 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0027701 k( 68) = ( 0.3250000 0.5000000 0.0000000), wk = 0.0027701 k( 69) = ( 0.3375000 0.5000000 0.0000000), wk = 0.0027701 k( 70) = ( 0.3500000 0.5000000 0.0000000), wk = 0.0027701 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0027701 k( 72) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0027701 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0027701 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0027701 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0027701 k( 76) = ( 0.4250000 0.5000000 0.0000000), wk = 0.0027701 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0027701 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0027701 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0027701 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0027701 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0027701 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 84) = ( 0.4912281 0.4912281 -0.0000000), wk = 0.0027701 k( 85) = ( 0.4824561 0.4824561 0.0000000), wk = 0.0027701 k( 86) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0027701 k( 87) = ( 0.4649123 0.4649123 -0.0000000), wk = 0.0027701 k( 88) = ( 0.4561404 0.4561404 0.0000000), wk = 0.0027701 k( 89) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0027701 k( 90) = ( 0.4385965 0.4385965 -0.0000000), wk = 0.0027701 k( 91) = ( 0.4298246 0.4298246 -0.0000000), wk = 0.0027701 k( 92) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0027701 k( 93) = ( 0.4122807 0.4122807 -0.0000000), wk = 0.0027701 k( 94) = ( 0.4035088 0.4035088 0.0000000), wk = 0.0027701 k( 95) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0027701 k( 96) = ( 0.3859649 0.3859649 -0.0000000), wk = 0.0027701 k( 97) = ( 0.3771930 0.3771930 -0.0000000), wk = 0.0027701 k( 98) = ( 0.3684211 0.3684211 -0.0000000), wk = 0.0027701 k( 99) = ( 0.3596491 0.3596491 -0.0000000), wk = 0.0027701 k( 100) = ( 0.3508772 0.3508772 0.0000000), wk = 0.0027701 k( 101) = ( 0.3421053 0.3421053 0.0000000), wk = 0.0027701 k( 102) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0027701 k( 103) = ( 0.3245614 0.3245614 -0.0000000), wk = 0.0027701 k( 104) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0027701 k( 105) = ( 0.3070175 0.3070175 -0.0000000), wk = 0.0027701 k( 106) = ( 0.2982456 0.2982456 0.0000000), wk = 0.0027701 k( 107) = ( 0.2894737 0.2894737 0.0000000), wk = 0.0027701 k( 108) = ( 0.2807018 0.2807018 -0.0000000), wk = 0.0027701 k( 109) = ( 0.2719298 0.2719298 0.0000000), wk = 0.0027701 k( 110) = ( 0.2631579 0.2631579 0.0000000), wk = 0.0027701 k( 111) = ( 0.2543860 0.2543860 -0.0000000), wk = 0.0027701 k( 112) = ( 0.2456140 0.2456140 0.0000000), wk = 0.0027701 k( 113) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0027701 k( 114) = ( 0.2280702 0.2280702 -0.0000000), wk = 0.0027701 k( 115) = ( 0.2192983 0.2192983 0.0000000), wk = 0.0027701 k( 116) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0027701 k( 117) = ( 0.2017544 0.2017544 -0.0000000), wk = 0.0027701 k( 118) = ( 0.1929825 0.1929825 -0.0000000), wk = 0.0027701 k( 119) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0027701 k( 120) = ( 0.1754386 0.1754386 -0.0000000), wk = 0.0027701 k( 121) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0027701 k( 122) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0027701 k( 123) = ( 0.1491228 0.1491228 -0.0000000), wk = 0.0027701 k( 124) = ( 0.1403509 0.1403509 0.0000000), wk = 0.0027701 k( 125) = ( 0.1315790 0.1315790 0.0000000), wk = 0.0027701 k( 126) = ( 0.1228070 0.1228070 0.0000000), wk = 0.0027701 k( 127) = ( 0.1140351 0.1140351 -0.0000000), wk = 0.0027701 k( 128) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0027701 k( 129) = ( 0.0964912 0.0964912 -0.0000000), wk = 0.0027701 k( 130) = ( 0.0877193 0.0877193 -0.0000000), wk = 0.0027701 k( 131) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0027701 k( 132) = ( 0.0701754 0.0701754 0.0000000), wk = 0.0027701 k( 133) = ( 0.0614035 0.0614035 0.0000000), wk = 0.0027701 k( 134) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0027701 k( 135) = ( 0.0438597 0.0438597 -0.0000000), wk = 0.0027701 k( 136) = ( 0.0350877 0.0350877 0.0000000), wk = 0.0027701 k( 137) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0027701 k( 138) = ( 0.0175439 0.0175439 0.0000000), wk = 0.0027701 k( 139) = ( 0.0087719 0.0087719 0.0000000), wk = 0.0027701 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 142) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0027701 k( 143) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0027701 k( 144) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0027701 k( 145) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0027701 k( 146) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0027701 k( 147) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0027701 k( 148) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0027701 k( 149) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0027701 k( 150) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0027701 k( 151) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0027701 k( 152) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0027701 k( 153) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0027701 k( 154) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027701 k( 155) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0027701 k( 156) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0027701 k( 157) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0027701 k( 158) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0027701 k( 159) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0027701 k( 160) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0027701 k( 161) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0027701 k( 162) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0027701 k( 163) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0027701 k( 164) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0027701 k( 165) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0027701 k( 166) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0027701 k( 167) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 168) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 169) = ( 0.0000000 0.0125000 0.5000000), wk = 0.0027701 k( 170) = ( 0.0000000 0.0250000 0.5000000), wk = 0.0027701 k( 171) = ( 0.0000000 0.0375000 0.5000000), wk = 0.0027701 k( 172) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0027701 k( 173) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0027701 k( 174) = ( 0.0000000 0.0750000 0.5000000), wk = 0.0027701 k( 175) = ( 0.0000000 0.0875000 0.5000000), wk = 0.0027701 k( 176) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0027701 k( 177) = ( 0.0000000 0.1125000 0.5000000), wk = 0.0027701 k( 178) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0027701 k( 179) = ( 0.0000000 0.1375000 0.5000000), wk = 0.0027701 k( 180) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0027701 k( 181) = ( 0.0000000 0.1625000 0.5000000), wk = 0.0027701 k( 182) = ( 0.0000000 0.1750000 0.5000000), wk = 0.0027701 k( 183) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0027701 k( 184) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0027701 k( 185) = ( 0.0000000 0.2125000 0.5000000), wk = 0.0027701 k( 186) = ( 0.0000000 0.2250000 0.5000000), wk = 0.0027701 k( 187) = ( 0.0000000 0.2375000 0.5000000), wk = 0.0027701 k( 188) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0027701 k( 189) = ( 0.0000000 0.2625000 0.5000000), wk = 0.0027701 k( 190) = ( 0.0000000 0.2750000 0.5000000), wk = 0.0027701 k( 191) = ( 0.0000000 0.2875000 0.5000000), wk = 0.0027701 k( 192) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0027701 k( 193) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0027701 k( 194) = ( 0.0000000 0.3250000 0.5000000), wk = 0.0027701 k( 195) = ( 0.0000000 0.3375000 0.5000000), wk = 0.0027701 k( 196) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0027701 k( 197) = ( 0.0000000 0.3625000 0.5000000), wk = 0.0027701 k( 198) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0027701 k( 199) = ( 0.0000000 0.3875000 0.5000000), wk = 0.0027701 k( 200) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0027701 k( 201) = ( 0.0000000 0.4125000 0.5000000), wk = 0.0027701 k( 202) = ( 0.0000000 0.4250000 0.5000000), wk = 0.0027701 k( 203) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0027701 k( 204) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0027701 k( 205) = ( 0.0000000 0.4625000 0.5000000), wk = 0.0027701 k( 206) = ( 0.0000000 0.4750000 0.5000000), wk = 0.0027701 k( 207) = ( 0.0000000 0.4875000 0.5000000), wk = 0.0027701 k( 208) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027701 k( 209) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027701 k( 210) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0027701 k( 211) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0027701 k( 212) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0027701 k( 213) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0027701 k( 214) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0027701 k( 215) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0027701 k( 216) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0027701 k( 217) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0027701 k( 218) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0027701 k( 219) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0027701 k( 220) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0027701 k( 221) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0027701 k( 222) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0027701 k( 223) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0027701 k( 224) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0027701 k( 225) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0027701 k( 226) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0027701 k( 227) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0027701 k( 228) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0027701 k( 229) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0027701 k( 230) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0027701 k( 231) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0027701 k( 232) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0027701 k( 233) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0027701 k( 234) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0027701 k( 235) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0027701 k( 236) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0027701 k( 237) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0027701 k( 238) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0027701 k( 239) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0027701 k( 240) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0027701 k( 241) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0027701 k( 242) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0027701 k( 243) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0027701 k( 244) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0027701 k( 245) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0027701 k( 246) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0027701 k( 247) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0027701 k( 248) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0027701 k( 249) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027701 k( 250) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027701 k( 251) = ( 0.4912281 0.4912281 0.5000000), wk = 0.0027701 k( 252) = ( 0.4824561 0.4824561 0.5000000), wk = 0.0027701 k( 253) = ( 0.4736842 0.4736842 0.5000000), wk = 0.0027701 k( 254) = ( 0.4649123 0.4649123 0.5000000), wk = 0.0027701 k( 255) = ( 0.4561404 0.4561404 0.5000000), wk = 0.0027701 k( 256) = ( 0.4473684 0.4473684 0.5000000), wk = 0.0027701 k( 257) = ( 0.4385965 0.4385965 0.5000000), wk = 0.0027701 k( 258) = ( 0.4298246 0.4298246 0.5000000), wk = 0.0027701 k( 259) = ( 0.4210526 0.4210526 0.5000000), wk = 0.0027701 k( 260) = ( 0.4122807 0.4122807 0.5000000), wk = 0.0027701 k( 261) = ( 0.4035088 0.4035088 0.5000000), wk = 0.0027701 k( 262) = ( 0.3947368 0.3947368 0.5000000), wk = 0.0027701 k( 263) = ( 0.3859649 0.3859649 0.5000000), wk = 0.0027701 k( 264) = ( 0.3771930 0.3771930 0.5000000), wk = 0.0027701 k( 265) = ( 0.3684211 0.3684211 0.5000000), wk = 0.0027701 k( 266) = ( 0.3596491 0.3596491 0.5000000), wk = 0.0027701 k( 267) = ( 0.3508772 0.3508772 0.5000000), wk = 0.0027701 k( 268) = ( 0.3421053 0.3421053 0.5000000), wk = 0.0027701 k( 269) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027701 k( 270) = ( 0.3245614 0.3245614 0.5000000), wk = 0.0027701 k( 271) = ( 0.3157895 0.3157895 0.5000000), wk = 0.0027701 k( 272) = ( 0.3070175 0.3070175 0.5000000), wk = 0.0027701 k( 273) = ( 0.2982456 0.2982456 0.5000000), wk = 0.0027701 k( 274) = ( 0.2894737 0.2894737 0.5000000), wk = 0.0027701 k( 275) = ( 0.2807018 0.2807018 0.5000000), wk = 0.0027701 k( 276) = ( 0.2719298 0.2719298 0.5000000), wk = 0.0027701 k( 277) = ( 0.2631579 0.2631579 0.5000000), wk = 0.0027701 k( 278) = ( 0.2543860 0.2543860 0.5000000), wk = 0.0027701 k( 279) = ( 0.2456140 0.2456140 0.5000000), wk = 0.0027701 k( 280) = ( 0.2368421 0.2368421 0.5000000), wk = 0.0027701 k( 281) = ( 0.2280702 0.2280702 0.5000000), wk = 0.0027701 k( 282) = ( 0.2192983 0.2192983 0.5000000), wk = 0.0027701 k( 283) = ( 0.2105263 0.2105263 0.5000000), wk = 0.0027701 k( 284) = ( 0.2017544 0.2017544 0.5000000), wk = 0.0027701 k( 285) = ( 0.1929825 0.1929825 0.5000000), wk = 0.0027701 k( 286) = ( 0.1842105 0.1842105 0.5000000), wk = 0.0027701 k( 287) = ( 0.1754386 0.1754386 0.5000000), wk = 0.0027701 k( 288) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0027701 k( 289) = ( 0.1578947 0.1578947 0.5000000), wk = 0.0027701 k( 290) = ( 0.1491228 0.1491228 0.5000000), wk = 0.0027701 k( 291) = ( 0.1403509 0.1403509 0.5000000), wk = 0.0027701 k( 292) = ( 0.1315790 0.1315790 0.5000000), wk = 0.0027701 k( 293) = ( 0.1228070 0.1228070 0.5000000), wk = 0.0027701 k( 294) = ( 0.1140351 0.1140351 0.5000000), wk = 0.0027701 k( 295) = ( 0.1052632 0.1052632 0.5000000), wk = 0.0027701 k( 296) = ( 0.0964912 0.0964912 0.5000000), wk = 0.0027701 k( 297) = ( 0.0877193 0.0877193 0.5000000), wk = 0.0027701 k( 298) = ( 0.0789474 0.0789474 0.5000000), wk = 0.0027701 k( 299) = ( 0.0701754 0.0701754 0.5000000), wk = 0.0027701 k( 300) = ( 0.0614035 0.0614035 0.5000000), wk = 0.0027701 k( 301) = ( 0.0526316 0.0526316 0.5000000), wk = 0.0027701 k( 302) = ( 0.0438597 0.0438597 0.5000000), wk = 0.0027701 k( 303) = ( 0.0350877 0.0350877 0.5000000), wk = 0.0027701 k( 304) = ( 0.0263158 0.0263158 0.5000000), wk = 0.0027701 k( 305) = ( 0.0175439 0.0175439 0.5000000), wk = 0.0027701 k( 306) = ( 0.0087719 0.0087719 0.5000000), wk = 0.0027701 k( 307) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 308) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027701 k( 309) = ( 0.0000000 0.5000000 0.0192308), wk = 0.0027701 k( 310) = ( 0.0000000 0.5000000 0.0384615), wk = 0.0027701 k( 311) = ( 0.0000000 0.5000000 0.0576923), wk = 0.0027701 k( 312) = ( 0.0000000 0.5000000 0.0769231), wk = 0.0027701 k( 313) = ( 0.0000000 0.5000000 0.0961538), wk = 0.0027701 k( 314) = ( 0.0000000 0.5000000 0.1153846), wk = 0.0027701 k( 315) = ( 0.0000000 0.5000000 0.1346154), wk = 0.0027701 k( 316) = ( 0.0000000 0.5000000 0.1538461), wk = 0.0027701 k( 317) = ( 0.0000000 0.5000000 0.1730769), wk = 0.0027701 k( 318) = ( 0.0000000 0.5000000 0.1923077), wk = 0.0027701 k( 319) = ( 0.0000000 0.5000000 0.2115385), wk = 0.0027701 k( 320) = ( 0.0000000 0.5000000 0.2307692), wk = 0.0027701 k( 321) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0027701 k( 322) = ( 0.0000000 0.5000000 0.2692308), wk = 0.0027701 k( 323) = ( 0.0000000 0.5000000 0.2884615), wk = 0.0027701 k( 324) = ( 0.0000000 0.5000000 0.3076923), wk = 0.0027701 k( 325) = ( 0.0000000 0.5000000 0.3269231), wk = 0.0027701 k( 326) = ( 0.0000000 0.5000000 0.3461538), wk = 0.0027701 k( 327) = ( 0.0000000 0.5000000 0.3653846), wk = 0.0027701 k( 328) = ( 0.0000000 0.5000000 0.3846154), wk = 0.0027701 k( 329) = ( 0.0000000 0.5000000 0.4038462), wk = 0.0027701 k( 330) = ( 0.0000000 0.5000000 0.4230769), wk = 0.0027701 k( 331) = ( 0.0000000 0.5000000 0.4423077), wk = 0.0027701 k( 332) = ( 0.0000000 0.5000000 0.4615385), wk = 0.0027701 k( 333) = ( 0.0000000 0.5000000 0.4807692), wk = 0.0027701 k( 334) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027701 k( 335) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027701 k( 336) = ( 0.5000000 0.5000000 0.0192308), wk = 0.0027701 k( 337) = ( 0.5000000 0.5000000 0.0384615), wk = 0.0027701 k( 338) = ( 0.5000000 0.5000000 0.0576923), wk = 0.0027701 k( 339) = ( 0.5000000 0.5000000 0.0769231), wk = 0.0027701 k( 340) = ( 0.5000000 0.5000000 0.0961538), wk = 0.0027701 k( 341) = ( 0.5000000 0.5000000 0.1153846), wk = 0.0027701 k( 342) = ( 0.5000000 0.5000000 0.1346154), wk = 0.0027701 k( 343) = ( 0.5000000 0.5000000 0.1538461), wk = 0.0027701 k( 344) = ( 0.5000000 0.5000000 0.1730769), wk = 0.0027701 k( 345) = ( 0.5000000 0.5000000 0.1923077), wk = 0.0027701 k( 346) = ( 0.5000000 0.5000000 0.2115385), wk = 0.0027701 k( 347) = ( 0.5000000 0.5000000 0.2307692), wk = 0.0027701 k( 348) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0027701 k( 349) = ( 0.5000000 0.5000000 0.2692308), wk = 0.0027701 k( 350) = ( 0.5000000 0.5000000 0.2884615), wk = 0.0027701 k( 351) = ( 0.5000000 0.5000000 0.3076923), wk = 0.0027701 k( 352) = ( 0.5000000 0.5000000 0.3269231), wk = 0.0027701 k( 353) = ( 0.5000000 0.5000000 0.3461538), wk = 0.0027701 k( 354) = ( 0.5000000 0.5000000 0.3653846), wk = 0.0027701 k( 355) = ( 0.5000000 0.5000000 0.3846154), wk = 0.0027701 k( 356) = ( 0.5000000 0.5000000 0.4038462), wk = 0.0027701 k( 357) = ( 0.5000000 0.5000000 0.4230769), wk = 0.0027701 k( 358) = ( 0.5000000 0.5000000 0.4423077), wk = 0.0027701 k( 359) = ( 0.5000000 0.5000000 0.4615385), wk = 0.0027701 k( 360) = ( 0.5000000 0.5000000 0.4807692), wk = 0.0027701 k( 361) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027701 Dense grid: 84613 G-vectors FFT dimensions: ( 48, 48, 75) Smooth grid: 40409 G-vectors FFT dimensions: ( 40, 40, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.27 Mb ( 286, 62) NL pseudopotentials 0.27 Mb ( 143, 124) Each V/rho on FFT grid 0.11 Mb ( 6912) Each G-vector array 0.02 Mb ( 2347) G-vector shells 0.01 Mb ( 1119) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.08 Mb ( 286, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.23 Mb ( 124, 2, 62) Check: negative/imaginary core charge= -0.000007 0.000000 The potential is recalculated from file : ./MgCuAs.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.2 secs Computing kpt #: 2 total cpu time spent up to now is 4.8 secs Computing kpt #: 3 total cpu time spent up to now is 5.2 secs Computing kpt #: 4 total cpu time spent up to now is 5.6 secs Computing kpt #: 5 total cpu time spent up to now is 6.0 secs Computing kpt #: 6 total cpu time spent up to now is 6.5 secs Computing kpt #: 7 total cpu time spent up to now is 7.0 secs Computing kpt #: 8 total cpu time spent up to now is 7.4 secs Computing kpt #: 9 total cpu time spent up to now is 7.9 secs Computing kpt #: 10 total cpu time spent up to now is 8.4 secs Computing kpt #: 11 total cpu time spent up to now is 8.9 secs Computing kpt #: 12 total cpu time spent up to now is 9.3 secs Computing kpt #: 13 total cpu time spent up to now is 9.9 secs Computing kpt #: 14 total cpu time spent up to now is 10.4 secs Computing kpt #: 15 total cpu time spent up to now is 10.9 secs Computing kpt #: 16 total cpu time spent up to now is 11.4 secs Computing kpt #: 17 total cpu time spent up to now is 11.9 secs Computing kpt #: 18 total cpu time spent up to now is 12.4 secs Computing kpt #: 19 total cpu time spent up to now is 12.9 secs Computing kpt #: 20 total cpu time spent up to now is 13.3 secs Computing kpt #: 21 total cpu time spent up to now is 13.8 secs Computing kpt #: 22 total cpu time spent up to now is 14.3 secs Computing kpt #: 23 total cpu time spent up to now is 14.7 secs Computing kpt #: 24 total cpu time spent up to now is 15.2 secs Computing kpt #: 25 total cpu time spent up to now is 15.6 secs Computing kpt #: 26 total cpu time spent up to now is 16.1 secs Computing kpt #: 27 total cpu time spent up to now is 16.5 secs Computing kpt #: 28 total cpu time spent up to now is 17.0 secs Computing kpt #: 29 total cpu time spent up to now is 17.4 secs Computing kpt #: 30 total cpu time spent up to now is 17.9 secs Computing kpt #: 31 total cpu time spent up to now is 18.3 secs Computing kpt #: 32 total cpu time spent up to now is 18.7 secs Computing kpt #: 33 total cpu time spent up to now is 19.2 secs Computing kpt #: 34 total cpu time spent up to now is 19.6 secs Computing kpt #: 35 total cpu time spent up to now is 20.1 secs Computing kpt #: 36 total cpu time spent up to now is 20.5 secs Computing kpt #: 37 total cpu time spent up to now is 21.0 secs Computing kpt #: 38 total cpu time spent up to now is 21.5 secs Computing kpt #: 39 total cpu time spent up to now is 21.9 secs Computing kpt #: 40 total cpu time spent up to now is 22.4 secs Computing kpt #: 41 total cpu time spent up to now is 22.9 secs Computing kpt #: 42 total cpu time spent up to now is 23.4 secs Computing kpt #: 43 total cpu time spent up to now is 24.4 secs Computing kpt #: 44 total cpu time spent up to now is 24.9 secs Computing kpt #: 45 total cpu time spent up to now is 25.4 secs Computing kpt #: 46 total cpu time spent up to now is 25.9 secs Computing kpt #: 47 total cpu time spent up to now is 26.3 secs Computing kpt #: 48 total cpu time spent up to now is 26.8 secs Computing kpt #: 49 total cpu time spent up to now is 27.3 secs Computing kpt #: 50 total cpu time spent up to now is 27.8 secs Computing kpt #: 51 total cpu time spent up to now is 28.3 secs Computing kpt #: 52 total cpu time spent up to now is 28.8 secs Computing kpt #: 53 total cpu time spent up to now is 29.3 secs Computing kpt #: 54 total cpu time spent up to now is 29.8 secs Computing kpt #: 55 total cpu time spent up to now is 30.3 secs Computing kpt #: 56 total cpu time spent up to now is 30.8 secs Computing kpt #: 57 total cpu time spent up to now is 31.3 secs Computing kpt #: 58 total cpu time spent up to now is 31.8 secs Computing kpt #: 59 total cpu time spent up to now is 32.3 secs Computing kpt #: 60 total cpu time spent up to now is 32.8 secs Computing kpt #: 61 total cpu time spent up to now is 33.3 secs Computing kpt #: 62 total cpu time spent up to now is 33.8 secs Computing kpt #: 63 total cpu time spent up to now is 34.3 secs Computing kpt #: 64 total cpu time spent up to now is 34.9 secs Computing kpt #: 65 total cpu time spent up to now is 35.4 secs Computing kpt #: 66 total cpu time spent up to now is 36.0 secs Computing kpt #: 67 total cpu time spent up to now is 36.6 secs Computing kpt #: 68 total cpu time spent up to now is 37.1 secs Computing kpt #: 69 total cpu time spent up to now is 37.7 secs Computing kpt #: 70 total cpu time spent up to now is 38.3 secs Computing kpt #: 71 total cpu time spent up to now is 38.9 secs Computing kpt #: 72 total cpu time spent up to now is 39.5 secs Computing kpt #: 73 total cpu time spent up to now is 40.2 secs Computing kpt #: 74 total cpu time spent up to now is 41.0 secs Computing kpt #: 75 total cpu time spent up to now is 41.8 secs Computing kpt #: 76 total cpu time spent up to now is 42.7 secs Computing kpt #: 77 total cpu time spent up to now is 43.5 secs Computing kpt #: 78 total cpu time spent up to now is 44.4 secs Computing kpt #: 79 total cpu time spent up to now is 45.2 secs Computing kpt #: 80 total cpu time spent up to now is 46.2 secs Computing kpt #: 81 total cpu time spent up to now is 47.0 secs Computing kpt #: 82 total cpu time spent up to now is 47.7 secs Computing kpt #: 83 total cpu time spent up to now is 48.3 secs Computing kpt #: 84 total cpu time spent up to now is 49.2 secs Computing kpt #: 85 total cpu time spent up to now is 49.9 secs Computing kpt #: 86 total cpu time spent up to now is 50.6 secs Computing kpt #: 87 total cpu time spent up to now is 51.3 secs Computing kpt #: 88 total cpu time spent up to now is 51.9 secs Computing kpt #: 89 total cpu time spent up to now is 52.5 secs Computing kpt #: 90 total cpu time spent up to now is 53.0 secs Computing kpt #: 91 total cpu time spent up to now is 53.5 secs Computing kpt #: 92 total cpu time spent up to now is 54.0 secs Computing kpt #: 93 total cpu time spent up to now is 54.5 secs Computing kpt #: 94 total cpu time spent up to now is 55.0 secs Computing kpt #: 95 total cpu time spent up to now is 55.4 secs Computing kpt #: 96 total cpu time spent up to now is 55.9 secs Computing kpt #: 97 total cpu time spent up to now is 56.3 secs Computing kpt #: 98 total cpu time spent up to now is 56.8 secs Computing kpt #: 99 total cpu time spent up to now is 57.2 secs Computing kpt #: 100 total cpu time spent up to now is 57.7 secs Computing kpt #: 101 total cpu time spent up to now is 58.1 secs Computing kpt #: 102 total cpu time spent up to now is 58.6 secs Computing kpt #: 103 total cpu time spent up to now is 59.0 secs Computing kpt #: 104 total cpu time spent up to now is 59.4 secs Computing kpt #: 105 total cpu time spent up to now is 59.9 secs Computing kpt #: 106 total cpu time spent up to now is 60.3 secs Computing kpt #: 107 total cpu time spent up to now is 60.7 secs Computing kpt #: 108 total cpu time spent up to now is 61.2 secs Computing kpt #: 109 total cpu time spent up to now is 61.6 secs Computing kpt #: 110 total cpu time spent up to now is 62.1 secs Computing kpt #: 111 total cpu time spent up to now is 62.5 secs Computing kpt #: 112 total cpu time spent up to now is 63.0 secs Computing kpt #: 113 total cpu time spent up to now is 63.4 secs Computing kpt #: 114 total cpu time spent up to now is 63.9 secs Computing kpt #: 115 total cpu time spent up to now is 64.3 secs Computing kpt #: 116 total cpu time spent up to now is 64.8 secs Computing kpt #: 117 total cpu time spent up to now is 65.3 secs Computing kpt #: 118 total cpu time spent up to now is 65.8 secs Computing kpt #: 119 total cpu time spent up to now is 66.3 secs Computing kpt #: 120 total cpu time spent up to now is 66.8 secs Computing kpt #: 121 total cpu time spent up to now is 67.2 secs Computing kpt #: 122 total cpu time spent up to now is 67.7 secs Computing kpt #: 123 total cpu time spent up to now is 68.2 secs Computing kpt #: 124 total cpu time spent up to now is 68.7 secs Computing kpt #: 125 total cpu time spent up to now is 69.2 secs Computing kpt #: 126 total cpu time spent up to now is 69.6 secs Computing kpt #: 127 total cpu time spent up to now is 70.1 secs Computing kpt #: 128 total cpu time spent up to now is 70.6 secs Computing kpt #: 129 total cpu time spent up to now is 71.1 secs Computing kpt #: 130 total cpu time spent up to now is 71.6 secs Computing kpt #: 131 total cpu time spent up to now is 72.0 secs Computing kpt #: 132 total cpu time spent up to now is 72.5 secs Computing kpt #: 133 total cpu time spent up to now is 73.0 secs Computing kpt #: 134 total cpu time spent up to now is 73.4 secs Computing kpt #: 135 total cpu time spent up to now is 73.9 secs Computing kpt #: 136 total cpu time spent up to now is 74.3 secs Computing kpt #: 137 total cpu time spent up to now is 74.8 secs Computing kpt #: 138 total cpu time spent up to now is 75.2 secs Computing kpt #: 139 total cpu time spent up to now is 75.6 secs Computing kpt #: 140 total cpu time spent up to now is 76.0 secs Computing kpt #: 141 total cpu time spent up to now is 76.4 secs Computing kpt #: 142 total cpu time spent up to now is 76.8 secs Computing kpt #: 143 total cpu time spent up to now is 77.2 secs Computing kpt #: 144 total cpu time spent up to now is 77.6 secs Computing kpt #: 145 total cpu time spent up to now is 78.1 secs Computing kpt #: 146 total cpu time spent up to now is 78.5 secs Computing kpt #: 147 total cpu time spent up to now is 79.0 secs Computing kpt #: 148 total cpu time spent up to now is 79.4 secs Computing kpt #: 149 total cpu time spent up to now is 79.9 secs Computing kpt #: 150 total cpu time spent up to now is 80.3 secs Computing kpt #: 151 total cpu time spent up to now is 80.8 secs Computing kpt #: 152 total cpu time spent up to now is 81.3 secs Computing kpt #: 153 total cpu time spent up to now is 81.8 secs Computing kpt #: 154 total cpu time spent up to now is 82.4 secs Computing kpt #: 155 total cpu time spent up to now is 82.9 secs Computing kpt #: 156 total cpu time spent up to now is 83.4 secs Computing kpt #: 157 total cpu time spent up to now is 84.0 secs Computing kpt #: 158 total cpu time spent up to now is 84.5 secs Computing kpt #: 159 total cpu time spent up to now is 85.0 secs Computing kpt #: 160 total cpu time spent up to now is 85.5 secs Computing kpt #: 161 total cpu time spent up to now is 86.0 secs Computing kpt #: 162 total cpu time spent up to now is 86.4 secs Computing kpt #: 163 total cpu time spent up to now is 86.9 secs Computing kpt #: 164 total cpu time spent up to now is 87.4 secs Computing kpt #: 165 total cpu time spent up to now is 87.9 secs Computing kpt #: 166 total cpu time spent up to now is 88.3 secs Computing kpt #: 167 total cpu time spent up to now is 88.8 secs Computing kpt #: 168 total cpu time spent up to now is 89.3 secs Computing kpt #: 169 total cpu time spent up to now is 89.7 secs Computing kpt #: 170 total cpu time spent up to now is 90.2 secs Computing kpt #: 171 total cpu time spent up to now is 90.7 secs Computing kpt #: 172 total cpu time spent up to now is 91.2 secs Computing kpt #: 173 total cpu time spent up to now is 91.7 secs Computing kpt #: 174 total cpu time spent up to now is 92.2 secs Computing kpt #: 175 total cpu time spent up to now is 92.7 secs Computing kpt #: 176 total cpu time spent up to now is 93.2 secs Computing kpt #: 177 total cpu time spent up to now is 93.7 secs Computing kpt #: 178 total cpu time spent up to now is 94.2 secs Computing kpt #: 179 total cpu time spent up to now is 94.7 secs Computing kpt #: 180 total cpu time spent up to now is 95.2 secs Computing kpt #: 181 total cpu time spent up to now is 95.7 secs Computing kpt #: 182 total cpu time spent up to now is 96.1 secs Computing kpt #: 183 total cpu time spent up to now is 96.6 secs Computing kpt #: 184 total cpu time spent up to now is 97.1 secs Computing kpt #: 185 total cpu time spent up to now is 97.5 secs Computing kpt #: 186 total cpu time spent up to now is 98.0 secs Computing kpt #: 187 total cpu time spent up to now is 98.5 secs Computing kpt #: 188 total cpu time spent up to now is 98.9 secs Computing kpt #: 189 total cpu time spent up to now is 99.4 secs Computing kpt #: 190 total cpu time spent up to now is 99.8 secs Computing kpt #: 191 total cpu time spent up to now is 100.3 secs Computing kpt #: 192 total cpu time spent up to now is 100.7 secs Computing kpt #: 193 total cpu time spent up to now is 101.1 secs Computing kpt #: 194 total cpu time spent up to now is 101.6 secs Computing kpt #: 195 total cpu time spent up to now is 102.0 secs Computing kpt #: 196 total cpu time spent up to now is 102.4 secs Computing kpt #: 197 total cpu time spent up to now is 102.9 secs Computing kpt #: 198 total cpu time spent up to now is 103.3 secs Computing kpt #: 199 total cpu time spent up to now is 103.7 secs Computing kpt #: 200 total cpu time spent up to now is 104.1 secs Computing kpt #: 201 total cpu time spent up to now is 104.6 secs Computing kpt #: 202 total cpu time spent up to now is 105.0 secs Computing kpt #: 203 total cpu time spent up to now is 105.4 secs Computing kpt #: 204 total cpu time spent up to now is 105.9 secs Computing kpt #: 205 total cpu time spent up to now is 106.3 secs Computing kpt #: 206 total cpu time spent up to now is 106.8 secs Computing kpt #: 207 total cpu time spent up to now is 107.2 secs Computing kpt #: 208 total cpu time spent up to now is 107.6 secs Computing kpt #: 209 total cpu time spent up to now is 108.1 secs Computing kpt #: 210 total cpu time spent up to now is 108.6 secs Computing kpt #: 211 total cpu time spent up to now is 109.0 secs Computing kpt #: 212 total cpu time spent up to now is 109.5 secs Computing kpt #: 213 total cpu time spent up to now is 109.9 secs Computing kpt #: 214 total cpu time spent up to now is 110.5 secs Computing kpt #: 215 total cpu time spent up to now is 111.1 secs Computing kpt #: 216 total cpu time spent up to now is 111.6 secs Computing kpt #: 217 total cpu time spent up to now is 112.0 secs Computing kpt #: 218 total cpu time spent up to now is 112.5 secs Computing kpt #: 219 total cpu time spent up to now is 113.0 secs Computing kpt #: 220 total cpu time spent up to now is 113.6 secs Computing kpt #: 221 total cpu time spent up to now is 114.1 secs Computing kpt #: 222 total cpu time spent up to now is 114.6 secs Computing kpt #: 223 total cpu time spent up to now is 115.1 secs Computing kpt #: 224 total cpu time spent up to now is 115.7 secs Computing kpt #: 225 total cpu time spent up to now is 116.3 secs Computing kpt #: 226 total cpu time spent up to now is 116.9 secs Computing kpt #: 227 total cpu time spent up to now is 117.4 secs Computing kpt #: 228 total cpu time spent up to now is 117.9 secs Computing kpt #: 229 total cpu time spent up to now is 118.4 secs Computing kpt #: 230 total cpu time spent up to now is 118.9 secs Computing kpt #: 231 total cpu time spent up to now is 119.3 secs Computing kpt #: 232 total cpu time spent up to now is 119.8 secs Computing kpt #: 233 total cpu time spent up to now is 120.3 secs Computing kpt #: 234 total cpu time spent up to now is 120.8 secs Computing kpt #: 235 total cpu time spent up to now is 121.3 secs Computing kpt #: 236 total cpu time spent up to now is 121.8 secs Computing kpt #: 237 total cpu time spent up to now is 122.3 secs Computing kpt #: 238 total cpu time spent up to now is 122.8 secs Computing kpt #: 239 total cpu time spent up to now is 123.3 secs Computing kpt #: 240 total cpu time spent up to now is 123.8 secs Computing kpt #: 241 total cpu time spent up to now is 124.3 secs Computing kpt #: 242 total cpu time spent up to now is 124.8 secs Computing kpt #: 243 total cpu time spent up to now is 125.3 secs Computing kpt #: 244 total cpu time spent up to now is 125.9 secs Computing kpt #: 245 total cpu time spent up to now is 126.4 secs Computing kpt #: 246 total cpu time spent up to now is 126.9 secs Computing kpt #: 247 total cpu time spent up to now is 127.4 secs Computing kpt #: 248 total cpu time spent up to now is 128.0 secs Computing kpt #: 249 total cpu time spent up to now is 128.4 secs Computing kpt #: 250 total cpu time spent up to now is 128.9 secs Computing kpt #: 251 total cpu time spent up to now is 129.4 secs Computing kpt #: 252 total cpu time spent up to now is 129.9 secs Computing kpt #: 253 total cpu time spent up to now is 130.4 secs Computing kpt #: 254 total cpu time spent up to now is 130.9 secs Computing kpt #: 255 total cpu time spent up to now is 131.4 secs Computing kpt #: 256 total cpu time spent up to now is 131.8 secs Computing kpt #: 257 total cpu time spent up to now is 132.3 secs Computing kpt #: 258 total cpu time spent up to now is 132.7 secs Computing kpt #: 259 total cpu time spent up to now is 133.2 secs Computing kpt #: 260 total cpu time spent up to now is 133.6 secs Computing kpt #: 261 total cpu time spent up to now is 134.1 secs Computing kpt #: 262 total cpu time spent up to now is 134.5 secs Computing kpt #: 263 total cpu time spent up to now is 135.0 secs Computing kpt #: 264 total cpu time spent up to now is 135.4 secs Computing kpt #: 265 total cpu time spent up to now is 135.9 secs Computing kpt #: 266 total cpu time spent up to now is 136.3 secs Computing kpt #: 267 total cpu time spent up to now is 136.7 secs Computing kpt #: 268 total cpu time spent up to now is 137.2 secs Computing kpt #: 269 total cpu time spent up to now is 137.6 secs Computing kpt #: 270 total cpu time spent up to now is 138.1 secs Computing kpt #: 271 total cpu time spent up to now is 138.5 secs Computing kpt #: 272 total cpu time spent up to now is 138.9 secs Computing kpt #: 273 total cpu time spent up to now is 139.4 secs Computing kpt #: 274 total cpu time spent up to now is 139.8 secs Computing kpt #: 275 total cpu time spent up to now is 140.3 secs Computing kpt #: 276 total cpu time spent up to now is 140.7 secs Computing kpt #: 277 total cpu time spent up to now is 141.2 secs Computing kpt #: 278 total cpu time spent up to now is 141.7 secs Computing kpt #: 279 total cpu time spent up to now is 142.2 secs Computing kpt #: 280 total cpu time spent up to now is 142.7 secs Computing kpt #: 281 total cpu time spent up to now is 143.1 secs Computing kpt #: 282 total cpu time spent up to now is 143.6 secs Computing kpt #: 283 total cpu time spent up to now is 144.1 secs Computing kpt #: 284 total cpu time spent up to now is 144.5 secs Computing kpt #: 285 total cpu time spent up to now is 145.0 secs Computing kpt #: 286 total cpu time spent up to now is 145.4 secs Computing kpt #: 287 total cpu time spent up to now is 145.9 secs Computing kpt #: 288 total cpu time spent up to now is 146.4 secs Computing kpt #: 289 total cpu time spent up to now is 146.8 secs Computing kpt #: 290 total cpu time spent up to now is 147.3 secs Computing kpt #: 291 total cpu time spent up to now is 147.8 secs Computing kpt #: 292 total cpu time spent up to now is 148.3 secs Computing kpt #: 293 total cpu time spent up to now is 148.7 secs Computing kpt #: 294 total cpu time spent up to now is 149.2 secs Computing kpt #: 295 total cpu time spent up to now is 149.7 secs Computing kpt #: 296 total cpu time spent up to now is 150.2 secs Computing kpt #: 297 total cpu time spent up to now is 150.7 secs Computing kpt #: 298 total cpu time spent up to now is 151.2 secs Computing kpt #: 299 total cpu time spent up to now is 151.6 secs Computing kpt #: 300 total cpu time spent up to now is 152.1 secs Computing kpt #: 301 total cpu time spent up to now is 152.6 secs Computing kpt #: 302 total cpu time spent up to now is 153.1 secs Computing kpt #: 303 total cpu time spent up to now is 153.6 secs Computing kpt #: 304 total cpu time spent up to now is 154.1 secs Computing kpt #: 305 total cpu time spent up to now is 154.5 secs Computing kpt #: 306 total cpu time spent up to now is 155.0 secs Computing kpt #: 307 total cpu time spent up to now is 155.5 secs Computing kpt #: 308 total cpu time spent up to now is 155.9 secs Computing kpt #: 309 total cpu time spent up to now is 156.4 secs Computing kpt #: 310 total cpu time spent up to now is 156.9 secs Computing kpt #: 311 total cpu time spent up to now is 157.3 secs Computing kpt #: 312 total cpu time spent up to now is 157.8 secs Computing kpt #: 313 total cpu time spent up to now is 158.2 secs Computing kpt #: 314 total cpu time spent up to now is 158.7 secs Computing kpt #: 315 total cpu time spent up to now is 159.2 secs Computing kpt #: 316 total cpu time spent up to now is 159.6 secs Computing kpt #: 317 total cpu time spent up to now is 160.1 secs Computing kpt #: 318 total cpu time spent up to now is 160.5 secs Computing kpt #: 319 total cpu time spent up to now is 160.9 secs Computing kpt #: 320 total cpu time spent up to now is 161.4 secs Computing kpt #: 321 total cpu time spent up to now is 161.8 secs Computing kpt #: 322 total cpu time spent up to now is 162.2 secs Computing kpt #: 323 total cpu time spent up to now is 162.7 secs Computing kpt #: 324 total cpu time spent up to now is 163.1 secs Computing kpt #: 325 total cpu time spent up to now is 163.5 secs Computing kpt #: 326 total cpu time spent up to now is 164.0 secs Computing kpt #: 327 total cpu time spent up to now is 164.4 secs Computing kpt #: 328 total cpu time spent up to now is 164.9 secs Computing kpt #: 329 total cpu time spent up to now is 165.3 secs Computing kpt #: 330 total cpu time spent up to now is 165.7 secs Computing kpt #: 331 total cpu time spent up to now is 166.2 secs Computing kpt #: 332 total cpu time spent up to now is 166.7 secs Computing kpt #: 333 total cpu time spent up to now is 167.1 secs Computing kpt #: 334 total cpu time spent up to now is 167.6 secs Computing kpt #: 335 total cpu time spent up to now is 168.2 secs Computing kpt #: 336 total cpu time spent up to now is 168.9 secs Computing kpt #: 337 total cpu time spent up to now is 169.5 secs Computing kpt #: 338 total cpu time spent up to now is 170.1 secs Computing kpt #: 339 total cpu time spent up to now is 170.7 secs Computing kpt #: 340 total cpu time spent up to now is 171.3 secs Computing kpt #: 341 total cpu time spent up to now is 171.9 secs Computing kpt #: 342 total cpu time spent up to now is 172.5 secs Computing kpt #: 343 total cpu time spent up to now is 173.1 secs Computing kpt #: 344 total cpu time spent up to now is 173.6 secs Computing kpt #: 345 total cpu time spent up to now is 174.1 secs Computing kpt #: 346 total cpu time spent up to now is 174.6 secs Computing kpt #: 347 total cpu time spent up to now is 175.1 secs Computing kpt #: 348 total cpu time spent up to now is 175.5 secs Computing kpt #: 349 total cpu time spent up to now is 176.0 secs Computing kpt #: 350 total cpu time spent up to now is 176.4 secs Computing kpt #: 351 total cpu time spent up to now is 176.9 secs Computing kpt #: 352 total cpu time spent up to now is 177.3 secs Computing kpt #: 353 total cpu time spent up to now is 177.8 secs Computing kpt #: 354 total cpu time spent up to now is 178.2 secs Computing kpt #: 355 total cpu time spent up to now is 178.7 secs Computing kpt #: 356 total cpu time spent up to now is 179.1 secs Computing kpt #: 357 total cpu time spent up to now is 179.6 secs Computing kpt #: 358 total cpu time spent up to now is 180.0 secs Computing kpt #: 359 total cpu time spent up to now is 180.5 secs Computing kpt #: 360 total cpu time spent up to now is 181.0 secs Computing kpt #: 361 total cpu time spent up to now is 181.5 secs ethr = 1.92E-08, avg # of iterations = 17.6 total cpu time spent up to now is 181.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2763 -3.2763 -1.1693 -1.1693 2.3410 2.3410 4.7263 4.7263 5.1445 5.1445 5.1727 5.1727 5.2702 5.2702 5.6076 5.6076 5.9798 5.9798 6.0706 6.0706 6.1339 6.1339 6.4412 6.4412 6.6297 6.6297 6.7444 6.7444 6.7716 6.7716 6.8675 6.8675 9.1521 9.1521 9.8087 9.8087 9.9912 9.9912 11.1337 11.1337 11.8414 11.8414 11.8912 11.8912 12.4369 12.4369 k = 0.0000 0.0125-0.0000 ( 5027 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2752 -3.2752 -1.1691 -1.1691 2.3424 2.3424 4.7266 4.7266 5.1447 5.1447 5.1724 5.1724 5.2699 5.2699 5.6078 5.6078 5.9772 5.9772 6.0709 6.0709 6.1339 6.1339 6.4409 6.4409 6.5783 6.5783 6.7446 6.7446 6.7963 6.7963 6.8923 6.8923 9.1381 9.1381 9.8138 9.8138 9.9948 9.9948 11.1361 11.1361 11.8287 11.8287 11.8831 11.8831 12.4609 12.4609 k = 0.0000 0.0250-0.0000 ( 5027 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2717 -3.2717 -1.1686 -1.1686 2.3467 2.3467 4.7274 4.7274 5.1456 5.1456 5.1714 5.1714 5.2689 5.2689 5.6084 5.6084 5.9688 5.9688 6.0715 6.0715 6.1340 6.1340 6.4395 6.4395 6.4877 6.4877 6.7249 6.7249 6.8372 6.8372 6.9565 6.9565 9.0981 9.0981 9.8265 9.8265 10.0064 10.0064 11.1426 11.1426 11.7795 11.7795 11.8802 11.8802 12.5232 12.5232 k = 0.0000 0.0375-0.0000 ( 5035 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2661 -3.2661 -1.1677 -1.1677 2.3538 2.3538 4.7286 4.7286 5.1469 5.1469 5.1697 5.1697 5.2675 5.2675 5.6093 5.6093 5.9534 5.9534 6.0720 6.0720 6.1338 6.1338 6.3909 6.3909 6.4387 6.4387 6.7001 6.7001 6.8711 6.8711 7.0367 7.0367 9.0371 9.0371 9.8413 9.8413 10.0270 10.0270 11.1506 11.1506 11.7071 11.7071 11.8880 11.8880 12.6079 12.6079 k = 0.0000 0.0500-0.0000 ( 5033 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2581 -3.2581 -1.1664 -1.1664 2.3638 2.3638 4.7303 4.7303 5.1487 5.1487 5.1669 5.1669 5.2659 5.2659 5.6106 5.6106 5.9281 5.9281 6.0717 6.0717 6.1328 6.1328 6.3008 6.3008 6.4360 6.4360 6.6738 6.6738 6.9026 6.9026 7.1180 7.1180 8.9604 8.9604 9.8535 9.8535 10.0566 10.0566 11.1548 11.1548 11.6327 11.6327 11.9020 11.9020 12.7041 12.7041 k = 0.0000 0.0625-0.0000 ( 5029 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2479 -3.2479 -1.1649 -1.1649 2.3766 2.3766 4.7322 4.7322 5.1509 5.1509 5.1628 5.1628 5.2644 5.2644 5.6122 5.6122 5.8877 5.8877 6.0697 6.0697 6.1289 6.1289 6.2268 6.2268 6.4328 6.4328 6.6469 6.6469 6.9337 6.9337 7.1954 7.1954 8.8722 8.8722 9.8614 9.8614 10.0937 10.0937 11.1458 11.1458 11.5732 11.5732 11.9209 11.9209 12.8065 12.8065 k = 0.0000 0.0750-0.0000 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2354 -3.2354 -1.1631 -1.1631 2.3923 2.3923 4.7342 4.7342 5.1523 5.1523 5.1583 5.1583 5.2633 5.2633 5.6141 5.6141 5.8270 5.8270 6.0643 6.0643 6.1168 6.1168 6.1825 6.1825 6.4289 6.4289 6.6198 6.6198 6.9652 6.9652 7.2664 7.2664 8.7757 8.7757 9.8652 9.8652 10.1357 10.1357 11.1125 11.1125 11.5431 11.5431 11.9442 11.9442 12.9127 12.9127 k = 0.0000 0.0875-0.0000 ( 5029 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2208 -3.2208 -1.1612 -1.1612 2.4108 2.4108 4.7359 4.7359 5.1466 5.1466 5.1591 5.1591 5.2631 5.2631 5.6159 5.6159 5.7466 5.7466 6.0534 6.0534 6.0997 6.0997 6.1679 6.1679 6.4244 6.4244 6.5924 6.5924 6.9973 6.9973 7.3299 7.3299 8.6734 8.6734 9.8658 9.8658 10.1806 10.1806 11.0526 11.0526 11.5468 11.5468 11.9718 11.9718 13.0218 13.0218 k = 0.0000 0.1000-0.0000 ( 5031 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3030 -33.3030 -33.3019 -33.3019 -33.2808 -33.2808 -33.2805 -33.2805 -3.2038 -3.2038 -1.1591 -1.1591 2.4321 2.4321 4.7371 4.7371 5.1360 5.1360 5.1629 5.1629 5.2637 5.2637 5.6155 5.6155 5.6553 5.6553 6.0384 6.0384 6.0882 6.0882 6.1657 6.1657 6.4192 6.4192 6.5649 6.5649 7.0302 7.0302 7.3847 7.3847 8.5671 8.5671 9.8639 9.8639 10.2270 10.2270 10.9743 10.9743 11.5770 11.5770 12.0034 12.0034 13.1338 13.1338 k = 0.0000 0.1125-0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2809 -33.2809 -33.2805 -33.2805 -3.1847 -3.1847 -1.1571 -1.1571 2.4562 2.4562 4.7370 4.7370 5.1225 5.1225 5.1675 5.1675 5.2649 5.2649 5.5488 5.5488 5.6244 5.6244 6.0234 6.0234 6.0808 6.0808 6.1673 6.1673 6.4132 6.4132 6.5372 6.5372 7.0640 7.0640 7.4302 7.4302 8.4581 8.4581 9.8599 9.8599 10.2741 10.2741 10.8878 10.8878 11.6244 11.6244 12.0392 12.0392 13.2492 13.2492 k = 0.0000 0.1250-0.0000 ( 5033 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2809 -33.2809 -33.2805 -33.2805 -3.1635 -3.1635 -1.1551 -1.1551 2.4831 2.4831 4.7346 4.7346 5.1062 5.1062 5.1727 5.1727 5.2659 5.2659 5.4497 5.4497 5.6263 5.6263 6.0100 6.0100 6.0748 6.0748 6.1704 6.1704 6.4066 6.4066 6.5094 6.5094 7.0987 7.0987 7.4657 7.4657 8.3477 8.3477 9.8541 9.8541 10.3215 10.3215 10.7999 10.7999 11.6824 11.6824 12.0788 12.0788 13.3686 13.3686 k = 0.0000 0.1375-0.0000 ( 5031 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2809 -33.2809 -33.2805 -33.2805 -3.1400 -3.1400 -1.1534 -1.1534 2.5128 2.5128 4.7285 4.7285 5.0873 5.0873 5.1784 5.1784 5.2617 5.2617 5.3588 5.3588 5.6292 5.6292 5.9980 5.9980 6.0689 6.0689 6.1742 6.1742 6.3991 6.3991 6.4815 6.4815 7.1345 7.1345 7.4906 7.4906 8.2369 8.2369 9.8465 9.8465 10.3689 10.3689 10.7149 10.7149 11.7468 11.7468 12.1223 12.1223 13.4926 13.4926 k = 0.0000 0.1500-0.0000 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2809 -33.2809 -33.2806 -33.2806 -3.1145 -3.1145 -1.1520 -1.1520 2.5452 2.5452 4.7163 4.7163 5.0657 5.0657 5.1840 5.1840 5.2263 5.2263 5.3074 5.3074 5.6324 5.6324 5.9870 5.9870 6.0627 6.0627 6.1782 6.1782 6.3909 6.3909 6.4537 6.4537 7.1713 7.1713 7.5047 7.5047 8.1264 8.1264 9.8372 9.8372 10.4161 10.4161 10.6361 10.6361 11.8151 11.8151 12.1695 12.1695 13.5983 13.5983 k = 0.0000 0.1625-0.0000 ( 5040 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5799 -33.5799 -33.3029 -33.3029 -33.3020 -33.3020 -33.2809 -33.2809 -33.2806 -33.2806 -3.0868 -3.0868 -1.1510 -1.1510 2.5804 2.5804 4.6947 4.6947 5.0415 5.0415 5.1535 5.1535 5.1940 5.1940 5.3013 5.3013 5.6357 5.6357 5.9769 5.9769 6.0562 6.0562 6.1824 6.1824 6.3815 6.3815 6.4261 6.4261 7.2092 7.2092 7.5077 7.5077 8.0171 8.0171 9.8262 9.8262 10.4610 10.4610 10.5672 10.5672 11.8850 11.8850 12.2203 12.2203 13.6130 13.6130 k = 0.0000 0.1750-0.0000 ( 5046 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5800 -33.5800 -33.3029 -33.3029 -33.3020 -33.3020 -33.2810 -33.2810 -33.2806 -33.2806 -3.0572 -3.0572 -1.1506 -1.1506 2.6183 2.6183 4.6598 4.6598 5.0143 5.0143 5.0911 5.0911 5.2006 5.2006 5.3056 5.3056 5.6392 5.6392 5.9673 5.9673 6.0492 6.0492 6.1864 6.1864 6.3702 6.3702 6.3997 6.3997 7.2482 7.2482 7.4995 7.4995 7.9097 7.9097 9.8134 9.8134 10.4778 10.4778 10.5358 10.5358 11.9552 11.9552 12.2747 12.2747 13.6114 13.6114 k = 0.0000 0.1875-0.0000 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5800 -33.5800 -33.3029 -33.3029 -33.3020 -33.3020 -33.2810 -33.2810 -33.2807 -33.2807 -3.0254 -3.0254 -1.1510 -1.1510 2.6588 2.6588 4.6095 4.6095 4.9833 4.9833 5.0453 5.0453 5.2087 5.2087 5.3127 5.3127 5.6428 5.6428 5.9581 5.9581 6.0417 6.0417 6.1903 6.1903 6.3542 6.3542 6.3773 6.3773 7.2880 7.2880 7.4807 7.4807 7.8046 7.8046 9.7986 9.7986 10.4359 10.4359 10.5733 10.5733 12.0242 12.0242 12.3324 12.3324 13.5959 13.5959 k = 0.0000 0.2000-0.0000 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5800 -33.5800 -33.3029 -33.3029 -33.3021 -33.3021 -33.2810 -33.2810 -33.2807 -33.2807 -2.9917 -2.9917 -1.1523 -1.1523 2.7020 2.7020 4.5452 4.5452 4.9487 4.9487 5.0171 5.0171 5.2175 5.2175 5.3213 5.3213 5.6463 5.6463 5.9493 5.9493 6.0338 6.0338 6.1938 6.1938 6.3310 6.3310 6.3616 6.3616 7.3276 7.3276 7.4525 7.4525 7.7025 7.7025 9.7819 9.7819 10.3937 10.3937 10.6221 10.6221 12.0911 12.0911 12.3934 12.3934 13.5676 13.5676 k = 0.0000 0.2125-0.0000 ( 5056 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2810 -33.2810 -33.2807 -33.2807 -2.9561 -2.9561 -1.1547 -1.1547 2.7478 2.7478 4.4709 4.4709 4.9120 4.9120 5.0016 5.0016 5.2268 5.2268 5.3308 5.3308 5.6498 5.6498 5.9407 5.9407 6.0254 6.0254 6.1969 6.1969 6.3040 6.3040 6.3490 6.3490 7.3604 7.3604 7.4223 7.4223 7.6038 7.6038 9.7630 9.7630 10.3605 10.3605 10.6730 10.6730 12.1552 12.1552 12.4575 12.4575 13.5276 13.5276 k = 0.0000 0.2250-0.0000 ( 5056 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2810 -33.2810 -33.2807 -33.2807 -2.9186 -2.9186 -1.1584 -1.1584 2.7962 2.7962 4.3915 4.3915 4.8733 4.8733 4.9945 4.9945 5.2368 5.2368 5.3411 5.3411 5.6533 5.6533 5.9324 5.9324 6.0165 6.0165 6.1994 6.1994 6.2759 6.2759 6.3373 6.3373 7.3455 7.3455 7.4315 7.4315 7.5093 7.5093 9.7419 9.7419 10.3371 10.3371 10.7254 10.7254 12.2159 12.2159 12.5246 12.5246 13.4772 13.4772 k = 0.0000 0.2375-0.0000 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2810 -33.2810 -33.2808 -33.2808 -2.8793 -2.8793 -1.1635 -1.1635 2.8471 2.8471 4.3103 4.3103 4.8326 4.8326 4.9928 4.9928 5.2474 5.2474 5.3521 5.3521 5.6567 5.6567 5.9243 5.9243 6.0073 6.0073 6.2010 6.2010 6.2475 6.2475 6.3256 6.3256 7.2928 7.2928 7.4158 7.4158 7.4745 7.4745 9.7185 9.7185 10.3235 10.3235 10.7790 10.7790 12.2727 12.2727 12.5946 12.5946 13.4180 13.4180 k = 0.0000 0.2500-0.0000 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2811 -33.2811 -33.2808 -33.2808 -2.8382 -2.8382 -1.1702 -1.1702 2.9005 2.9005 4.2300 4.2300 4.7896 4.7896 4.9945 4.9945 5.2586 5.2586 5.3636 5.3636 5.6599 5.6599 5.9164 5.9164 5.9976 5.9976 6.2006 6.2006 6.2199 6.2199 6.3141 6.3141 7.2292 7.2292 7.3300 7.3300 7.5195 7.5195 9.6928 9.6928 10.3192 10.3192 10.8337 10.8337 12.3252 12.3252 12.6673 12.6673 13.3513 13.3513 k = 0.0000 0.2625-0.0000 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2811 -33.2811 -33.2808 -33.2808 -2.7954 -2.7954 -1.1787 -1.1787 2.9562 2.9562 4.1521 4.1521 4.7443 4.7443 4.9981 4.9981 5.2703 5.2703 5.3756 5.3756 5.6629 5.6629 5.9086 5.9086 5.9875 5.9875 6.1865 6.1865 6.2049 6.2049 6.3027 6.3027 7.1588 7.1588 7.2481 7.2481 7.5676 7.5676 9.6646 9.6646 10.3237 10.3237 10.8895 10.8895 12.3732 12.3732 12.7425 12.7425 13.2782 13.2782 k = 0.0000 0.2750-0.0000 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3029 -33.3029 -33.3022 -33.3022 -33.2811 -33.2811 -33.2808 -33.2808 -2.7510 -2.7510 -1.1892 -1.1892 3.0143 3.0143 4.0778 4.0778 4.6970 4.6970 5.0028 5.0028 5.2826 5.2826 5.3880 5.3880 5.6657 5.6657 5.9010 5.9010 5.9770 5.9770 6.1590 6.1590 6.2019 6.2019 6.2917 6.2917 7.0836 7.0836 7.1711 7.1711 7.6175 7.6175 9.6339 9.6339 10.3364 10.3364 10.9463 10.9463 12.4164 12.4164 12.8201 12.8201 13.2000 13.2000 k = 0.0000 0.2875-0.0000 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3029 -33.3029 -33.3022 -33.3022 -33.2812 -33.2812 -33.2809 -33.2809 -2.7050 -2.7050 -1.2018 -1.2018 3.0745 3.0745 4.0078 4.0078 4.6477 4.6477 5.0075 5.0075 5.2955 5.2955 5.4008 5.4008 5.6682 5.6682 5.8934 5.8934 5.9661 5.9661 6.1305 6.1305 6.1980 6.1980 6.2813 6.2813 7.0053 7.0053 7.0990 7.0990 7.6689 7.6689 9.6008 9.6008 10.3566 10.3566 11.0039 11.0039 12.4546 12.4546 12.8997 12.8997 13.1178 13.1178 k = 0.0000 0.3000-0.0000 ( 5042 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3029 -33.3029 -33.3022 -33.3022 -33.2811 -33.2811 -33.2809 -33.2809 -2.6576 -2.6576 -1.2167 -1.2167 3.1368 3.1368 3.9428 3.9428 4.5969 4.5969 5.0117 5.0117 5.3089 5.3089 5.4139 5.4139 5.6703 5.6703 5.8860 5.8860 5.9547 5.9547 6.1022 6.1022 6.1923 6.1923 6.2714 6.2714 6.9257 6.9257 7.0318 7.0318 7.7218 7.7218 9.5650 9.5650 10.3835 10.3835 11.0624 11.0624 12.4876 12.4876 12.9801 12.9801 13.0334 13.0334 k = 0.0000 0.3125-0.0000 ( 5042 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3028 -33.3028 -33.3022 -33.3022 -33.2812 -33.2812 -33.2809 -33.2809 -2.6087 -2.6087 -1.2340 -1.2340 3.2010 3.2010 3.8831 3.8831 4.5448 4.5448 5.0146 5.0146 5.3229 5.3229 5.4272 5.4272 5.6721 5.6721 5.8787 5.8787 5.9428 5.9428 6.0741 6.0741 6.1844 6.1844 6.2620 6.2620 6.8467 6.8467 6.9695 6.9695 7.7760 7.7760 9.5267 9.5267 10.4168 10.4168 11.1215 11.1215 12.5151 12.5151 12.9430 12.9430 13.0657 13.0657 k = 0.0000 0.3250-0.0000 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3028 -33.3028 -33.3022 -33.3022 -33.2812 -33.2812 -33.2809 -33.2809 -2.5586 -2.5586 -1.2539 -1.2539 3.2668 3.2668 3.8293 3.8293 4.4919 4.4919 5.0156 5.0156 5.3374 5.3374 5.4406 5.4406 5.6733 5.6733 5.8716 5.8716 5.9301 5.9301 6.0465 6.0465 6.1745 6.1745 6.2524 6.2524 6.7703 6.7703 6.9118 6.9118 7.8316 7.8316 9.4858 9.4858 10.4556 10.4556 11.1810 11.1810 12.5368 12.5368 12.8538 12.8538 13.1500 13.1500 k = 0.0000 0.3375-0.0000 ( 5042 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5803 -33.5803 -33.3028 -33.3028 -33.3023 -33.3023 -33.2812 -33.2812 -33.2810 -33.2810 -2.5073 -2.5073 -1.2763 -1.2763 3.3340 3.3340 3.7815 3.7815 4.4388 4.4388 5.0138 5.0138 5.3525 5.3525 5.4541 5.4541 5.6741 5.6741 5.8645 5.8645 5.9165 5.9165 6.0199 6.0199 6.1629 6.1629 6.2417 6.2417 6.6986 6.6986 6.8587 6.8587 7.8884 7.8884 9.4424 9.4424 10.4996 10.4996 11.2406 11.2406 12.5526 12.5526 12.7637 12.7637 13.2355 13.2355 k = 0.0000 0.3500-0.0000 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5803 -33.5803 -33.3028 -33.3028 -33.3023 -33.3023 -33.2812 -33.2812 -33.2810 -33.2810 -2.4550 -2.4550 -1.3015 -1.3015 3.4021 3.4021 3.7399 3.7399 4.3860 4.3860 5.0085 5.0085 5.3680 5.3680 5.4676 5.4676 5.6743 5.6743 5.8577 5.8577 5.9014 5.9014 5.9946 5.9946 6.1501 6.1501 6.2287 6.2287 6.6338 6.6338 6.8098 6.8098 7.9464 7.9464 9.3966 9.3966 10.5483 10.5483 11.2998 11.2998 12.5616 12.5616 12.6741 12.6741 13.3216 13.3216 k = 0.0000 0.3625-0.0000 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5803 -33.5803 -33.3028 -33.3028 -33.3023 -33.3023 -33.2812 -33.2812 -33.2811 -33.2811 -2.4017 -2.4017 -1.3293 -1.3293 3.4705 3.4705 3.7049 3.7049 4.3344 4.3344 4.9988 4.9988 5.3840 5.3840 5.4810 5.4810 5.6738 5.6738 5.8510 5.8510 5.8844 5.8844 5.9713 5.9713 6.1365 6.1365 6.2124 6.2124 6.5782 6.5782 6.7651 6.7651 8.0055 8.0055 9.3483 9.3483 10.6013 10.6013 11.3580 11.3580 12.5582 12.5582 12.5916 12.5916 13.4077 13.4077 k = 0.0000 0.3750-0.0000 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5804 -33.5804 -33.3028 -33.3028 -33.3024 -33.3024 -33.2812 -33.2812 -33.2811 -33.2811 -2.3476 -2.3476 -1.3599 -1.3599 3.5376 3.5376 3.6769 3.6769 4.2853 4.2853 4.9837 4.9837 5.4005 5.4005 5.4941 5.4941 5.6727 5.6727 5.8445 5.8445 5.8651 5.8651 5.9507 5.9507 6.1225 6.1225 6.1922 6.1922 6.5334 6.5334 6.7243 6.7243 8.0657 8.0657 9.2978 9.2978 10.6581 10.6581 11.4144 11.4144 12.4918 12.4918 12.5679 12.5679 13.4933 13.4933 k = 0.0000 0.3875-0.0000 ( 5058 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5804 -33.5804 -33.3028 -33.3028 -33.3024 -33.3024 -33.2813 -33.2813 -33.2811 -33.2811 -2.2928 -2.2928 -1.3932 -1.3932 3.5991 3.5991 3.6590 3.6590 4.2403 4.2403 4.9625 4.9625 5.4173 5.4173 5.5069 5.5069 5.6710 5.6710 5.8365 5.8365 5.8453 5.8453 5.9330 5.9330 6.1084 6.1084 6.1686 6.1686 6.4998 6.4998 6.6872 6.6872 8.1268 8.1268 9.2451 9.2451 10.7184 10.7184 11.4676 11.4676 12.4092 12.4092 12.5576 12.5576 13.5776 13.5776 k = 0.0000 0.4000-0.0000 ( 5056 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5804 -33.5804 -33.3027 -33.3027 -33.3024 -33.3024 -33.2812 -33.2812 -33.2811 -33.2811 -2.2374 -2.2374 -1.4291 -1.4291 3.6247 3.6247 3.6789 3.6789 4.2021 4.2021 4.9343 4.9343 5.4346 5.4346 5.5193 5.5193 5.6687 5.6687 5.8167 5.8167 5.8359 5.8359 5.9179 5.9179 6.0946 6.0946 6.1430 6.1430 6.4765 6.4765 6.6535 6.6535 8.1888 8.1888 9.1904 9.1904 10.7820 10.7820 11.5156 11.5156 12.3312 12.3312 12.5422 12.5422 13.6597 13.6597 k = 0.0000 0.4125-0.0000 ( 5058 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5804 -33.5804 -33.3027 -33.3027 -33.3024 -33.3024 -33.2813 -33.2813 -33.2812 -33.2812 -2.1817 -2.1817 -1.4676 -1.4676 3.6195 3.6195 3.7272 3.7272 4.1750 4.1750 4.8985 4.8985 5.4521 5.4521 5.5310 5.5310 5.6658 5.6658 5.7920 5.7920 5.8313 5.8313 5.9050 5.9050 6.0814 6.0814 6.1174 6.1174 6.4618 6.4618 6.6230 6.6230 8.2516 8.2516 9.1339 9.1339 10.8484 10.8484 11.5553 11.5553 12.2619 12.2619 12.5211 12.5211 13.7385 13.7385 k = 0.0000 0.4250-0.0000 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3027 -33.3027 -33.3025 -33.3025 -33.2812 -33.2812 -33.2812 -33.2812 -2.1258 -2.1258 -1.5085 -1.5085 3.6162 3.6162 3.7653 3.7653 4.1652 4.1652 4.8552 4.8552 5.4698 5.4698 5.5420 5.5420 5.6626 5.6626 5.7669 5.7669 5.8283 5.8283 5.8936 5.8936 6.0690 6.0690 6.0939 6.0939 6.4538 6.4538 6.5955 6.5955 8.3150 8.3150 9.0757 9.0757 10.9173 10.9173 11.5821 11.5821 12.2058 12.2058 12.4945 12.4945 13.8129 13.8129 k = 0.0000 0.4375-0.0000 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3027 -33.3027 -33.3025 -33.3025 -33.2813 -33.2813 -33.2812 -33.2812 -2.0699 -2.0699 -1.5517 -1.5517 3.6178 3.6178 3.7842 3.7842 4.1783 4.1783 4.8046 4.8046 5.4876 5.4876 5.5519 5.5519 5.6591 5.6591 5.7426 5.7426 5.8267 5.8267 5.8833 5.8833 6.0578 6.0578 6.0735 6.0735 6.4508 6.4508 6.5707 6.5707 8.3790 8.3790 9.0160 9.0160 10.9884 10.9884 11.5907 11.5907 12.1684 12.1684 12.4630 12.4630 13.8817 13.8817 k = 0.0000 0.4500-0.0000 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3027 -33.3027 -33.3025 -33.3025 -33.2813 -33.2813 -33.2812 -33.2812 -2.0141 -2.0141 -1.5971 -1.5971 3.6246 3.6246 3.7833 3.7833 4.2145 4.2145 4.7472 4.7472 5.5052 5.5052 5.5604 5.5604 5.6556 5.6556 5.7197 5.7197 5.8267 5.8267 5.8738 5.8738 6.0479 6.0479 6.0569 6.0569 6.4517 6.4517 6.5485 6.5485 8.4433 8.4433 8.9551 8.9551 11.0613 11.0613 11.5772 11.5772 12.1535 12.1535 12.4271 12.4271 13.9437 13.9437 k = 0.0000 0.4625-0.0000 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3027 -33.3027 -33.3025 -33.3025 -33.2813 -33.2813 -33.2812 -33.2812 -1.9586 -1.9586 -1.6444 -1.6444 3.6363 3.6363 3.7684 3.7684 4.2680 4.2680 4.6842 4.6842 5.5224 5.5224 5.5669 5.5669 5.6526 5.6526 5.6990 5.6990 5.8282 5.8282 5.8648 5.8648 6.0398 6.0398 6.0443 6.0443 6.4557 6.4557 6.5287 6.5287 8.5080 8.5080 8.8930 8.8930 11.1354 11.1354 11.5421 11.5421 12.1603 12.1603 12.3876 12.3876 13.9978 13.9978 k = 0.0000 0.4750-0.0000 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3027 -33.3027 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.9037 -1.9037 -1.6936 -1.6936 3.6524 3.6524 3.7460 3.7460 4.3321 4.3321 4.6167 4.6167 5.5385 5.5385 5.5704 5.5704 5.6510 5.6510 5.6811 5.6811 5.8314 5.8314 5.8565 5.8565 6.0336 6.0336 6.0356 6.0356 6.4624 6.4624 6.5112 6.5112 8.5728 8.5728 8.8301 8.8301 11.2102 11.2102 11.4902 11.4902 12.1840 12.1840 12.3455 12.3455 14.0435 14.0435 k = 0.0000 0.4875-0.0000 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.8495 -1.8495 -1.7442 -1.7442 3.6725 3.6725 3.7207 3.7207 4.4018 4.4018 4.5461 4.5461 5.5526 5.5526 5.5694 5.5694 5.6521 5.6521 5.6670 5.6670 5.8360 5.8360 5.8488 5.8488 6.0298 6.0298 6.0305 6.0305 6.4714 6.4714 6.4958 6.4958 8.6376 8.6376 8.7664 8.7664 11.2848 11.2848 11.4273 11.4273 12.2185 12.2185 12.3020 12.3020 14.0806 14.0806 k = 0.0000 0.5000-0.0000 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7963 -1.7963 -1.7963 -1.7963 3.6957 3.6957 3.6957 3.6957 4.4739 4.4739 4.4739 4.4739 5.5634 5.5634 5.5634 5.5634 5.6572 5.6572 5.6572 5.6572 5.8419 5.8419 5.8419 5.8419 6.0287 6.0287 6.0287 6.0287 6.4825 6.4825 6.4825 6.4825 8.7021 8.7021 8.7021 8.7021 11.3578 11.3578 11.3578 11.3578 12.2589 12.2589 12.2589 12.2589 14.1099 14.1099 k = 0.0000 0.5000-0.0000 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7963 -1.7963 -1.7963 -1.7963 3.6957 3.6957 3.6957 3.6957 4.4739 4.4739 4.4739 4.4739 5.5634 5.5634 5.5634 5.5634 5.6572 5.6572 5.6572 5.6572 5.8419 5.8419 5.8419 5.8419 6.0287 6.0287 6.0287 6.0287 6.4825 6.4825 6.4825 6.4825 8.7021 8.7021 8.7021 8.7021 11.3578 11.3578 11.3578 11.3578 12.2589 12.2589 12.2589 12.2589 14.1099 14.1099 k = 0.0125 0.5000-0.0000 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7956 -1.7956 -1.7955 -1.7955 3.6958 3.6958 3.6962 3.6962 4.4745 4.4745 4.4751 4.4751 5.5623 5.5623 5.5636 5.5636 5.6490 5.6490 5.6648 5.6648 5.8350 5.8350 5.8481 5.8481 6.0293 6.0293 6.0298 6.0298 6.4826 6.4826 6.4827 6.4827 8.6910 8.6910 8.6941 8.6941 11.3559 11.3559 11.3692 11.3692 12.2569 12.2569 12.2655 12.2655 14.0866 14.0866 k = 0.0250 0.5000-0.0000 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7933 -1.7933 -1.7932 -1.7932 3.6965 3.6965 3.6973 3.6973 4.4769 4.4769 4.4783 4.4783 5.5604 5.5604 5.5626 5.5626 5.6407 5.6407 5.6714 5.6714 5.8277 5.8277 5.8536 5.8536 6.0317 6.0317 6.0327 6.0327 6.4828 6.4828 6.4830 6.4830 8.6613 8.6613 8.6674 8.6674 11.3623 11.3623 11.3887 11.3887 12.2604 12.2604 12.2776 12.2776 14.0226 14.0226 k = 0.0375 0.5000-0.0000 ( 5078 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7895 -1.7895 -1.7894 -1.7894 3.6977 3.6977 3.6990 3.6990 4.4811 4.4811 4.4832 4.4832 5.5579 5.5579 5.5602 5.5602 5.6328 5.6328 5.6771 5.6771 5.8202 5.8202 5.8580 5.8580 6.0356 6.0356 6.0374 6.0374 6.4832 6.4832 6.4835 6.4835 8.6147 8.6147 8.6235 8.6235 11.3730 11.3730 11.4118 11.4118 12.2725 12.2725 12.2980 12.2980 13.9256 13.9256 k = 0.0500 0.5000-0.0000 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7843 -1.7843 -1.7841 -1.7841 3.6995 3.6995 3.7012 3.7012 4.4872 4.4872 4.4899 4.4899 5.5546 5.5546 5.5556 5.5556 5.6260 5.6260 5.6818 5.6818 5.8127 5.8127 5.8613 5.8613 6.0410 6.0410 6.0439 6.0439 6.4839 6.4839 6.4841 6.4841 8.5535 8.5535 8.5646 8.5646 11.3823 11.3823 11.4318 11.4318 12.2978 12.2978 12.3305 12.3305 13.8044 13.8044 k = 0.0625 0.5000-0.0000 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7775 -1.7775 -1.7773 -1.7773 3.7018 3.7018 3.7040 3.7040 4.4950 4.4950 4.4985 4.4985 5.5485 5.5485 5.5505 5.5505 5.6210 5.6210 5.6856 5.6856 5.8052 5.8052 5.8635 5.8635 6.0478 6.0478 6.0520 6.0520 6.4847 6.4847 6.4850 6.4850 8.4803 8.4803 8.4933 8.4933 11.3839 11.3839 11.4416 11.4416 12.3411 12.3411 12.3793 12.3793 13.6662 13.6662 k = 0.0750 0.5000-0.0000 ( 5078 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7693 -1.7693 -1.7690 -1.7690 3.7045 3.7045 3.7071 3.7071 4.5044 4.5044 4.5087 4.5087 5.5389 5.5389 5.5456 5.5456 5.6179 5.6179 5.6886 5.6886 5.7977 5.7977 5.8644 5.8644 6.0559 6.0559 6.0615 6.0615 6.4857 6.4857 6.4860 6.4860 8.3978 8.3978 8.4123 8.4123 11.3729 11.3729 11.4355 11.4355 12.4054 12.4054 12.4470 12.4470 13.5169 13.5169 k = 0.0875 0.5000-0.0000 ( 5078 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7597 -1.7597 -1.7594 -1.7594 3.7075 3.7075 3.7106 3.7106 4.5155 4.5155 4.5205 4.5205 5.5270 5.5270 5.5399 5.5399 5.6166 5.6166 5.6913 5.6913 5.7902 5.7902 5.8644 5.8644 6.0651 6.0651 6.0723 6.0723 6.4869 6.4869 6.4872 6.4872 8.3085 8.3085 8.3242 8.3242 11.3467 11.3467 11.4112 11.4112 12.4901 12.4901 12.5337 12.5337 13.3612 13.3612 k = 0.1000 0.5000-0.0000 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7486 -1.7486 -1.7483 -1.7483 3.7108 3.7108 3.7143 3.7143 4.5281 4.5281 4.5339 4.5339 5.5134 5.5134 5.5332 5.5332 5.6166 5.6166 5.6936 5.6936 5.7828 5.7828 5.8635 5.8635 6.0753 6.0753 6.0841 6.0841 6.4883 6.4883 6.4885 6.4885 8.2145 8.2145 8.2313 8.2313 11.3052 11.3052 11.3695 11.3695 12.5894 12.5894 12.6358 12.6358 13.2039 13.2039 k = 0.1125 0.5000-0.0000 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.7362 -1.7362 -1.7358 -1.7358 3.7140 3.7140 3.7181 3.7181 4.5421 4.5421 4.5487 4.5487 5.4986 5.4986 5.5256 5.5256 5.6176 5.6176 5.6959 5.6959 5.7755 5.7755 5.8618 5.8618 6.0863 6.0863 6.0967 6.0967 6.4900 6.4900 6.4900 6.4900 8.1178 8.1178 8.1354 8.1354 11.2497 11.2497 11.3124 11.3124 12.6854 12.6854 12.7406 12.7406 13.0571 13.0571 k = 0.1250 0.5000-0.0000 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.7225 -1.7225 -1.7221 -1.7221 3.7173 3.7173 3.7218 3.7218 4.5574 4.5574 4.5649 4.5649 5.4829 5.4829 5.5173 5.5173 5.6193 5.6193 5.6980 5.6980 5.7685 5.7685 5.8597 5.8597 6.0981 6.0981 6.1099 6.1099 6.4916 6.4916 6.4918 6.4918 8.0200 8.0200 8.0382 8.0382 11.1823 11.1823 11.2429 11.2429 12.7143 12.7143 12.7706 12.7706 12.9966 12.9966 k = 0.1375 0.5000-0.0000 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.7076 -1.7076 -1.7071 -1.7071 3.7203 3.7203 3.7254 3.7254 4.5738 4.5738 4.5821 4.5821 5.4667 5.4667 5.5082 5.5082 5.6214 5.6214 5.6996 5.6996 5.7623 5.7623 5.8573 5.8573 6.1105 6.1105 6.1235 6.1235 6.4934 6.4934 6.4939 6.4939 7.9225 7.9225 7.9412 7.9412 11.1050 11.1050 11.1634 11.1634 12.6190 12.6190 12.6496 12.6496 13.0970 13.0970 k = 0.1500 0.5000-0.0000 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.6914 -1.6914 -1.6909 -1.6909 3.7229 3.7229 3.7285 3.7285 4.5911 4.5911 4.6004 4.6004 5.4503 5.4503 5.4985 5.4985 5.6237 5.6237 5.7002 5.7002 5.7577 5.7577 5.8550 5.8550 6.1233 6.1233 6.1374 6.1374 6.4953 6.4953 6.4962 6.4962 7.8263 7.8263 7.8455 7.8455 11.0198 11.0198 11.0759 11.0759 12.4727 12.4727 12.4915 12.4915 13.2424 13.2424 k = 0.1625 0.5000-0.0000 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5806 -33.5806 -33.3027 -33.3027 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.6741 -1.6741 -1.6735 -1.6735 3.7250 3.7250 3.7311 3.7311 4.6092 4.6092 4.6193 4.6193 5.4339 5.4339 5.4884 5.4884 5.6261 5.6261 5.6988 5.6988 5.7558 5.7558 5.8530 5.8530 6.1365 6.1365 6.1514 6.1514 6.4973 6.4973 6.4987 6.4987 7.7325 7.7325 7.7520 7.7520 10.9282 10.9282 10.9823 10.9823 12.3138 12.3138 12.3274 12.3274 13.4002 13.4002 k = 0.1750 0.5000-0.0000 ( 5076 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2815 -33.2815 -33.2815 -33.2815 -1.6557 -1.6557 -1.6551 -1.6551 3.7263 3.7263 3.7329 3.7329 4.6278 4.6278 4.6388 4.6388 5.4178 5.4178 5.4780 5.4780 5.6285 5.6285 5.6950 5.6950 5.7575 5.7575 5.8516 5.8516 6.1498 6.1498 6.1654 6.1654 6.4995 6.4995 6.5014 6.5014 7.6418 7.6418 7.6617 7.6617 10.8317 10.8317 10.8839 10.8839 12.1516 12.1516 12.1623 12.1623 13.5637 13.5637 k = 0.1875 0.5000-0.0000 ( 5076 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2815 -33.2815 -33.2815 -33.2815 -1.6364 -1.6364 -1.6357 -1.6357 3.7266 3.7266 3.7338 3.7338 4.6467 4.6467 4.6585 4.6585 5.4022 5.4022 5.4674 5.4674 5.6307 5.6307 5.6889 5.6889 5.7626 5.7626 5.8512 5.8512 6.1632 6.1632 6.1792 6.1792 6.5018 6.5018 6.5044 6.5044 7.5548 7.5548 7.5750 7.5750 10.7314 10.7314 10.7819 10.7819 11.9890 11.9890 11.9980 11.9980 13.7299 13.7299 k = 0.2000 0.5000-0.0000 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2815 -33.2815 -33.2815 -33.2815 -1.6161 -1.6161 -1.6154 -1.6154 3.7257 3.7257 3.7334 3.7334 4.6655 4.6655 4.6781 4.6781 5.3873 5.3873 5.4568 5.4568 5.6327 5.6327 5.6817 5.6817 5.7706 5.7706 5.8522 5.8522 6.1766 6.1766 6.1929 6.1929 6.5042 6.5042 6.5075 6.5075 7.4719 7.4719 7.4924 7.4924 10.6284 10.6284 10.6773 10.6773 11.8275 11.8275 11.8354 11.8354 13.8964 13.8964 k = 0.2125 0.5000-0.0000 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2815 -33.2815 -33.2815 -33.2815 -1.5950 -1.5950 -1.5943 -1.5943 3.7234 3.7234 3.7316 3.7316 4.6841 4.6841 4.6972 4.6972 5.3734 5.3734 5.4464 5.4464 5.6344 5.6344 5.6743 5.6743 5.7809 5.7809 5.8548 5.8548 6.1899 6.1899 6.2062 6.2062 6.5068 6.5068 6.5109 6.5109 7.3937 7.3937 7.4145 7.4145 10.5235 10.5235 10.5709 10.5709 11.6679 11.6679 11.6749 11.6749 14.0616 14.0616 k = 0.2250 0.5000-0.0000 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2815 -33.2815 -33.2815 -33.2815 -1.5732 -1.5732 -1.5725 -1.5725 3.7195 3.7195 3.7282 3.7282 4.7020 4.7020 4.7155 4.7155 5.3608 5.3608 5.4362 5.4362 5.6361 5.6361 5.6675 5.6675 5.7932 5.7932 5.8592 5.8592 6.2030 6.2030 6.2191 6.2191 6.5094 6.5094 6.5146 6.5146 7.3202 7.3202 7.3412 7.3412 10.4174 10.4174 10.4635 10.4635 11.5106 11.5106 11.5171 11.5171 14.2237 14.2237 k = 0.2375 0.5000-0.0000 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.5508 -1.5508 -1.5501 -1.5501 3.7138 3.7138 3.7230 3.7230 4.7190 4.7190 4.7327 4.7327 5.3498 5.3498 5.4263 5.4263 5.6380 5.6380 5.6619 5.6619 5.8073 5.8073 5.8657 5.8657 6.2159 6.2159 6.2316 6.2316 6.5122 6.5122 6.5184 6.5184 7.2516 7.2516 7.2729 7.2729 10.3109 10.3109 10.3557 10.3557 11.3562 11.3562 11.3622 11.3622 14.3814 14.3814 k = 0.2500 0.5000-0.0000 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.5279 -1.5279 -1.5272 -1.5272 3.7063 3.7063 3.7158 3.7158 4.7349 4.7349 4.7483 4.7483 5.3405 5.3405 5.4168 5.4168 5.6403 5.6403 5.6583 5.6583 5.8229 5.8229 5.8744 5.8744 6.2283 6.2283 6.2435 6.2435 6.5151 6.5151 6.5224 6.5224 7.1880 7.1880 7.2096 7.2096 10.2046 10.2046 10.2482 10.2482 11.2050 11.2050 11.2106 11.2106 14.5335 14.5335 k = 0.2625 0.5000-0.0000 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.5047 -1.5047 -1.5040 -1.5040 3.6967 3.6967 3.7065 3.7065 4.7493 4.7493 4.7621 4.7621 5.3330 5.3330 5.4076 5.4076 5.6436 5.6436 5.6573 5.6573 5.8401 5.8401 5.8852 5.8852 6.2402 6.2402 6.2547 6.2547 6.5181 6.5181 6.5267 6.5267 7.1292 7.1292 7.1511 7.1511 10.0990 10.0990 10.1415 10.1415 11.0573 11.0573 11.0626 11.0626 14.6789 14.6789 k = 0.2750 0.5000-0.0000 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.4812 -1.4812 -1.4805 -1.4805 3.6851 3.6851 3.6950 3.6950 4.7621 4.7621 4.7740 4.7740 5.3273 5.3273 5.3987 5.3987 5.6484 5.6484 5.6593 5.6593 5.8588 5.8588 5.8980 5.8980 6.2516 6.2516 6.2653 6.2653 6.5211 6.5211 6.5310 6.5310 7.0753 7.0753 7.0975 7.0975 9.9947 9.9947 10.0361 10.0361 10.9134 10.9134 10.9185 10.9185 14.8170 14.8170 k = 0.2875 0.5000-0.0000 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.4577 -1.4577 -1.4569 -1.4569 3.6714 3.6714 3.6815 3.6815 4.7733 4.7733 4.7838 4.7838 5.3231 5.3231 5.3901 5.3901 5.6551 5.6551 5.6647 5.6647 5.8788 5.8788 5.9128 5.9128 6.2624 6.2624 6.2751 6.2751 6.5243 6.5243 6.5354 6.5354 7.0260 7.0260 7.0485 7.0485 9.8921 9.8921 9.9324 9.9324 10.7737 10.7737 10.7786 10.7786 14.9476 14.9476 k = 0.3000 0.5000-0.0000 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.4342 -1.4342 -1.4334 -1.4334 3.6558 3.6558 3.6658 3.6658 4.7828 4.7828 4.7918 4.7918 5.3203 5.3203 5.3817 5.3817 5.6643 5.6643 5.6736 5.6736 5.9001 5.9001 5.9293 5.9293 6.2725 6.2725 6.2841 6.2841 6.5276 6.5276 6.5399 6.5399 6.9810 6.9810 7.0039 7.0039 9.7918 9.7918 9.8310 9.8310 10.6385 10.6385 10.6432 10.6432 15.0706 15.0706 k = 0.3125 0.5000-0.0000 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.4109 -1.4109 -1.4101 -1.4101 3.6384 3.6384 3.6483 3.6483 4.7907 4.7907 4.7979 4.7979 5.3184 5.3184 5.3735 5.3735 5.6762 5.6762 5.6861 5.6861 5.9225 5.9225 5.9475 5.9475 6.2817 6.2817 6.2922 6.2922 6.5309 6.5309 6.5444 6.5444 6.9403 6.9403 6.9636 6.9636 9.6942 9.6942 9.7322 9.7322 10.5081 10.5081 10.5126 10.5126 15.1866 15.1866 k = 0.3250 0.5000-0.0000 ( 5054 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3880 -1.3880 -1.3872 -1.3872 3.6194 3.6194 3.6291 3.6291 4.7972 4.7972 4.8026 4.8026 5.3170 5.3170 5.3656 5.3656 5.6911 5.6911 5.7021 5.7021 5.9459 5.9459 5.9670 5.9670 6.2900 6.2900 6.2993 6.2993 6.5343 6.5343 6.5487 6.5487 6.9036 6.9036 6.9273 6.9273 9.5997 9.5997 9.6365 9.6365 10.3829 10.3829 10.3873 10.3873 15.2959 15.2959 k = 0.3375 0.5000-0.0000 ( 5050 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3656 -1.3656 -1.3649 -1.3649 3.5992 3.5992 3.6085 3.6085 4.8024 4.8024 4.8060 4.8060 5.3158 5.3158 5.3580 5.3580 5.7089 5.7089 5.7212 5.7212 5.9702 5.9702 5.9878 5.9878 6.2973 6.2973 6.3055 6.3055 6.5377 6.5377 6.5527 6.5527 6.8706 6.8706 6.8949 6.8949 9.5089 9.5089 9.5444 9.5444 10.2632 10.2632 10.2675 10.2675 15.3995 15.3995 k = 0.3500 0.5000-0.0000 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3440 -1.3440 -1.3433 -1.3433 3.5781 3.5781 3.5870 3.5870 4.8065 4.8065 4.8085 4.8085 5.3146 5.3146 5.3506 5.3506 5.7294 5.7294 5.7429 5.7429 5.9951 5.9951 6.0094 6.0094 6.3034 6.3034 6.3105 6.3105 6.5410 6.5410 6.5562 6.5562 6.8413 6.8413 6.8661 6.8661 9.4221 9.4221 9.4562 9.4562 10.1495 10.1495 10.1536 10.1536 15.4978 15.4978 k = 0.3625 0.5000-0.0000 ( 5054 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3232 -1.3232 -1.3225 -1.3225 3.5565 3.5565 3.5649 3.5649 4.8097 4.8097 4.8104 4.8104 5.3132 5.3132 5.3436 5.3436 5.7523 5.7523 5.7667 5.7667 6.0203 6.0203 6.0318 6.0318 6.3084 6.3084 6.3145 6.3145 6.5442 6.5442 6.5592 6.5592 6.8154 6.8154 6.8408 6.8408 9.3399 9.3399 9.3725 9.3725 10.0422 10.0422 10.0461 10.0461 15.5916 15.5916 k = 0.3750 0.5000-0.0000 ( 5058 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.3035 -1.3035 -1.3029 -1.3029 3.5348 3.5348 3.5426 3.5426 4.8118 4.8118 4.8123 4.8123 5.3117 5.3117 5.3370 5.3370 5.7770 5.7770 5.7920 5.7920 6.0456 6.0456 6.0545 6.0545 6.3122 6.3122 6.3173 6.3173 6.5471 6.5471 6.5614 6.5614 6.7929 6.7929 6.8189 6.8189 9.2627 9.2627 9.2936 9.2936 9.9417 9.9417 9.9455 9.9455 15.6816 15.6816 k = 0.3875 0.5000-0.0000 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2850 -1.2850 -1.2844 -1.2844 3.5136 3.5136 3.5207 3.5207 4.8130 4.8130 4.8143 4.8143 5.3099 5.3099 5.3308 5.3308 5.8029 5.8029 5.8181 5.8181 6.0706 6.0706 6.0773 6.0773 6.3145 6.3145 6.3190 6.3190 6.5496 6.5496 6.5627 6.5627 6.7738 6.7738 6.8002 6.8002 9.1911 9.1911 9.2200 9.2200 9.8486 9.8486 9.8521 9.8521 15.7681 15.7681 k = 0.4000 0.5000-0.0000 ( 5068 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3028 -33.3028 -33.2818 -33.2818 -33.2818 -33.2818 -1.2679 -1.2679 -1.2674 -1.2674 3.4931 3.4931 3.4996 3.4996 4.8140 4.8140 4.8158 4.8158 5.3081 5.3081 5.3251 5.3251 5.8294 5.8294 5.8444 5.8444 6.0951 6.0951 6.0998 6.0998 6.3156 6.3156 6.3194 6.3194 6.5515 6.5515 6.5629 6.5629 6.7579 6.7579 6.7846 6.7846 9.1254 9.1254 9.1522 9.1522 9.7633 9.7633 9.7666 9.7666 15.8515 15.8515 k = 0.4125 0.5000-0.0000 ( 5076 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2818 -33.2818 -33.2818 -33.2818 -1.2524 -1.2524 -1.2519 -1.2519 3.4740 3.4740 3.4797 3.4797 4.8148 4.8148 4.8170 4.8170 5.3062 5.3062 5.3200 5.3200 5.8556 5.8556 5.8700 5.8700 6.1185 6.1185 6.1217 6.1217 6.3153 6.3153 6.3186 6.3186 6.5526 6.5526 6.5620 6.5620 6.7454 6.7454 6.7718 6.7718 9.0662 9.0662 9.0907 9.0907 9.6863 9.6863 9.6894 9.6894 15.9319 15.9319 k = 0.4250 0.5000-0.0000 ( 5080 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2386 -1.2386 -1.2382 -1.2382 3.4565 3.4565 3.4614 3.4614 4.8157 4.8157 4.8180 4.8180 5.3045 5.3045 5.3155 5.3155 5.8809 5.8809 5.8943 5.8943 6.1406 6.1406 6.1425 6.1425 6.3137 6.3137 6.3167 6.3167 6.5529 6.5529 6.5602 6.5602 6.7361 6.7361 6.7615 6.7615 9.0141 9.0141 9.0358 9.0358 9.6183 9.6183 9.6211 9.6211 16.0095 16.0095 k = 0.4375 0.5000-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2267 -1.2267 -1.2263 -1.2263 3.4412 3.4412 3.4453 3.4453 4.8164 4.8164 4.8186 4.8186 5.3029 5.3029 5.3115 5.3115 5.9044 5.9044 5.9165 5.9165 6.1609 6.1609 6.1619 6.1619 6.3110 6.3110 6.3136 6.3136 6.5523 6.5523 6.5576 6.5576 6.7299 6.7299 6.7533 6.7533 8.9693 8.9693 8.9881 8.9881 9.5597 9.5597 9.5621 9.5621 16.0841 16.0841 k = 0.4500 0.5000-0.0000 ( 5094 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2167 -1.2167 -1.2164 -1.2164 3.4282 3.4282 3.4315 3.4315 4.8172 4.8172 4.8191 4.8191 5.3016 5.3016 5.3081 5.3081 5.9255 5.9255 5.9358 5.9358 6.1791 6.1791 6.1795 6.1795 6.3074 6.3074 6.3097 6.3097 6.5511 6.5511 6.5547 6.5547 6.7264 6.7264 6.7468 6.7468 8.9325 8.9325 8.9479 8.9479 9.5110 9.5110 9.5131 9.5131 16.1553 16.1553 k = 0.4625 0.5000-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2088 -1.2088 -1.2086 -1.2086 3.4179 3.4179 3.4203 3.4203 4.8178 4.8178 4.8194 4.8194 5.3007 5.3007 5.3053 5.3053 5.9433 5.9433 5.9515 5.9515 6.1946 6.1946 6.1946 6.1946 6.3033 6.3033 6.3052 6.3052 6.5495 6.5495 6.5519 6.5519 6.7252 6.7252 6.7415 6.7415 8.9039 8.9039 8.9157 8.9157 9.4727 9.4727 9.4743 9.4743 16.2223 16.2223 k = 0.4750 0.5000-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2031 -1.2031 -1.2030 -1.2030 3.4104 3.4104 3.4121 3.4121 4.8184 4.8184 4.8195 4.8195 5.3001 5.3001 5.3031 5.3031 5.9571 5.9571 5.9628 5.9628 6.2065 6.2065 6.2067 6.2067 6.2994 6.2994 6.3008 6.3008 6.5481 6.5481 6.5494 6.5494 6.7257 6.7257 6.7371 6.7371 8.8838 8.8838 8.8919 8.8919 9.4451 9.4451 9.4462 9.4462 16.2837 16.2837 k = 0.4875 0.5000-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1997 -1.1997 -1.1996 -1.1996 3.4061 3.4061 3.4069 3.4069 4.8189 4.8189 4.8194 4.8194 5.3001 5.3001 5.3016 5.3016 5.9663 5.9663 5.9692 5.9692 6.2145 6.2145 6.2146 6.2146 6.2965 6.2965 6.2973 6.2973 6.5471 6.5471 6.5477 6.5477 6.7275 6.7275 6.7334 6.7334 8.8726 8.8726 8.8766 8.8766 9.4286 9.4286 9.4291 9.4291 16.3360 16.3360 k = 0.5000 0.5000-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1985 -1.1985 -1.1985 -1.1985 3.4049 3.4049 3.4049 3.4049 4.8192 4.8192 4.8192 4.8192 5.3005 5.3005 5.3005 5.3005 5.9704 5.9704 5.9704 5.9704 6.2173 6.2173 6.2173 6.2173 6.2956 6.2956 6.2956 6.2956 6.5470 6.5470 6.5470 6.5470 6.7301 6.7301 6.7301 6.7301 8.8701 8.8701 8.8701 8.8701 9.4232 9.4232 9.4232 9.4232 16.3707 16.3707 k = 0.5000 0.5000-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1985 -1.1985 -1.1985 -1.1985 3.4049 3.4049 3.4049 3.4049 4.8192 4.8192 4.8192 4.8192 5.3005 5.3005 5.3005 5.3005 5.9704 5.9704 5.9704 5.9704 6.2173 6.2173 6.2173 6.2173 6.2956 6.2956 6.2956 6.2956 6.5470 6.5470 6.5470 6.5470 6.7301 6.7301 6.7301 6.7301 8.8701 8.8701 8.8701 8.8701 9.4232 9.4232 9.4232 9.4232 16.3707 16.3707 k = 0.4912 0.4912-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2010 -1.2010 -1.1983 -1.1983 3.4060 3.4060 3.4070 3.4070 4.8186 4.8186 4.8197 4.8197 5.3000 5.3000 5.3017 5.3017 5.9648 5.9648 5.9708 5.9708 6.2121 6.2121 6.2173 6.2173 6.2905 6.2905 6.3030 6.3030 6.5431 6.5431 6.5518 6.5518 6.7274 6.7274 6.7333 6.7333 8.8707 8.8707 8.8784 8.8784 9.4240 9.4240 9.4336 9.4336 16.3320 16.3320 k = 0.4825 0.4825-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2084 -1.2084 -1.1976 -1.1976 3.4100 3.4100 3.4124 3.4124 4.8171 4.8171 4.8207 4.8207 5.2993 5.2993 5.3040 5.3040 5.9502 5.9502 5.9710 5.9710 6.1984 6.1984 6.2169 6.2169 6.2755 6.2755 6.3227 6.3227 6.5316 6.5316 6.5656 6.5656 6.7254 6.7254 6.7371 6.7371 8.8741 8.8741 8.9012 8.9012 9.4262 9.4262 9.4641 9.4641 16.2641 16.2641 k = 0.4737 0.4737-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2207 -1.2207 -1.1965 -1.1965 3.4167 3.4167 3.4213 3.4213 4.8146 4.8146 4.8220 4.8220 5.2986 5.2986 5.3076 5.3076 5.9284 5.9284 5.9712 5.9712 6.1792 6.1792 6.2153 6.2153 6.2522 6.2522 6.3510 6.3510 6.5134 6.5134 6.5870 6.5870 6.7239 6.7239 6.7412 6.7412 8.8805 8.8805 8.9385 8.9385 9.4300 9.4300 9.5136 9.5136 16.1802 16.1802 k = 0.4649 0.4649-0.0000 ( 5081 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2377 -1.2377 -1.1949 -1.1949 3.4261 3.4261 3.4336 3.4336 4.8111 4.8111 4.8234 4.8234 5.2978 5.2978 5.3126 5.3126 5.9019 5.9019 5.9712 5.9712 6.1562 6.1562 6.2068 6.2068 6.2280 6.2280 6.3852 6.3852 6.4895 6.4895 6.6142 6.6142 6.7229 6.7229 6.7458 6.7458 8.8903 8.8903 8.9895 8.9895 9.4352 9.4352 9.5807 9.5807 16.0867 16.0867 k = 0.4561 0.4561-0.0000 ( 5085 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.2593 -1.2593 -1.1929 -1.1929 3.4381 3.4381 3.4490 3.4490 4.8067 4.8067 4.8241 4.8241 5.2973 5.2973 5.3191 5.3191 5.8725 5.8725 5.9704 5.9704 6.1304 6.1304 6.1763 6.1763 6.2201 6.2201 6.4237 6.4237 6.4612 6.4612 6.6457 6.6457 6.7223 6.7223 6.7509 6.7509 8.9041 8.9041 9.0532 9.0532 9.4420 9.4420 9.6635 9.6635 15.9862 15.9862 k = 0.4474 0.4474-0.0000 ( 5087 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3027 -33.3027 -33.2819 -33.2819 -33.2819 -33.2819 -1.2853 -1.2853 -1.1905 -1.1905 3.4529 3.4529 3.4674 3.4674 4.8012 4.8012 4.8233 4.8233 5.2974 5.2974 5.3268 5.3268 5.8414 5.8414 5.9679 5.9679 6.1016 6.1016 6.1382 6.1382 6.2176 6.2176 6.4296 6.4296 6.4655 6.4655 6.6799 6.6799 6.7222 6.7222 6.7571 6.7571 8.9220 8.9220 9.1284 9.1284 9.4503 9.4503 9.7604 9.7604 15.8800 15.8800 k = 0.4386 0.4386-0.0000 ( 5099 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.3154 -1.3154 -1.1878 -1.1878 3.4702 3.4702 3.4884 3.4884 4.7948 4.7948 4.8202 4.8202 5.2987 5.2987 5.3358 5.3358 5.8095 5.8095 5.9612 5.9612 6.0696 6.0696 6.1024 6.1024 6.2155 6.2155 6.3962 6.3962 6.5095 6.5095 6.7135 6.7135 6.7234 6.7234 6.7664 6.7664 8.9445 8.9445 9.2139 9.2139 9.4602 9.4602 9.8697 9.8697 15.7688 15.7688 k = 0.4298 0.4298-0.0000 ( 5091 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3027 -33.3027 -33.2819 -33.2819 -33.2818 -33.2818 -1.3494 -1.3494 -1.1847 -1.1847 3.4902 3.4902 3.5118 3.5118 4.7875 4.7875 4.8138 4.8138 5.3016 5.3016 5.3459 5.3459 5.7772 5.7772 5.9456 5.9456 6.0379 6.0379 6.0733 6.0733 6.2129 6.2129 6.3621 6.3621 6.5551 6.5551 6.7228 6.7228 6.7431 6.7431 6.7852 6.7852 8.9715 8.9715 9.3085 9.3085 9.4718 9.4718 9.9901 9.9901 15.6533 15.6533 k = 0.4211 0.4211-0.0000 ( 5077 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.3869 -1.3869 -1.1813 -1.1813 3.5128 3.5128 3.5373 3.5373 4.7792 4.7792 4.8029 4.8029 5.3066 5.3066 5.3571 5.3571 5.7451 5.7451 5.9160 5.9160 6.0120 6.0120 6.0518 6.0518 6.2091 6.2091 6.3289 6.3289 6.6013 6.6013 6.7253 6.7253 6.7585 6.7585 6.8194 6.8194 9.0031 9.0031 9.4105 9.4105 9.4858 9.4858 10.1202 10.1202 15.5338 15.5338 k = 0.4123 0.4123-0.0000 ( 5075 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.4277 -1.4277 -1.1776 -1.1776 3.5380 3.5380 3.5644 3.5644 4.7698 4.7698 4.7870 4.7870 5.3143 5.3143 5.3691 5.3691 5.7135 5.7135 5.8758 5.8758 5.9891 5.9891 6.0393 6.0393 6.2032 6.2032 6.2983 6.2983 6.6461 6.6461 6.7302 6.7302 6.7692 6.7692 6.8618 6.8618 9.0393 9.0393 9.4929 9.4929 9.5282 9.5282 10.2589 10.2589 15.4108 15.4108 k = 0.4035 0.4035-0.0000 ( 5069 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.4715 -1.4715 -1.1737 -1.1737 3.5657 3.5657 3.5928 3.5928 4.7574 4.7574 4.7675 4.7675 5.3247 5.3247 5.3817 5.3817 5.6828 5.6828 5.8318 5.8318 5.9651 5.9651 6.0346 6.0346 6.1935 6.1935 6.2728 6.2728 6.6836 6.6836 6.7414 6.7414 6.7815 6.7815 6.9079 6.9079 9.0800 9.0800 9.5129 9.5129 9.6410 9.6410 10.4051 10.4051 15.2847 15.2847 k = 0.3947 0.3947-0.0000 ( 5077 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3027 -33.3027 -33.2818 -33.2818 -33.2817 -33.2817 -1.5179 -1.5179 -1.1695 -1.1695 3.5957 3.5957 3.6221 3.6221 4.7332 4.7332 4.7531 4.7531 5.3377 5.3377 5.3945 5.3945 5.6534 5.6534 5.7880 5.7880 5.9401 5.9401 6.0342 6.0342 6.1783 6.1783 6.2547 6.2547 6.7049 6.7049 6.7611 6.7611 6.8035 6.8035 6.9564 6.9564 9.1253 9.1253 9.5310 9.5310 9.7628 9.7628 10.5580 10.5580 15.1559 15.1559 k = 0.3860 0.3860-0.0000 ( 5079 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3027 -33.3027 -33.2818 -33.2818 -33.2817 -33.2817 -1.5667 -1.5667 -1.1652 -1.1652 3.6279 3.6279 3.6520 3.6520 4.6995 4.6995 4.7418 4.7418 5.3532 5.3532 5.4068 5.4068 5.6261 5.6261 5.7466 5.7466 5.9149 5.9149 6.0359 6.0359 6.1585 6.1585 6.2437 6.2437 6.7145 6.7145 6.7773 6.7773 6.8431 6.8431 7.0069 7.0069 9.1750 9.1750 9.5505 9.5505 9.8897 9.8897 10.7168 10.7168 15.0250 15.0250 k = 0.3772 0.3772-0.0000 ( 5089 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5808 -33.5808 -33.3028 -33.3028 -33.3027 -33.3027 -33.2818 -33.2818 -33.2817 -33.2817 -1.6176 -1.6176 -1.1609 -1.1609 3.6616 3.6616 3.6823 3.6823 4.6604 4.6604 4.7308 4.7308 5.3702 5.3702 5.4175 5.4175 5.6020 5.6020 5.7086 5.7086 5.8901 5.8901 6.0383 6.0383 6.1372 6.1372 6.2373 6.2373 6.7206 6.7206 6.7894 6.7894 6.8929 6.8929 7.0592 7.0592 9.2291 9.2291 9.5716 9.5716 10.0208 10.0208 10.8808 10.8808 14.8923 14.8923 k = 0.3684 0.3684-0.0000 ( 5085 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5807 -33.5807 -33.3028 -33.3028 -33.3026 -33.3026 -33.2818 -33.2818 -33.2817 -33.2817 -1.6703 -1.6703 -1.1564 -1.1564 3.6947 3.6947 3.7144 3.7144 4.6173 4.6173 4.7198 4.7198 5.3878 5.3878 5.4250 5.4250 5.5830 5.5830 5.6746 5.6746 5.8659 5.8659 6.0403 6.0403 6.1174 6.1174 6.2335 6.2335 6.7260 6.7260 6.8009 6.8009 6.9471 6.9471 7.1131 7.1131 9.2875 9.2875 9.5944 9.5944 10.1553 10.1553 11.0492 11.0492 14.7584 14.7584 k = 0.3596 0.3596-0.0000 ( 5085 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5807 -33.5807 -33.3028 -33.3028 -33.3026 -33.3026 -33.2817 -33.2817 -33.2816 -33.2816 -1.7244 -1.7244 -1.1519 -1.1519 3.7237 3.7237 3.7507 3.7507 4.5721 4.5721 4.7090 4.7090 5.4036 5.4036 5.4282 5.4282 5.5712 5.5712 5.6451 5.6451 5.8426 5.8426 6.0404 6.0404 6.1018 6.1018 6.2311 6.2311 6.7314 6.7314 6.8130 6.8130 7.0036 7.0036 7.1687 7.1687 9.3500 9.3500 9.6189 9.6189 10.2925 10.2925 11.2214 11.2214 14.6239 14.6239 k = 0.3509 0.3509-0.0000 ( 5073 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5807 -33.5807 -33.3028 -33.3028 -33.3026 -33.3026 -33.2817 -33.2817 -33.2816 -33.2816 -1.7797 -1.7797 -1.1475 -1.1475 3.7466 3.7466 3.7918 3.7918 4.5269 4.5269 4.6985 4.6985 5.4091 5.4091 5.4326 5.4326 5.5682 5.5682 5.6204 5.6204 5.8206 5.8206 6.0366 6.0366 6.0926 6.0926 6.2296 6.2296 6.7372 6.7372 6.8265 6.8265 7.0616 7.0616 7.2258 7.2258 9.4165 9.4165 9.6453 9.6453 10.4315 10.4315 11.3967 11.3967 14.4895 14.4895 k = 0.3421 0.3421-0.0000 ( 5067 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5806 -33.5806 -33.3028 -33.3028 -33.3026 -33.3026 -33.2817 -33.2817 -33.2815 -33.2815 -1.8360 -1.8360 -1.1432 -1.1432 3.7631 3.7631 3.8362 3.8362 4.4841 4.4841 4.6887 4.6887 5.3986 5.3986 5.4429 5.4429 5.5726 5.5726 5.6014 5.6014 5.8003 5.8003 6.0287 6.0287 6.0903 6.0903 6.2287 6.2287 6.7434 6.7434 6.8418 6.8418 7.1209 7.1209 7.2846 7.2846 9.4867 9.4867 9.6737 9.6737 10.5716 10.5716 11.5745 11.5745 14.3559 14.3559 k = 0.3333 0.3333-0.0000 ( 5061 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5806 -33.5806 -33.3028 -33.3028 -33.3025 -33.3025 -33.2816 -33.2816 -33.2815 -33.2815 -1.8930 -1.8930 -1.1390 -1.1390 3.7716 3.7716 3.8834 3.8834 4.4465 4.4465 4.6796 4.6796 5.3809 5.3809 5.4509 5.4509 5.5800 5.5800 5.5907 5.5907 5.7824 5.7824 6.0190 6.0190 6.0925 6.0925 6.2282 6.2282 6.7500 6.7500 6.8593 6.8593 7.1810 7.1810 7.3448 7.3448 9.5601 9.5601 9.7044 9.7044 10.7116 10.7116 11.7542 11.7542 14.2241 14.2241 k = 0.3246 0.3246-0.0000 ( 5063 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5806 -33.5806 -33.3028 -33.3028 -33.3025 -33.3025 -33.2816 -33.2816 -33.2815 -33.2815 -1.9506 -1.9506 -1.1349 -1.1349 3.7703 3.7703 3.9332 3.9332 4.4170 4.4170 4.6717 4.6717 5.3602 5.3602 5.4530 5.4530 5.5800 5.5800 5.5960 5.5960 5.7681 5.7681 6.0095 6.0095 6.0972 6.0972 6.2283 6.2283 6.7570 6.7570 6.8793 6.8793 7.2419 7.2419 7.4066 7.4066 9.6356 9.6356 9.7384 9.7384 10.8504 10.8504 11.9349 11.9349 14.0953 14.0953 k = 0.3158 0.3158-0.0000 ( 5063 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5806 -33.5806 -33.3028 -33.3028 -33.3025 -33.3025 -33.2816 -33.2816 -33.2814 -33.2814 -2.0084 -2.0084 -1.1311 -1.1311 3.7577 3.7577 3.9852 3.9852 4.3977 4.3977 4.6650 4.6650 5.3382 5.3382 5.4488 5.4488 5.5798 5.5798 5.6064 5.6064 5.7590 5.7590 6.0013 6.0013 6.1029 6.1029 6.2288 6.2288 6.7642 6.7642 6.9021 6.9021 7.3034 7.3034 7.4699 7.4699 9.7101 9.7101 9.7783 9.7783 10.9866 10.9866 12.1157 12.1157 13.9711 13.9711 k = 0.3070 0.3070-0.0000 ( 5071 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5806 -33.5806 -33.3028 -33.3028 -33.3025 -33.3025 -33.2815 -33.2815 -33.2814 -33.2814 -2.0662 -2.0662 -1.1276 -1.1276 3.7331 3.7331 4.0395 4.0395 4.3897 4.3897 4.6598 4.6598 5.3159 5.3159 5.4402 5.4402 5.5806 5.5806 5.6157 5.6157 5.7568 5.7568 5.9947 5.9947 6.1092 6.1092 6.2297 6.2297 6.7717 6.7717 6.9280 6.9280 7.3654 7.3654 7.5347 7.5347 9.7741 9.7741 9.8334 9.8334 11.1182 11.1182 12.2958 12.2958 13.8533 13.8533 k = 0.2982 0.2982-0.0000 ( 5063 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5805 -33.5805 -33.3028 -33.3028 -33.3025 -33.3025 -33.2815 -33.2815 -33.2814 -33.2814 -2.1240 -2.1240 -1.1244 -1.1244 3.6975 3.6975 4.0959 4.0959 4.3926 4.3926 4.6563 4.6563 5.2940 5.2940 5.4289 5.4289 5.5789 5.5789 5.6238 5.6238 5.7622 5.7622 5.9899 5.9899 6.1156 6.1156 6.2313 6.2313 6.7792 6.7792 6.9569 6.9569 7.4275 7.4275 7.6010 7.6010 9.8224 9.8224 9.9086 9.9086 11.2428 11.2428 12.4739 12.4739 13.7444 13.7444 k = 0.2895 0.2895-0.0000 ( 5063 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5805 -33.5805 -33.3028 -33.3028 -33.3024 -33.3024 -33.2815 -33.2815 -33.2813 -33.2813 -2.1815 -2.1815 -1.1215 -1.1215 3.6527 3.6527 4.1544 4.1544 4.4048 4.4048 4.6547 4.6547 5.2727 5.2727 5.4163 5.4163 5.5725 5.5725 5.6315 5.6315 5.7746 5.7746 5.9867 5.9867 6.1218 6.1218 6.2335 6.2335 6.7869 6.7869 6.9892 6.9892 7.4897 7.4897 7.6688 7.6688 9.8650 9.8650 9.9932 9.9932 11.3573 11.3573 12.6487 12.6487 13.6476 13.6476 k = 0.2807 0.2807-0.0000 ( 5067 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5808 -33.5808 -33.5805 -33.5805 -33.3028 -33.3028 -33.3024 -33.3024 -33.2815 -33.2815 -33.2813 -33.2813 -2.2385 -2.2385 -1.1189 -1.1189 3.6010 3.6010 4.2148 4.2148 4.4245 4.4245 4.6552 4.6552 5.2524 5.2524 5.4033 5.4033 5.5618 5.5618 5.6390 5.6390 5.7922 5.7922 5.9850 5.9850 6.1276 6.1276 6.2365 6.2365 6.7946 6.7946 7.0247 7.0247 7.5517 7.5517 7.7380 7.7380 9.9072 9.9072 10.0813 10.0813 11.4580 11.4580 12.8187 12.8187 13.5668 13.5668 k = 0.2719 0.2719-0.0000 ( 5071 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5808 -33.5808 -33.5804 -33.5804 -33.3029 -33.3029 -33.3024 -33.3024 -33.2814 -33.2814 -33.2813 -33.2813 -2.2950 -2.2950 -1.1168 -1.1168 3.5443 3.5443 4.2769 4.2769 4.4499 4.4499 4.6577 4.6577 5.2333 5.2333 5.3901 5.3901 5.5483 5.5483 5.6459 5.6459 5.8134 5.8134 5.9847 5.9847 6.1328 6.1328 6.2403 6.2403 6.8023 6.8023 7.0635 7.0635 7.6131 7.6131 7.8086 7.8086 9.9503 9.9503 10.1709 10.1709 11.5405 11.5405 12.9821 12.9821 13.5064 13.5064 k = 0.2632 0.2632-0.0000 ( 5065 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5808 -33.5808 -33.5804 -33.5804 -33.3029 -33.3029 -33.3024 -33.3024 -33.2814 -33.2814 -33.2812 -33.2812 -2.3507 -2.3507 -1.1151 -1.1151 3.4844 3.4844 4.3406 4.3406 4.4795 4.4795 4.6626 4.6626 5.2157 5.2157 5.3770 5.3770 5.5330 5.5330 5.6519 5.6519 5.8370 5.8370 5.9854 5.9854 6.1374 6.1374 6.2449 6.2449 6.8101 6.8101 7.1055 7.1055 7.6738 7.6738 7.8806 7.8806 9.9949 9.9949 10.2606 10.2606 11.6005 11.6005 13.1368 13.1368 13.4709 13.4709 k = 0.2544 0.2544-0.0000 ( 5061 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5808 -33.5808 -33.5804 -33.5804 -33.3029 -33.3029 -33.3023 -33.3023 -33.2814 -33.2814 -33.2812 -33.2812 -2.4056 -2.4056 -1.1138 -1.1138 3.4226 3.4226 4.4056 4.4056 4.5123 4.5123 4.6697 4.6697 5.1999 5.1999 5.3640 5.3640 5.5169 5.5169 5.6569 5.6569 5.8621 5.8621 5.9871 5.9871 6.1413 6.1413 6.2505 6.2505 6.8179 6.8179 7.1506 7.1506 7.7333 7.7333 7.9540 7.9540 10.0411 10.0411 10.3494 10.3494 11.6347 11.6347 13.2804 13.2804 13.4644 13.4644 k = 0.2456 0.2456-0.0000 ( 5069 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5808 -33.5808 -33.5804 -33.5804 -33.3029 -33.3029 -33.3023 -33.3023 -33.2813 -33.2813 -33.2812 -33.2812 -2.4594 -2.4594 -1.1130 -1.1130 3.3598 3.3598 4.4713 4.4713 4.5476 4.5476 4.6791 4.6791 5.1860 5.1860 5.3513 5.3513 5.5003 5.5003 5.6608 5.6608 5.8884 5.8884 5.9896 5.9896 6.1443 6.1443 6.2569 6.2569 6.8256 6.8256 7.1986 7.1986 7.7911 7.7911 8.0286 8.0286 10.0890 10.0890 10.4359 10.4359 11.6421 11.6421 13.4080 13.4080 13.4909 13.4909 k = 0.2368 0.2368-0.0000 ( 5065 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5803 -33.5803 -33.3029 -33.3029 -33.3023 -33.3023 -33.2813 -33.2813 -33.2811 -33.2811 -2.5122 -2.5122 -1.1126 -1.1126 3.2969 3.2969 4.5359 4.5359 4.5859 4.5859 4.6911 4.6911 5.1746 5.1746 5.3389 5.3389 5.4836 5.4836 5.6638 5.6638 5.9153 5.9153 5.9928 5.9928 6.1466 6.1466 6.2641 6.2641 6.8334 6.8334 7.2495 7.2495 7.8468 7.8468 8.1045 8.1045 10.1386 10.1386 10.5190 10.5190 11.6248 11.6248 13.5045 13.5045 13.5628 13.5628 k = 0.2281 0.2281-0.0000 ( 5069 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5808 -33.5808 -33.5803 -33.5803 -33.3029 -33.3029 -33.3023 -33.3023 -33.2813 -33.2813 -33.2811 -33.2811 -2.5638 -2.5638 -1.1126 -1.1126 3.2343 3.2343 4.5943 4.5943 4.6305 4.6305 4.7067 4.7067 5.1659 5.1659 5.3267 5.3267 5.4671 5.4671 5.6657 5.6657 5.9427 5.9427 5.9965 5.9965 6.1482 6.1482 6.2720 6.2720 6.8411 6.8411 7.3032 7.3032 7.8997 7.8997 8.1816 8.1816 10.1899 10.1899 10.5974 10.5974 11.5868 11.5868 13.5823 13.5823 13.6631 13.6631 k = 0.2193 0.2193-0.0000 ( 5061 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5803 -33.5803 -33.3029 -33.3029 -33.3022 -33.3022 -33.2813 -33.2813 -33.2810 -33.2810 -2.6140 -2.6140 -1.1131 -1.1131 3.1726 3.1726 4.6399 4.6399 4.6814 4.6814 4.7312 4.7312 5.1607 5.1607 5.3148 5.3148 5.4508 5.4508 5.6668 5.6668 5.9701 5.9701 6.0009 6.0009 6.1492 6.1492 6.2804 6.2804 6.8488 6.8488 7.3595 7.3595 7.9492 7.9492 8.2598 8.2598 10.2428 10.2428 10.6696 10.6696 11.5336 11.5336 13.6673 13.6673 13.7611 13.7611 k = 0.2105 0.2105-0.0000 ( 5055 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3029 -33.3029 -33.3022 -33.3022 -33.2812 -33.2812 -33.2810 -33.2810 -2.6629 -2.6629 -1.1140 -1.1140 3.1121 3.1121 4.6769 4.6769 4.7179 4.7179 4.7801 4.7801 5.1595 5.1595 5.3033 5.3033 5.4350 5.4350 5.6670 5.6670 5.9959 5.9959 6.0075 6.0075 6.1498 6.1498 6.2893 6.2893 6.8564 6.8564 7.4183 7.4183 7.9945 7.9945 8.3391 8.3391 10.2973 10.2973 10.7343 10.7343 11.4706 11.4706 13.7587 13.7587 13.8530 13.8530 k = 0.2018 0.2018-0.0000 ( 5047 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3029 -33.3029 -33.3022 -33.3022 -33.2812 -33.2812 -33.2809 -33.2809 -2.7103 -2.7103 -1.1153 -1.1153 3.0531 3.0531 4.7073 4.7073 4.7440 4.7440 4.8464 4.8464 5.1631 5.1631 5.2920 5.2920 5.4196 5.4196 5.6666 5.6666 6.0075 6.0075 6.0288 6.0288 6.1499 6.1499 6.2985 6.2985 6.8639 6.8639 7.4795 7.4795 8.0347 8.0347 8.4194 8.4194 10.3531 10.3531 10.7902 10.7902 11.4026 11.4026 13.8506 13.8506 13.9404 13.9404 k = 0.1930 0.1930-0.0000 ( 5043 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5802 -33.5802 -33.3029 -33.3029 -33.3021 -33.3021 -33.2811 -33.2811 -33.2809 -33.2809 -2.7562 -2.7562 -1.1170 -1.1170 2.9957 2.9957 4.7293 4.7293 4.7728 4.7728 4.9173 4.9173 5.1721 5.1721 5.2812 5.2812 5.4048 5.4048 5.6657 5.6657 6.0130 6.0130 6.0564 6.0564 6.1496 6.1496 6.3079 6.3079 6.8712 6.8712 7.5430 7.5430 8.0688 8.0688 8.5005 8.5005 10.4103 10.4103 10.8359 10.8359 11.3339 11.3339 13.9348 13.9348 14.0227 14.0227 k = 0.1842 0.1842-0.0000 ( 5047 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2811 -33.2811 -33.2808 -33.2808 -2.8004 -2.8004 -1.1190 -1.1190 2.9401 2.9401 4.7443 4.7443 4.8050 4.8050 4.9896 4.9896 5.1874 5.1874 5.2709 5.2709 5.3908 5.3908 5.6642 5.6642 6.0181 6.0181 6.0846 6.0846 6.1492 6.1492 6.3175 6.3175 6.8782 6.8782 7.6087 7.6087 8.0959 8.0959 8.5824 8.5824 10.4686 10.4686 10.8704 10.8704 11.2679 11.2679 13.8516 13.8516 14.0123 14.0123 k = 0.1754 0.1754-0.0000 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2811 -33.2811 -33.2808 -33.2808 -2.8430 -2.8430 -1.1213 -1.1213 2.8866 2.8866 4.7549 4.7549 4.8382 4.8382 5.0618 5.0618 5.2093 5.2093 5.2613 5.2613 5.3775 5.3775 5.6622 5.6622 6.0233 6.0233 6.1130 6.1130 6.1485 6.1485 6.3271 6.3271 6.8851 6.8851 7.6765 7.6765 8.1150 8.1150 8.6649 8.6649 10.5278 10.5278 10.8931 10.8931 11.2076 11.2076 13.6681 13.6681 14.0622 14.0622 k = 0.1667 0.1667-0.0000 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2811 -33.2811 -33.2807 -33.2807 -2.8838 -2.8838 -1.1239 -1.1239 2.8351 2.8351 4.7620 4.7620 4.8710 4.8710 5.1325 5.1325 5.2368 5.2368 5.2543 5.2543 5.3655 5.3655 5.6600 5.6600 6.0284 6.0284 6.1416 6.1416 6.1477 6.1477 6.3366 6.3366 6.8916 6.8916 7.7461 7.7461 8.1253 8.1253 8.7478 8.7478 10.5876 10.5876 10.9036 10.9036 11.1554 11.1554 13.4889 13.4889 14.0846 14.0846 k = 0.1579 0.1579-0.0000 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5801 -33.5801 -33.3029 -33.3029 -33.3021 -33.3021 -33.2811 -33.2811 -33.2807 -33.2807 -2.9229 -2.9229 -1.1267 -1.1267 2.7859 2.7859 4.7664 4.7664 4.9030 4.9030 5.1965 5.1965 5.2462 5.2462 5.2773 5.2773 5.3557 5.3557 5.6575 5.6575 6.0335 6.0335 6.1467 6.1467 6.1704 6.1704 6.3460 6.3460 6.8976 6.8976 7.8171 7.8171 8.1261 8.1261 8.8310 8.8310 10.6475 10.6475 10.9022 10.9022 11.1129 11.1129 13.3152 13.3152 14.0763 14.0763 k = 0.1491 0.1491-0.0000 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5800 -33.5800 -33.3029 -33.3029 -33.3020 -33.3020 -33.2810 -33.2810 -33.2807 -33.2807 -2.9601 -2.9601 -1.1297 -1.1297 2.7390 2.7390 4.7684 4.7684 4.9338 4.9338 5.2219 5.2219 5.2734 5.2734 5.3217 5.3217 5.3520 5.3520 5.6550 5.6550 6.0386 6.0386 6.1457 6.1457 6.1996 6.1996 6.3552 6.3552 6.9032 6.9032 7.8885 7.8885 8.1177 8.1177 8.9142 8.9142 10.7067 10.7067 10.8904 10.8904 11.0810 11.0810 13.1476 13.1476 14.0396 14.0396 k = 0.1404 0.1404-0.0000 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5800 -33.5800 -33.3029 -33.3029 -33.3020 -33.3020 -33.2810 -33.2810 -33.2807 -33.2807 -2.9953 -2.9953 -1.1329 -1.1329 2.6945 2.6945 4.7685 4.7685 4.9633 4.9633 5.2174 5.2174 5.3030 5.3030 5.3691 5.3691 5.3785 5.3785 5.6524 5.6524 6.0436 6.0436 6.1446 6.1446 6.2292 6.2292 6.3643 6.3643 6.9083 6.9083 7.9566 7.9566 8.1034 8.1034 8.9973 8.9973 10.7632 10.7632 10.8708 10.8708 11.0604 11.0604 12.9865 12.9865 13.9801 13.9801 k = 0.1316 0.1316-0.0000 ( 5049 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5800 -33.5800 -33.3029 -33.3029 -33.3020 -33.3020 -33.2810 -33.2810 -33.2806 -33.2806 -3.0287 -3.0287 -1.1362 -1.1362 2.6524 2.6524 4.7671 4.7671 4.9912 4.9912 5.2102 5.2102 5.3045 5.3045 5.4179 5.4179 5.4391 5.4391 5.6503 5.6503 6.0484 6.0484 6.1435 6.1435 6.2594 6.2594 6.3731 6.3731 6.9126 6.9126 8.0015 8.0015 8.1030 8.1030 9.0797 9.0797 10.8011 10.8011 10.8594 10.8594 11.0517 11.0517 12.8326 12.8326 13.9037 13.9037 k = 0.1228 0.1228-0.0000 ( 5053 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5800 -33.5800 -33.3030 -33.3030 -33.3020 -33.3020 -33.2810 -33.2810 -33.2806 -33.2806 -3.0601 -3.0601 -1.1395 -1.1395 2.6129 2.6129 4.7646 4.7646 5.0175 5.0175 5.2027 5.2027 5.2985 5.2985 5.4760 5.4760 5.5012 5.5012 5.6491 5.6491 6.0530 6.0530 6.1425 6.1425 6.2904 6.2904 6.3816 6.3816 6.9161 6.9161 7.9867 7.9867 8.1529 8.1529 9.1614 9.1614 10.7797 10.7797 10.8967 10.8967 11.0555 11.0555 12.6867 12.6867 13.8150 13.8150 k = 0.1140 0.1140-0.0000 ( 5039 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5799 -33.5799 -33.3030 -33.3030 -33.3020 -33.3020 -33.2809 -33.2809 -33.2806 -33.2806 -3.0894 -3.0894 -1.1428 -1.1428 2.5759 2.5759 4.7614 4.7614 5.0420 5.0420 5.1955 5.1955 5.2914 5.2914 5.5387 5.5387 5.5597 5.5597 5.6511 5.6511 6.0573 6.0573 6.1415 6.1415 6.3222 6.3222 6.3899 6.3899 6.9188 6.9188 7.9393 7.9393 8.2268 8.2268 9.2417 9.2417 10.7331 10.7331 10.9484 10.9484 11.0719 11.0719 12.5495 12.5495 13.7175 13.7175 k = 0.1053 0.1053-0.0000 ( 5033 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3030 -33.3030 -33.3019 -33.3019 -33.2809 -33.2809 -33.2805 -33.2805 -3.1167 -3.1167 -1.1461 -1.1461 2.5415 2.5415 4.7577 4.7577 5.0645 5.0645 5.1886 5.1886 5.2846 5.2846 5.5978 5.5978 5.6109 5.6109 5.6659 5.6659 6.0613 6.0613 6.1405 6.1405 6.3546 6.3546 6.3984 6.3984 6.9203 6.9203 7.8776 7.8776 8.3070 8.3070 9.3204 9.3204 10.6765 10.6765 10.9993 10.9993 11.1004 11.1004 12.4220 12.4220 13.6135 13.6135 k = 0.0965 0.0965-0.0000 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3030 -33.3030 -33.3019 -33.3019 -33.2809 -33.2809 -33.2805 -33.2805 -3.1420 -3.1420 -1.1494 -1.1494 2.5098 2.5098 4.7538 4.7538 5.0850 5.0850 5.1822 5.1822 5.2784 5.2784 5.6173 5.6173 5.6733 5.6733 5.7097 5.7097 6.0650 6.0650 6.1396 6.1396 6.3856 6.3856 6.4091 6.4091 6.9206 6.9206 7.8059 7.8059 8.3900 8.3900 9.3968 9.3968 10.6128 10.6128 11.0466 11.0466 11.1401 11.1401 12.3054 12.3054 13.5047 13.5047 k = 0.0877 0.0877-0.0000 ( 5027 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2808 -33.2808 -33.2805 -33.2805 -3.1651 -3.1651 -1.1524 -1.1524 2.4807 2.4807 4.7498 4.7498 5.1032 5.1032 5.1764 5.1764 5.2732 5.2732 5.6201 5.6201 5.7307 5.7307 5.7749 5.7749 6.0683 6.0683 6.1388 6.1388 6.4047 6.4047 6.4325 6.4325 6.9196 6.9196 7.7262 7.7262 8.4745 8.4745 9.4703 9.4703 10.5436 10.5436 11.0884 11.0884 11.1900 11.1900 12.2010 12.2010 13.3925 13.3925 k = 0.0789 0.0789-0.0000 ( 5033 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2808 -33.2808 -33.2805 -33.2805 -3.1861 -3.1861 -1.1554 -1.1554 2.4543 2.4543 4.7458 4.7458 5.1190 5.1190 5.1711 5.1711 5.2692 5.2692 5.6194 5.6194 5.7793 5.7793 5.8513 5.8513 6.0712 6.0712 6.1380 6.1380 6.4132 6.4132 6.4671 6.4671 6.9169 6.9169 7.6400 7.6400 8.5601 8.5601 9.5402 9.5402 10.4702 10.4702 11.1230 11.1230 11.2491 11.2491 12.1103 12.1103 13.2780 13.2780 k = 0.0702 0.0702-0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2808 -33.2808 -33.2805 -33.2805 -3.2049 -3.2049 -1.1581 -1.1581 2.4306 2.4306 4.7421 4.7421 5.1322 5.1322 5.1666 5.1666 5.2663 5.2663 5.6178 5.6178 5.8216 5.8216 5.9332 5.9332 6.0740 6.0740 6.1375 6.1375 6.4194 6.4194 6.5044 6.5044 6.9125 6.9125 7.5487 7.5487 8.6459 8.6459 9.6056 9.6056 10.3941 10.3941 11.1488 11.1488 11.3162 11.3162 12.0347 12.0347 13.1623 13.1623 k = 0.0614 0.0614-0.0000 ( 5043 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5799 -33.5799 -33.3030 -33.3030 -33.3019 -33.3019 -33.2809 -33.2809 -33.2805 -33.2805 -3.2216 -3.2216 -1.1606 -1.1606 2.4097 2.4097 4.7386 4.7386 5.1423 5.1423 5.1632 5.1632 5.2647 5.2647 5.6158 5.6158 5.8585 5.8585 6.0164 6.0164 6.0785 6.0785 6.1373 6.1373 6.4247 6.4247 6.5427 6.5427 6.9060 6.9060 7.4532 7.4532 8.7314 8.7314 9.6655 9.6655 10.3167 10.3167 11.1649 11.1649 11.3899 11.3899 11.9750 11.9750 13.0463 13.0463 k = 0.0526 0.0526-0.0000 ( 5047 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5799 -33.5799 -33.3030 -33.3030 -33.3019 -33.3019 -33.2809 -33.2809 -33.2804 -33.2804 -3.2360 -3.2360 -1.1628 -1.1628 2.3915 2.3915 4.7355 4.7355 5.1483 5.1483 5.1621 5.1621 5.2643 5.2643 5.6139 5.6139 5.8903 5.8903 6.0671 6.0671 6.1145 6.1145 6.1406 6.1406 6.4291 6.4291 6.5812 6.5812 6.8974 6.8974 7.3549 7.3549 8.8156 8.8156 9.7186 9.7186 10.2399 10.2399 11.1714 11.1714 11.4688 11.4688 11.9311 11.9311 12.9312 12.9312 k = 0.0439 0.0439-0.0000 ( 5029 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2483 -3.2483 -1.1648 -1.1648 2.3761 2.3761 4.7328 4.7328 5.1495 5.1495 5.1642 5.1642 5.2649 5.2649 5.6121 5.6121 5.9172 5.9172 6.0720 6.0720 6.1337 6.1337 6.2087 6.2087 6.4329 6.4329 6.6191 6.6191 6.8861 6.8861 7.2548 7.2548 8.8971 8.8971 9.7634 9.7634 10.1662 10.1662 11.1696 11.1696 11.5510 11.5510 11.9017 11.9017 12.8186 12.8186 k = 0.0351 0.0351-0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2584 -3.2584 -1.1664 -1.1664 2.3635 2.3635 4.7305 4.7305 5.1483 5.1483 5.1673 5.1673 5.2661 5.2661 5.6106 5.6106 5.9394 5.9394 6.0726 6.0726 6.1342 6.1342 6.3012 6.3012 6.4361 6.4361 6.6558 6.6558 6.8720 6.8720 7.1542 7.1542 8.9740 8.9740 9.7973 9.7973 10.0996 10.0996 11.1621 11.1621 11.6343 11.6343 11.8841 11.8841 12.7105 12.7105 k = 0.0263 0.0263-0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2662 -3.2662 -1.1677 -1.1677 2.3536 2.3536 4.7287 4.7287 5.1468 5.1468 5.1698 5.1698 5.2676 5.2676 5.6093 5.6093 5.9568 5.9568 6.0723 6.0723 6.1341 6.1341 6.3957 6.3957 6.4388 6.4388 6.6902 6.6902 6.8542 6.8542 7.0554 7.0554 9.0431 9.0431 9.8170 9.8170 10.0457 10.0457 11.1522 11.1522 11.7146 11.7146 11.8756 11.8756 12.6100 12.6100 k = 0.0175 0.0175-0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2718 -3.2718 -1.1686 -1.1686 2.3466 2.3466 4.7274 4.7274 5.1455 5.1455 5.1715 5.1715 5.2689 5.2689 5.6084 5.6084 5.9695 5.9695 6.0716 6.0716 6.1340 6.1340 6.4396 6.4396 6.4911 6.4911 6.7209 6.7209 6.8306 6.8306 6.9632 6.9632 9.1000 9.1000 9.8204 9.8204 10.0109 10.0109 11.1427 11.1427 11.7847 11.7847 11.8744 11.8744 12.5233 12.5233 k = 0.0088 0.0088-0.0000 ( 5021 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2752 -3.2752 -1.1691 -1.1691 2.3424 2.3424 4.7266 4.7266 5.1447 5.1447 5.1724 5.1724 5.2699 5.2699 5.6078 5.6078 5.9772 5.9772 6.0709 6.0709 6.1339 6.1339 6.4409 6.4409 6.5793 6.5793 6.7438 6.7438 6.7955 6.7955 6.8928 6.8928 9.1384 9.1384 9.8133 9.8133 9.9951 9.9951 11.1361 11.1361 11.8296 11.8296 11.8824 11.8824 12.4606 12.4606 k = 0.0000 0.0000 0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2763 -3.2763 -1.1693 -1.1693 2.3410 2.3410 4.7263 4.7263 5.1445 5.1445 5.1727 5.1727 5.2702 5.2702 5.6076 5.6076 5.9798 5.9798 6.0706 6.0706 6.1339 6.1339 6.4412 6.4412 6.6297 6.6297 6.7444 6.7444 6.7716 6.7716 6.8675 6.8675 9.1521 9.1521 9.8087 9.8087 9.9912 9.9912 11.1337 11.1337 11.8414 11.8414 11.8912 11.8912 12.4369 12.4369 k = 0.0000 0.0000 0.0000 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2763 -3.2763 -1.1693 -1.1693 2.3410 2.3410 4.7263 4.7263 5.1445 5.1445 5.1727 5.1727 5.2702 5.2702 5.6076 5.6076 5.9798 5.9798 6.0706 6.0706 6.1339 6.1339 6.4412 6.4412 6.6297 6.6297 6.7444 6.7444 6.7716 6.7716 6.8675 6.8675 9.1521 9.1521 9.8087 9.8087 9.9912 9.9912 11.1337 11.1337 11.8414 11.8414 11.8912 11.8912 12.4369 12.4369 k = 0.0000 0.0000 0.0122 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2754 -3.2754 -1.1719 -1.1719 2.3443 2.3443 4.7261 4.7261 5.1445 5.1445 5.1721 5.1721 5.2695 5.2695 5.6079 5.6079 5.9799 5.9799 6.0708 6.0708 6.1340 6.1340 6.4412 6.4412 6.6274 6.6274 6.7465 6.7465 6.7717 6.7717 6.8695 6.8695 9.1548 9.1548 9.8020 9.8020 9.9834 9.9834 11.1346 11.1346 11.8498 11.8498 11.8983 11.8983 12.4388 12.4388 k = 0.0000 0.0000 0.0244 ( 5053 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5798 -33.5798 -33.3030 -33.3030 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2728 -3.2728 -1.1795 -1.1795 2.3541 2.3541 4.7254 4.7254 5.1445 5.1445 5.1706 5.1706 5.2674 5.2674 5.6086 5.6086 5.9801 5.9801 6.0711 6.0711 6.1344 6.1344 6.4413 6.4413 6.6203 6.6203 6.7526 6.7526 6.7719 6.7719 6.8755 6.8755 9.1628 9.1628 9.7820 9.7820 9.9605 9.9605 11.1370 11.1370 11.8744 11.8744 11.9195 11.9195 12.4444 12.4444 k = 0.0000 0.0000 0.0366 ( 5049 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5807 -33.5807 -33.5798 -33.5798 -33.3030 -33.3030 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2684 -3.2684 -1.1921 -1.1921 2.3703 2.3703 4.7243 4.7243 5.1445 5.1445 5.1681 5.1681 5.2641 5.2641 5.6098 5.6098 5.9804 5.9804 6.0718 6.0718 6.1349 6.1349 6.4414 6.4414 6.6088 6.6088 6.7615 6.7615 6.7736 6.7736 6.8854 6.8854 9.1760 9.1760 9.7497 9.7497 9.9237 9.9237 11.1411 11.1411 11.9141 11.9141 11.9539 11.9539 12.4535 12.4535 k = 0.0000 0.0000 0.0488 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3018 -33.3018 -33.2808 -33.2808 -33.2804 -33.2804 -3.2623 -3.2623 -1.2094 -1.2094 2.3926 2.3926 4.7226 4.7226 5.1445 5.1445 5.1647 5.1647 5.2595 5.2595 5.6115 5.6115 5.9808 5.9808 6.0726 6.0726 6.1356 6.1356 6.4415 6.4415 6.5932 6.5932 6.7672 6.7672 6.7826 6.7826 6.8992 6.8992 9.1943 9.1943 9.7063 9.7063 9.8747 9.8747 11.1469 11.1469 11.9669 11.9669 12.0000 12.0000 12.4658 12.4658 k = 0.0000 0.0000 0.0611 ( 5033 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3030 -33.3030 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2545 -3.2545 -1.2312 -1.2312 2.4207 2.4207 4.7202 4.7202 5.1445 5.1445 5.1605 5.1605 5.2537 5.2537 5.6136 5.6136 5.9813 5.9813 6.0736 6.0736 6.1365 6.1365 6.4417 6.4417 6.5739 6.5739 6.7682 6.7682 6.8001 6.8001 6.9169 6.9169 9.2172 9.2172 9.6533 9.6533 9.8154 9.8154 11.1543 11.1543 12.0309 12.0309 12.0562 12.0562 12.4808 12.4808 k = 0.0000 0.0000 0.0733 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3029 -33.3029 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2450 -3.2450 -1.2570 -1.2570 2.4543 2.4543 4.7170 4.7170 5.1445 5.1445 5.1555 5.1555 5.2470 5.2470 5.6161 5.6161 5.9819 5.9819 6.0747 6.0747 6.1375 6.1375 6.4418 6.4418 6.5515 6.5515 6.7684 6.7684 6.8224 6.8224 6.9384 6.9384 9.2446 9.2446 9.5922 9.5922 9.7478 9.7478 11.1634 11.1634 12.1040 12.1040 12.1207 12.1207 12.4978 12.4978 k = 0.0000 0.0000 0.0855 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5798 -33.5798 -33.3029 -33.3029 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2340 -3.2340 -1.2865 -1.2865 2.4928 2.4928 4.7130 4.7130 5.1445 5.1445 5.1499 5.1499 5.2395 5.2395 5.6190 5.6190 5.9827 5.9827 6.0759 6.0759 6.1386 6.1386 6.4420 6.4420 6.5263 6.5263 6.7684 6.7684 6.8487 6.8487 6.9636 6.9636 9.2759 9.2759 9.5246 9.5246 9.6735 9.6735 11.1742 11.1742 12.1842 12.1842 12.1916 12.1916 12.5154 12.5154 k = 0.0000 0.0000 0.0977 ( 5033 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2214 -3.2214 -1.3193 -1.3193 2.5358 2.5358 4.7079 4.7079 5.1432 5.1432 5.1450 5.1450 5.2312 5.2312 5.6222 5.6222 5.9836 5.9836 6.0772 6.0772 6.1397 6.1397 6.4422 6.4422 6.4990 6.4990 6.7683 6.7683 6.8788 6.8788 6.9924 6.9924 9.3103 9.3103 9.4523 9.4523 9.5942 9.5942 11.1867 11.1867 12.2669 12.2669 12.2698 12.2698 12.5316 12.5316 k = 0.0000 0.0000 0.1099 ( 5025 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5806 -33.5806 -33.5799 -33.5799 -33.3029 -33.3029 -33.3019 -33.3019 -33.2808 -33.2808 -33.2804 -33.2804 -3.2074 -3.2074 -1.3548 -1.3548 2.5828 2.5828 4.7015 4.7015 5.1369 5.1369 5.1447 5.1447 5.2225 5.2225 5.6256 5.6256 5.9846 5.9846 6.0784 6.0784 6.1409 6.1409 6.4424 6.4424 6.4702 6.4702 6.7683 6.7683 6.9124 6.9124 7.0248 7.0248 9.3404 9.3404 9.3836 9.3836 9.5109 9.5109 11.2009 11.2009 12.3434 12.3434 12.3591 12.3591 12.5432 12.5432 k = 0.0000 0.0000 0.1221 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5805 -33.5805 -33.5799 -33.5799 -33.3029 -33.3029 -33.3020 -33.3020 -33.2808 -33.2808 -33.2805 -33.2805 -3.1920 -3.1920 -1.3926 -1.3926 2.6331 2.6331 4.6938 4.6938 5.1301 5.1301 5.1447 5.1447 5.2134 5.2134 5.6292 5.6292 5.9856 5.9856 6.0797 6.0797 6.1420 6.1420 6.4405 6.4405 6.4425 6.4425 6.7682 6.7682 6.9495 6.9495 7.0605 7.0605 9.2876 9.2876 9.3978 9.3978 9.4247 9.4247 11.2169 11.2169 12.4131 12.4131 12.4501 12.4501 12.5489 12.5489 k = 0.0000 0.0000 0.1343 ( 5049 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5805 -33.5805 -33.5799 -33.5799 -33.3029 -33.3029 -33.3020 -33.3020 -33.2808 -33.2808 -33.2805 -33.2805 -3.1753 -3.1753 -1.4322 -1.4322 2.6863 2.6863 4.6846 4.6846 5.1230 5.1230 5.1447 5.1447 5.2041 5.2041 5.6329 5.6329 5.9868 5.9868 6.0809 6.0809 6.1431 6.1431 6.4104 6.4104 6.4427 6.4427 6.7682 6.7682 6.9898 6.9898 7.0996 7.0996 9.2059 9.2059 9.3365 9.3365 9.4413 9.4413 11.2346 11.2346 12.4416 12.4416 12.5384 12.5384 12.5698 12.5698 k = 0.0000 0.0000 0.1465 ( 5049 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5805 -33.5805 -33.5799 -33.5799 -33.3028 -33.3028 -33.3020 -33.3020 -33.2808 -33.2808 -33.2805 -33.2805 -3.1576 -3.1576 -1.4731 -1.4731 2.7417 2.7417 4.6737 4.6737 5.1158 5.1158 5.1447 5.1447 5.1947 5.1947 5.6367 5.6367 5.9880 5.9880 6.0820 6.0820 6.1442 6.1442 6.3806 6.3806 6.4428 6.4428 6.7683 6.7683 7.0333 7.0333 7.1419 7.1419 9.1212 9.1212 9.2469 9.2469 9.4889 9.4889 11.2542 11.2542 12.3927 12.3927 12.5784 12.5784 12.6320 12.6320 k = 0.0000 0.0000 0.1587 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5805 -33.5805 -33.5799 -33.5799 -33.3028 -33.3028 -33.3020 -33.3020 -33.2808 -33.2808 -33.2805 -33.2805 -3.1389 -3.1389 -1.5149 -1.5149 2.7987 2.7987 4.6611 4.6611 5.1086 5.1086 5.1448 5.1448 5.1854 5.1854 5.6404 5.6404 5.9892 5.9892 6.0831 6.0831 6.1452 6.1452 6.3515 6.3515 6.4430 6.4430 6.7683 6.7683 7.0797 7.0797 7.1872 7.1872 9.0350 9.0350 9.1565 9.1565 9.5394 9.5394 11.2755 11.2755 12.2959 12.2959 12.5267 12.5267 12.7084 12.7084 k = 0.0000 0.0000 0.1710 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5805 -33.5805 -33.5799 -33.5799 -33.3028 -33.3028 -33.3020 -33.3020 -33.2807 -33.2807 -33.2805 -33.2805 -3.1194 -3.1194 -1.5569 -1.5569 2.8566 2.8566 4.6467 4.6467 5.1016 5.1016 5.1448 5.1448 5.1763 5.1763 5.6440 5.6440 5.9905 5.9905 6.0841 6.0841 6.1461 6.1461 6.3238 6.3238 6.4431 6.4431 6.7684 6.7684 7.1291 7.1291 7.2354 7.2354 8.9479 8.9479 9.0657 9.0657 9.5924 9.5924 11.2988 11.2988 12.1752 12.1752 12.4626 12.4626 12.7857 12.7857 k = 0.0000 0.0000 0.1832 ( 5045 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5805 -33.5805 -33.5800 -33.5800 -33.3028 -33.3028 -33.3021 -33.3021 -33.2807 -33.2807 -33.2805 -33.2805 -3.0993 -3.0993 -1.5987 -1.5987 2.9149 2.9149 4.6305 4.6305 5.0948 5.0948 5.1448 5.1448 5.1675 5.1675 5.6473 5.6473 5.9918 5.9918 6.0850 6.0850 6.1469 6.1469 6.2977 6.2977 6.4432 6.4432 6.7685 6.7685 7.1811 7.1811 7.2865 7.2865 8.8604 8.8604 8.9750 8.9750 9.6478 9.6478 11.3238 11.3238 12.0437 12.0437 12.3971 12.3971 12.8599 12.8599 k = 0.0000 0.0000 0.1954 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5800 -33.5800 -33.3027 -33.3027 -33.3021 -33.3021 -33.2807 -33.2807 -33.2805 -33.2805 -3.0790 -3.0790 -1.6398 -1.6398 2.9729 2.9729 4.6126 4.6126 5.0883 5.0883 5.1449 5.1449 5.1591 5.1591 5.6503 5.6503 5.9930 5.9930 6.0859 6.0859 6.1477 6.1477 6.2736 6.2736 6.4433 6.4433 6.7687 6.7687 7.2357 7.2357 7.3402 7.3402 8.7730 8.7730 8.8846 8.8846 9.7054 9.7054 11.3508 11.3508 11.9089 11.9089 12.3317 12.3317 12.9287 12.9287 k = 0.0000 0.0000 0.2076 ( 5037 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5800 -33.5800 -33.3027 -33.3027 -33.3021 -33.3021 -33.2807 -33.2807 -33.2805 -33.2805 -3.0586 -3.0586 -1.6796 -1.6796 3.0297 3.0297 4.5933 4.5933 5.0822 5.0822 5.1449 5.1449 5.1513 5.1513 5.6529 5.6529 5.9942 5.9942 6.0866 6.0866 6.1484 6.1484 6.2518 6.2518 6.4434 6.4434 6.7688 6.7688 7.2927 7.2927 7.3965 7.3965 8.6858 8.6858 8.7948 8.7948 9.7649 9.7649 11.3796 11.3796 11.7746 11.7746 12.2670 12.2670 12.9910 12.9910 k = 0.0000 0.0000 0.2198 ( 5033 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5800 -33.5800 -33.3026 -33.3026 -33.3022 -33.3022 -33.2807 -33.2807 -33.2805 -33.2805 -3.0386 -3.0386 -1.7175 -1.7175 3.0847 3.0847 4.5730 4.5730 5.0765 5.0765 5.1441 5.1441 5.1449 5.1449 5.6551 5.6551 5.9954 5.9954 6.0873 6.0873 6.1490 6.1490 6.2325 6.2325 6.4435 6.4435 6.7689 6.7689 7.3520 7.3520 7.4551 7.4551 8.5994 8.5994 8.7060 8.7060 9.8263 9.8263 11.4103 11.4103 11.6434 11.6434 12.2035 12.2035 13.0467 13.0467 k = 0.0000 0.0000 0.2320 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5801 -33.5801 -33.3026 -33.3026 -33.3022 -33.3022 -33.2807 -33.2807 -33.2805 -33.2805 -3.0193 -3.0193 -1.7531 -1.7531 3.1368 3.1368 4.5520 4.5520 5.0714 5.0714 5.1375 5.1375 5.1449 5.1449 5.6569 5.6569 5.9964 5.9964 6.0879 6.0879 6.1496 6.1496 6.2157 6.2157 6.4436 6.4436 6.7691 6.7691 7.4133 7.4133 7.5160 7.5160 8.5139 8.5139 8.6183 8.6183 9.8890 9.8890 11.4429 11.4429 11.5171 11.5171 12.1414 12.1414 13.0963 13.0963 k = 0.0000 0.0000 0.2442 ( 5041 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5801 -33.5801 -33.3026 -33.3026 -33.3022 -33.3022 -33.2807 -33.2807 -33.2805 -33.2805 -3.0011 -3.0011 -1.7857 -1.7857 3.1854 3.1854 4.5311 4.5311 5.0669 5.0669 5.1318 5.1318 5.1450 5.1450 5.6583 5.6583 5.9974 5.9974 6.0884 6.0884 6.1500 6.1500 6.2015 6.2015 6.4436 6.4436 6.7692 6.7692 7.4764 7.4764 7.5789 7.5789 8.4297 8.4297 8.5321 8.5321 9.9524 9.9524 11.3971 11.3971 11.4773 11.4773 12.0810 12.0810 13.1400 13.1400 k = 0.0000 0.0000 0.2564 ( 5045 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5803 -33.5803 -33.5801 -33.5801 -33.3026 -33.3026 -33.3023 -33.3023 -33.2807 -33.2807 -33.2805 -33.2805 -2.9846 -2.9846 -1.8147 -1.8147 3.2292 3.2292 4.5110 4.5110 5.0629 5.0629 5.1268 5.1268 5.1450 5.1450 5.6594 5.6594 5.9983 5.9983 6.0888 6.0888 6.1504 6.1504 6.1898 6.1898 6.4437 6.4437 6.7693 6.7693 7.5409 7.5409 7.6435 7.6435 8.3472 8.3472 8.4477 8.4477 10.0157 10.0157 11.2850 11.2850 11.5133 11.5133 12.0227 12.0227 13.1780 13.1780 k = 0.0000 0.0000 0.2686 ( 5036 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5803 -33.5803 -33.5801 -33.5801 -33.3025 -33.3025 -33.3023 -33.3023 -33.2807 -33.2807 -33.2805 -33.2805 -2.9701 -2.9701 -1.8394 -1.8394 3.2672 3.2672 4.4925 4.4925 5.0597 5.0597 5.1226 5.1226 5.1450 5.1450 5.6601 5.6601 5.9990 5.9990 6.0891 6.0891 6.1507 6.1507 6.1805 6.1805 6.4437 6.4437 6.7694 6.7694 7.6063 7.6063 7.7093 7.7093 8.2671 8.2671 8.3657 8.3657 10.0771 10.0771 11.1831 11.1831 11.5507 11.5507 11.9669 11.9669 13.2099 13.2099 k = 0.0000 0.0000 0.2809 ( 5044 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5801 -33.5801 -33.3025 -33.3025 -33.3023 -33.3023 -33.2807 -33.2807 -33.2805 -33.2805 -2.9582 -2.9582 -1.8594 -1.8594 3.2983 3.2983 4.4768 4.4768 5.0571 5.0571 5.1194 5.1194 5.1450 5.1450 5.6606 5.6606 5.9995 5.9995 6.0894 6.0894 6.1510 6.1510 6.1734 6.1734 6.4437 6.4437 6.7695 6.7695 7.6713 7.6713 7.7752 7.7752 8.1905 8.1905 8.2871 8.2871 10.1339 10.1339 11.0945 11.0945 11.5888 11.5888 11.9142 11.9142 13.2354 13.2354 k = 0.0000 0.0000 0.2931 ( 5044 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3023 -33.3023 -33.2806 -33.2806 -33.2805 -33.2805 -2.9494 -2.9494 -1.8742 -1.8742 3.3215 3.3215 4.4646 4.4646 5.0553 5.0553 5.1171 5.1171 5.1450 5.1450 5.6609 5.6609 6.0000 6.0000 6.0896 6.0896 6.1511 6.1511 6.1685 6.1685 6.4438 6.4438 6.7696 6.7696 7.7334 7.7334 7.8389 7.8389 8.1202 8.1202 8.2143 8.2143 10.1818 10.1818 11.0236 11.0236 11.6263 11.6263 11.8664 11.8664 13.2540 13.2540 k = 0.0000 0.0000 0.3053 ( 5052 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2806 -33.2806 -33.2806 -33.2806 -2.9439 -2.9439 -1.8832 -1.8832 3.3358 3.3358 4.4570 4.4570 5.0541 5.0541 5.1156 5.1156 5.1450 5.1450 5.6610 5.6610 6.0002 6.0002 6.0897 6.0897 6.1512 6.1512 6.1656 6.1656 6.4438 6.4438 6.7696 6.7696 7.7852 7.7852 7.8935 7.8935 8.0635 8.0635 8.1542 8.1542 10.2148 10.2148 10.9767 10.9767 11.6585 11.6585 11.8280 11.8280 13.2654 13.2654 k = 0.0000 0.0000 0.3175 ( 5060 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9420 -2.9420 -1.8862 -1.8862 3.3406 3.3406 4.4544 4.4544 5.0538 5.0538 5.1152 5.1152 5.1450 5.1450 5.6611 5.6611 6.0003 6.0003 6.0897 6.0897 6.1513 6.1513 6.1646 6.1646 6.4438 6.4438 6.7696 6.7696 7.8080 7.8080 7.9185 7.9185 8.0390 8.0390 8.1274 8.1274 10.2268 10.2268 10.9601 10.9601 11.6732 11.6732 11.8112 11.8112 13.2692 13.2692 k = 0.0000 0.0000 0.3175 ( 5060 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9420 -2.9420 -1.8862 -1.8862 3.3406 3.3406 4.4544 4.4544 5.0538 5.0538 5.1152 5.1152 5.1450 5.1450 5.6611 5.6611 6.0003 6.0003 6.0897 6.0897 6.1513 6.1513 6.1646 6.1646 6.4438 6.4438 6.7696 6.7696 7.8080 7.8080 7.9185 7.9185 8.0390 8.0390 8.1274 8.1274 10.2268 10.2268 10.9601 10.9601 11.6732 11.6732 11.8112 11.8112 13.2692 13.2692 k = 0.0000 0.0125 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2806 -33.2806 -33.2805 -33.2805 -2.9410 -2.9410 -1.8854 -1.8854 3.3395 3.3395 4.4544 4.4544 5.0536 5.0536 5.1149 5.1149 5.1454 5.1454 5.6609 5.6609 5.9995 5.9995 6.0830 6.0830 6.1376 6.1376 6.1856 6.1856 6.4436 6.4436 6.7677 6.7677 7.8068 7.8068 7.9172 7.9172 8.0339 8.0339 8.1233 8.1233 10.2287 10.2287 10.9688 10.9688 11.6804 11.6804 11.8170 11.8170 13.2674 13.2674 k = 0.0000 0.0250 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2806 -33.2806 -33.2806 -33.2806 -2.9379 -2.9379 -1.8831 -1.8831 3.3362 3.3362 4.4545 4.4545 5.0532 5.0532 5.1140 5.1140 5.1465 5.1465 5.6603 5.6603 5.9969 5.9969 6.0652 6.0652 6.1277 6.1277 6.2155 6.2155 6.4430 6.4430 6.7621 6.7621 7.8028 7.8028 7.9137 7.9137 8.0134 8.0134 8.1168 8.1168 10.2341 10.2341 10.9935 10.9935 11.7020 11.7020 11.8348 11.8348 13.2620 13.2620 k = 0.0000 0.0375 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9327 -2.9327 -1.8793 -1.8793 3.3307 3.3307 4.4546 4.4546 5.0524 5.0524 5.1130 5.1130 5.1483 5.1483 5.6593 5.6593 5.9918 5.9918 6.0428 6.0428 6.1223 6.1223 6.2474 6.2474 6.4421 6.4421 6.7529 6.7529 7.7949 7.7949 7.9094 7.9094 7.9700 7.9700 8.1176 8.1176 10.2427 10.2427 11.0307 11.0307 11.7379 11.7379 11.8658 11.8658 13.2525 13.2525 k = 0.0000 0.0500 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9255 -2.9255 -1.8740 -1.8740 3.3228 3.3228 4.4546 4.4546 5.0508 5.0508 5.1120 5.1120 5.1509 5.1509 5.6579 5.6579 5.9819 5.9819 6.0221 6.0221 6.1184 6.1184 6.2799 6.2799 6.4411 6.4411 6.7402 6.7402 7.7820 7.7820 7.8990 7.8990 7.9123 7.9123 8.1272 8.1272 10.2537 10.2537 11.0751 11.0751 11.7876 11.7876 11.9112 11.9112 13.2376 13.2376 k = 0.0000 0.0625 0.3175 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9163 -2.9163 -1.8673 -1.8673 3.3125 3.3125 4.4545 4.4545 5.0484 5.0484 5.1117 5.1117 5.1541 5.1541 5.6561 5.6561 5.9646 5.9646 6.0072 6.0072 6.1146 6.1146 6.3122 6.3122 6.4407 6.4407 6.7245 6.7245 7.7620 7.7620 7.8239 7.8239 7.9076 7.9076 8.1432 8.1432 10.2661 10.2661 11.1211 11.1211 11.8507 11.8507 11.9723 11.9723 13.2159 13.2159 k = 0.0000 0.0750 0.3175 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9050 -2.9050 -1.8591 -1.8591 3.2998 3.2998 4.4541 4.4541 5.0448 5.0448 5.1124 5.1124 5.1580 5.1580 5.6539 5.6539 5.9417 5.9417 5.9969 5.9969 6.1105 6.1105 6.3424 6.3424 6.4419 6.4419 6.7060 6.7060 7.7160 7.7160 7.7546 7.7546 7.9103 7.9103 8.1639 8.1639 10.2792 10.2792 11.1635 11.1635 11.9264 11.9264 12.0483 12.0483 13.1862 13.1862 k = 0.0000 0.0875 0.3175 ( 5062 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.8917 -2.8917 -1.8496 -1.8496 3.2843 3.2843 4.4531 4.4531 5.0403 5.0403 5.1142 5.1142 5.1626 5.1626 5.6514 5.6514 5.9165 5.9165 5.9880 5.9880 6.1060 6.1060 6.3673 6.3673 6.4476 6.4476 6.6850 6.6850 7.6220 7.6220 7.7222 7.7222 7.9163 7.9163 8.1884 8.1884 10.2920 10.2920 11.1984 11.1984 12.0135 12.0135 12.1357 12.1357 13.1517 13.1517 k = 0.0000 0.1000 0.3175 ( 5062 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.8764 -2.8764 -1.8387 -1.8387 3.2662 3.2662 4.4514 4.4514 5.0351 5.0351 5.1174 5.1174 5.1679 5.1679 5.6484 5.6484 5.8906 5.8906 5.9787 5.9787 6.1008 6.1008 6.3824 6.3824 6.4615 6.4615 6.6622 6.6622 7.5189 7.5189 7.6934 7.6934 7.9250 7.9250 8.2161 8.2161 10.3038 10.3038 11.2239 11.2239 12.1104 12.1104 12.2267 12.2267 13.1227 13.1227 k = 0.0000 0.1125 0.3175 ( 5052 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.8592 -2.8592 -1.8267 -1.8267 3.2452 3.2452 4.4488 4.4488 5.0295 5.0295 5.1218 5.1218 5.1739 5.1739 5.6450 5.6450 5.8646 5.8646 5.9684 5.9684 6.0952 6.0952 6.3874 6.3874 6.4828 6.4828 6.6382 6.6382 7.4150 7.4150 7.6646 7.6646 7.9361 7.9361 8.2464 8.2464 10.3141 10.3141 11.2389 11.2389 12.2147 12.2147 12.3083 12.3083 13.1154 13.1154 k = 0.0000 0.1250 0.3175 ( 5052 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.8400 -2.8400 -1.8134 -1.8134 3.2213 3.2213 4.4447 4.4447 5.0241 5.0241 5.1272 5.1272 5.1806 5.1806 5.6412 5.6412 5.8385 5.8385 5.9566 5.9566 6.0889 6.0889 6.3860 6.3860 6.5051 6.5051 6.6146 6.6146 7.3143 7.3143 7.6364 7.6364 7.9493 7.9493 8.2789 8.2789 10.3223 10.3223 11.2432 11.2432 12.3211 12.3211 12.3671 12.3671 13.1472 13.1472 k = 0.0000 0.1375 0.3175 ( 5052 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.8189 -2.8189 -1.7992 -1.7992 3.1945 3.1945 4.4388 4.4388 5.0193 5.0193 5.1336 5.1336 5.1879 5.1879 5.6369 5.6369 5.8125 5.8125 5.9430 5.9430 6.0821 6.0821 6.3813 6.3813 6.5197 6.5197 6.5953 6.5953 7.2213 7.2213 7.6094 7.6094 7.9644 7.9644 8.3132 8.3132 10.3281 10.3281 11.2364 11.2364 12.3773 12.3773 12.4422 12.4422 13.2268 13.2268 k = 0.0000 0.1500 0.3175 ( 5042 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.7959 -2.7959 -1.7839 -1.7839 3.1648 3.1648 4.4307 4.4307 5.0156 5.0156 5.1409 5.1409 5.1960 5.1960 5.6322 5.6322 5.7864 5.7864 5.9276 5.9276 6.0746 6.0746 6.3746 6.3746 6.5159 6.5159 6.5869 6.5869 7.1410 7.1410 7.5843 7.5843 7.9813 7.9813 8.3491 8.3491 10.3311 10.3311 11.2178 11.2178 12.3710 12.3710 12.5454 12.5454 13.2446 13.2446 k = 0.0000 0.1625 0.3175 ( 5042 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5803 -33.5803 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.7710 -2.7710 -1.7679 -1.7679 3.1324 3.1324 4.4197 4.4197 5.0133 5.0133 5.1489 5.1489 5.2047 5.2047 5.6271 5.6271 5.7602 5.7602 5.9102 5.9102 6.0666 6.0666 6.3664 6.3664 6.4949 6.4949 6.5835 6.5835 7.0794 7.0794 7.5617 7.5617 7.9999 7.9999 8.3860 8.3860 10.3310 10.3310 11.1868 11.1868 12.3463 12.3463 12.6375 12.6375 13.2504 13.2504 k = 0.0000 0.1750 0.3175 ( 5040 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5803 -33.5803 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.7444 -2.7444 -1.7511 -1.7511 3.0972 3.0972 4.4051 4.4051 5.0127 5.0127 5.1576 5.1576 5.2141 5.2141 5.6214 5.6214 5.7337 5.7337 5.8909 5.8909 6.0581 6.0581 6.3571 6.3571 6.4663 6.4663 6.5716 6.5716 7.0418 7.0418 7.5418 7.5418 8.0201 8.0201 8.4238 8.4238 10.3276 10.3276 11.1430 11.1430 12.3163 12.3163 12.7087 12.7087 13.2322 13.2322 k = 0.0000 0.1875 0.3175 ( 5046 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2809 -33.2809 -33.2808 -33.2808 -2.7160 -2.7160 -1.7338 -1.7338 3.0597 3.0597 4.3863 4.3863 5.0142 5.0142 5.1669 5.1669 5.2240 5.2240 5.6149 5.6149 5.7071 5.7071 5.8700 5.8700 6.0490 6.0490 6.3465 6.3465 6.4347 6.4347 6.5464 6.5464 7.0299 7.0299 7.5250 7.5250 8.0418 8.0418 8.4622 8.4622 10.3206 10.3206 11.0863 11.0863 12.2885 12.2885 12.7547 12.7547 13.2007 13.2007 k = 0.0000 0.2000 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2809 -33.2809 -33.2808 -33.2808 -2.6860 -2.6860 -1.7161 -1.7161 3.0201 3.0201 4.3625 4.3625 5.0178 5.0178 5.1768 5.1768 5.2345 5.2345 5.6072 5.6072 5.6807 5.6807 5.8480 5.8480 6.0394 6.0394 6.3348 6.3348 6.4019 6.4019 6.5110 6.5110 7.0396 7.0396 7.5115 7.5115 8.0651 8.0651 8.5007 8.5007 10.3097 10.3097 11.0174 11.0174 12.2669 12.2669 12.7786 12.7786 13.1648 13.1648 k = 0.0000 0.2125 0.3175 ( 5048 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2809 -33.2809 -33.2808 -33.2808 -2.6543 -2.6543 -1.6982 -1.6982 2.9787 2.9787 4.3328 4.3328 5.0237 5.0237 5.1872 5.1872 5.2456 5.2456 5.5975 5.5975 5.6559 5.6559 5.8256 5.8256 6.0292 6.0292 6.3212 6.3212 6.3693 6.3693 6.4711 6.4711 7.0650 7.0650 7.5013 7.5013 8.0897 8.0897 8.5392 8.5392 10.2948 10.2948 10.9374 10.9374 12.2531 12.2531 12.7873 12.7873 13.1267 13.1267 k = 0.0000 0.2250 0.3175 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2809 -33.2809 -33.2808 -33.2808 -2.6210 -2.6210 -1.6803 -1.6803 2.9361 2.9361 4.2965 4.2965 5.0319 5.0319 5.1981 5.1981 5.2570 5.2570 5.5842 5.5842 5.6346 5.6346 5.8036 5.8036 6.0185 6.0185 6.3044 6.3044 6.3390 6.3390 6.4310 6.4310 7.1009 7.1009 7.4947 7.4947 8.1158 8.1158 8.5774 8.5774 10.2755 10.2755 10.8480 10.8480 12.2475 12.2475 12.7871 12.7871 13.0873 13.0873 k = 0.0000 0.2375 0.3175 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3025 -33.3025 -33.2809 -33.2809 -33.2809 -33.2809 -2.5862 -2.5862 -1.6626 -1.6626 2.8927 2.8927 4.2533 4.2533 5.0424 5.0424 5.2094 5.2094 5.2689 5.2689 5.5665 5.5665 5.6188 5.6188 5.7825 5.7825 6.0074 6.0074 6.2816 6.2816 6.3146 6.3146 6.3927 6.3927 7.1437 7.1437 7.4916 7.4916 8.1432 8.1432 8.6149 8.6149 10.2517 10.2517 10.7512 10.7512 12.2496 12.2496 12.7825 12.7825 13.0472 13.0472 k = 0.0000 0.2500 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5804 -33.5804 -33.3025 -33.3025 -33.3025 -33.3025 -33.2810 -33.2810 -33.2809 -33.2809 -2.5500 -2.5500 -1.6453 -1.6453 2.8490 2.8490 4.2027 4.2027 5.0552 5.0552 5.2211 5.2211 5.2810 5.2810 5.5464 5.5464 5.6076 5.6076 5.7627 5.7627 5.9957 5.9957 6.2534 6.2534 6.2958 6.2958 6.3573 6.3573 7.1913 7.1913 7.4920 7.4920 8.1718 8.1718 8.6515 8.6515 10.2232 10.2232 10.6487 10.6487 12.2586 12.2586 12.7764 12.7764 13.0071 13.0071 k = 0.0000 0.2625 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5804 -33.5804 -33.3025 -33.3025 -33.3025 -33.3025 -33.2810 -33.2810 -33.2809 -33.2809 -2.5125 -2.5125 -1.6287 -1.6287 2.8056 2.8056 4.1449 4.1449 5.0700 5.0700 5.2332 5.2332 5.2933 5.2933 5.5270 5.5270 5.5989 5.5989 5.7444 5.7444 5.9835 5.9835 6.2234 6.2234 6.2793 6.2793 6.3249 6.3249 7.2424 7.2424 7.4959 7.4959 8.2016 8.2016 8.6869 8.6869 10.1897 10.1897 10.5424 10.5424 12.2736 12.2736 12.7707 12.7707 12.9676 12.9676 k = 0.0000 0.2750 0.3175 ( 5058 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3026 -33.3026 -33.3025 -33.3025 -33.2810 -33.2810 -33.2810 -33.2810 -2.4737 -2.4737 -1.6129 -1.6129 2.7631 2.7631 4.0801 4.0801 5.0868 5.0868 5.2455 5.2455 5.3057 5.3057 5.5105 5.5105 5.5916 5.5916 5.7279 5.7279 5.9709 5.9709 6.1931 6.1931 6.2632 6.2632 6.2953 6.2953 7.2959 7.2959 7.5033 7.5033 8.2326 8.2326 8.7207 8.7207 10.1513 10.1513 10.4339 10.4339 12.2940 12.2940 12.7667 12.7667 12.9294 12.9294 k = 0.0000 0.2875 0.3175 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3026 -33.3026 -33.3025 -33.3025 -33.2811 -33.2811 -33.2810 -33.2810 -2.4337 -2.4337 -1.5983 -1.5983 2.7220 2.7220 4.0091 4.0091 5.1054 5.1054 5.2581 5.2581 5.3181 5.3181 5.4980 5.4980 5.5851 5.5851 5.7129 5.7129 5.9578 5.9578 6.1630 6.1630 6.2468 6.2468 6.2688 6.2688 7.3513 7.3513 7.5144 7.5144 8.2646 8.2646 8.7527 8.7527 10.1074 10.1074 10.3247 10.3247 12.3188 12.3188 12.7651 12.7651 12.8933 12.8933 k = 0.0000 0.3000 0.3175 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3026 -33.3026 -33.3025 -33.3025 -33.2811 -33.2811 -33.2810 -33.2810 -2.3928 -2.3928 -1.5851 -1.5851 2.6831 2.6831 3.9326 3.9326 5.1254 5.1254 5.2709 5.2709 5.3306 5.3306 5.4900 5.4900 5.5791 5.5791 5.6996 5.6996 5.9442 5.9442 6.1332 6.1332 6.2296 6.2296 6.2452 6.2452 7.4078 7.4078 7.5293 7.5293 8.2976 8.2976 8.7825 8.7825 10.0576 10.0576 10.2168 10.2168 12.3475 12.3475 12.7659 12.7659 12.8602 12.8602 k = 0.0000 0.3125 0.3175 ( 5068 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3026 -33.3026 -33.3025 -33.3025 -33.2811 -33.2811 -33.2811 -33.2811 -2.3509 -2.3509 -1.5735 -1.5735 2.6467 2.6467 3.8519 3.8519 5.1468 5.1468 5.2839 5.2839 5.3432 5.3432 5.4863 5.4863 5.5735 5.5735 5.6878 5.6878 5.9301 5.9301 6.1036 6.1036 6.2113 6.2113 6.2246 6.2246 7.4643 7.4643 7.5485 7.5485 8.3315 8.3315 8.8100 8.8100 10.0001 10.0001 10.1131 10.1131 12.3797 12.3797 12.7686 12.7686 12.8316 12.8316 k = 0.0000 0.3250 0.3175 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3025 -33.3025 -33.2811 -33.2811 -33.2811 -33.2811 -2.3082 -2.3082 -1.5639 -1.5639 2.6136 2.6136 3.7678 3.7678 5.1691 5.1691 5.2970 5.2970 5.3561 5.3561 5.4865 5.4865 5.5684 5.5684 5.6775 5.6775 5.9155 5.9155 6.0742 6.0742 6.1926 6.1926 6.2062 6.2062 7.5185 7.5185 7.5740 7.5740 8.3661 8.3661 8.8346 8.8346 9.9306 9.9306 10.0191 10.0191 12.4147 12.4147 12.7694 12.7694 12.8120 12.8120 k = 0.0000 0.3375 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3025 -33.3025 -33.2811 -33.2811 -33.2811 -33.2811 -2.2649 -2.2649 -1.5565 -1.5565 2.5842 2.5842 3.6814 3.6814 5.1921 5.1921 5.3101 5.3101 5.3693 5.3693 5.4899 5.4899 5.5638 5.5638 5.6687 5.6687 5.9005 5.9005 6.0452 6.0452 6.1743 6.1743 6.1888 6.1888 7.5644 7.5644 7.6112 7.6112 8.4013 8.4013 8.8563 8.8563 9.8459 9.8459 9.9391 9.9391 12.4522 12.4522 12.7607 12.7607 12.8094 12.8094 k = 0.0000 0.3500 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3025 -33.3025 -33.2812 -33.2812 -33.2811 -33.2811 -2.2211 -2.2211 -1.5515 -1.5515 2.5590 2.5590 3.5938 3.5938 5.2154 5.2154 5.3231 5.3231 5.3830 5.3830 5.4957 5.4957 5.5597 5.5597 5.6616 5.6616 5.8849 5.8849 6.0167 6.0167 6.1569 6.1569 6.1720 6.1720 7.6001 7.6001 7.6616 7.6616 8.4370 8.4370 8.8747 8.8747 9.7519 9.7519 9.8684 9.8684 12.4918 12.4918 12.7467 12.7467 12.8198 12.8198 k = 0.0000 0.3625 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2811 -33.2811 -2.1769 -2.1769 -1.5492 -1.5492 2.5386 2.5386 3.5059 3.5059 5.2388 5.2388 5.3361 5.3361 5.3973 5.3973 5.5029 5.5029 5.5564 5.5564 5.6561 5.6561 5.8687 5.8687 5.9887 5.9887 6.1403 6.1403 6.1555 6.1555 7.6326 7.6326 7.7175 7.7175 8.4731 8.4731 8.8896 8.8896 9.6563 9.6563 9.8007 9.8007 12.5331 12.5331 12.7348 12.7348 12.8359 12.8359 k = 0.0000 0.3750 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -2.1326 -2.1326 -1.5498 -1.5498 2.5234 2.5234 3.4184 3.4184 5.2619 5.2619 5.3490 5.3490 5.4122 5.4122 5.5105 5.5105 5.5542 5.5542 5.6525 5.6525 5.8521 5.8521 5.9615 5.9615 6.1247 6.1247 6.1393 6.1393 7.6659 7.6659 7.7742 7.7742 8.5093 8.5093 8.9008 8.9008 9.5633 9.5633 9.7334 9.7334 12.5757 12.5757 12.7275 12.7275 12.8550 12.8550 k = 0.0000 0.3875 0.3175 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -2.0884 -2.0884 -1.5534 -1.5534 2.5136 2.5136 3.3321 3.3321 5.2844 5.2844 5.3614 5.3614 5.4276 5.4276 5.5174 5.5174 5.5536 5.5536 5.6510 5.6510 5.8348 5.8348 5.9352 5.9352 6.1100 6.1100 6.1237 6.1237 7.7009 7.7009 7.8297 7.8297 8.5455 8.5455 8.9082 8.9082 9.4750 9.4750 9.6657 9.6657 12.6192 12.6192 12.7257 12.7257 12.8758 12.8758 k = 0.0000 0.4000 0.3175 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -2.0443 -2.0443 -1.5601 -1.5601 2.5097 2.5097 3.2477 3.2477 5.3059 5.3059 5.3733 5.3733 5.4434 5.4434 5.5224 5.5224 5.5553 5.5553 5.6519 5.6519 5.8170 5.8170 5.9100 5.9100 6.0963 6.0963 6.1087 6.1087 7.7377 7.7377 7.8827 7.8827 8.5813 8.5813 8.9116 8.9116 9.3930 9.3930 9.5980 9.5980 12.6630 12.6630 12.7301 12.7301 12.8971 12.8971 k = 0.0000 0.4125 0.3175 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -2.0008 -2.0008 -1.5701 -1.5701 2.5118 2.5118 3.1658 3.1658 5.3261 5.3261 5.3844 5.3844 5.4592 5.4592 5.5250 5.5250 5.5594 5.5594 5.6552 5.6552 5.7986 5.7986 5.8860 5.8860 6.0837 6.0837 6.0945 6.0945 7.7763 7.7763 7.9317 7.9317 8.6166 8.6166 8.9112 8.9112 9.3189 9.3189 9.5307 9.5307 12.7066 12.7066 12.7410 12.7410 12.9178 12.9178 k = 0.0000 0.4250 0.3175 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2812 -33.2812 -1.9578 -1.9578 -1.5833 -1.5833 2.5201 2.5201 3.0869 3.0869 5.3448 5.3448 5.3944 5.3944 5.4746 5.4746 5.5260 5.5260 5.5655 5.5655 5.6609 5.6609 5.7799 5.7799 5.8633 5.8633 6.0722 6.0722 6.0813 6.0813 7.8162 7.8162 7.9752 7.9752 8.6510 8.6510 8.9071 8.9071 9.2545 9.2545 9.4645 9.4645 12.7490 12.7490 12.7591 12.7591 12.9368 12.9368 k = 0.0000 0.4375 0.3175 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2812 -33.2812 -1.9159 -1.9159 -1.5998 -1.5998 2.5348 2.5348 3.0116 3.0116 5.3616 5.3616 5.4029 5.4029 5.4887 5.4887 5.5261 5.5261 5.5731 5.5731 5.6683 5.6683 5.7613 5.7613 5.8418 5.8418 6.0620 6.0620 6.0695 6.0695 7.8569 7.8569 8.0114 8.0114 8.6842 8.6842 8.8996 8.8996 9.2014 9.2014 9.4003 9.4003 12.7814 12.7814 12.7924 12.7924 12.9527 12.9527 k = 0.0000 0.4500 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.8750 -1.8750 -1.6196 -1.6196 2.5559 2.5559 2.9403 2.9403 5.3765 5.3765 5.4096 5.4096 5.5008 5.5008 5.5260 5.5260 5.5826 5.5826 5.6760 5.6760 5.7441 5.7441 5.8217 5.8217 6.0533 6.0533 6.0592 6.0592 7.8975 7.8975 8.0383 8.0383 8.7158 8.7158 8.8892 8.8892 9.1616 9.1616 9.3391 9.3391 12.8128 12.8128 12.8313 12.8313 12.9642 12.9642 k = 0.0000 0.4625 0.3175 ( 5046 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -1.8356 -1.8356 -1.6424 -1.6424 2.5833 2.5833 2.8734 2.8734 5.3892 5.3892 5.4141 5.4141 5.5102 5.5102 5.5258 5.5258 5.5946 5.5946 5.6802 5.6802 5.7319 5.7319 5.8027 5.8027 6.0464 6.0464 6.0507 6.0507 7.9370 7.9370 8.0543 8.0543 8.7454 8.7454 8.8761 8.8761 9.1365 9.1365 9.2822 9.2822 12.8505 12.8505 12.8676 12.8676 12.9703 12.9703 k = 0.0000 0.4750 0.3175 ( 5042 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -1.7978 -1.7978 -1.6683 -1.6683 2.6170 2.6170 2.8112 2.8112 5.3995 5.3995 5.4163 5.4163 5.5168 5.5168 5.5255 5.5255 5.6091 5.6091 5.6747 5.6747 5.7306 5.7306 5.7848 5.7848 6.0415 6.0415 6.0443 6.0443 7.9740 7.9740 8.0586 8.0586 8.7730 8.7730 8.8605 8.8605 9.1272 9.1272 9.2311 9.2311 12.8938 12.8938 12.9006 12.9006 12.9702 12.9702 k = 0.0000 0.4875 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -1.7620 -1.7620 -1.6970 -1.6970 2.6569 2.6569 2.7542 2.7542 5.4075 5.4075 5.4159 5.4159 5.5210 5.5210 5.5249 5.5249 5.6257 5.6257 5.6605 5.6605 5.7393 5.7393 5.7680 5.7680 6.0387 6.0387 6.0401 6.0401 8.0068 8.0068 8.0511 8.0511 8.7983 8.7983 8.8423 8.8423 9.1336 9.1336 9.1879 9.1879 12.9256 12.9256 12.9439 12.9439 12.9657 12.9657 k = 0.0000 0.5000 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -1.7283 -1.7283 -1.7283 -1.7283 2.7027 2.7027 2.7027 2.7027 5.4130 5.4130 5.4130 5.4130 5.5235 5.5235 5.5235 5.5235 5.6432 5.6432 5.6432 5.6432 5.7526 5.7526 5.7526 5.7526 6.0382 6.0382 6.0382 6.0382 8.0332 8.0332 8.0332 8.0332 8.8215 8.8215 8.8215 8.8215 9.1545 9.1545 9.1545 9.1545 12.9462 12.9462 12.9462 12.9462 13.0064 13.0064 k = 0.0000 0.5000 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -1.7283 -1.7283 -1.7283 -1.7283 2.7027 2.7027 2.7027 2.7027 5.4130 5.4130 5.4130 5.4130 5.5235 5.5235 5.5235 5.5235 5.6432 5.6432 5.6432 5.6432 5.7526 5.7526 5.7526 5.7526 6.0382 6.0382 6.0382 6.0382 8.0332 8.0332 8.0332 8.0332 8.8215 8.8215 8.8215 8.8215 9.1545 9.1545 9.1545 9.1545 12.9462 12.9462 12.9462 12.9462 13.0064 13.0064 k = 0.0125 0.5000 0.3175 ( 5048 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7276 -1.7276 -1.7275 -1.7275 2.7039 2.7039 2.7042 2.7042 5.4101 5.4101 5.4153 5.4153 5.5177 5.5177 5.5271 5.5271 5.6403 5.6403 5.6457 5.6457 5.7480 5.7480 5.7582 5.7582 6.0385 6.0385 6.0390 6.0390 8.0160 8.0160 8.0279 8.0279 8.7987 8.7987 8.8442 8.8442 9.1447 9.1447 9.1775 9.1775 12.8686 12.8686 12.8856 12.8856 13.0626 13.0626 k = 0.0250 0.5000 0.3175 ( 5052 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7255 -1.7255 -1.7254 -1.7254 2.7078 2.7078 2.7083 2.7083 5.4066 5.4066 5.4170 5.4170 5.5101 5.5101 5.5283 5.5283 5.6366 5.6366 5.6479 5.6479 5.7444 5.7444 5.7648 5.7648 6.0399 6.0399 6.0408 6.0408 7.9784 7.9784 8.0001 8.0001 8.7793 8.7793 8.8616 8.8616 9.1512 9.1512 9.2104 9.2104 12.7692 12.7692 12.7868 12.7868 13.1464 13.1464 k = 0.0375 0.5000 0.3175 ( 5048 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7220 -1.7220 -1.7218 -1.7218 2.7143 2.7143 2.7151 2.7151 5.4024 5.4024 5.4178 5.4178 5.5013 5.5013 5.5270 5.5270 5.6319 5.6319 5.6496 5.6496 5.7421 5.7421 5.7723 5.7723 6.0423 6.0423 6.0437 6.0437 7.9236 7.9236 7.9517 7.9517 8.7641 8.7641 8.8699 8.8699 9.1746 9.1746 9.2503 9.2503 12.6634 12.6634 12.6802 12.6802 13.2314 13.2314 k = 0.0500 0.5000 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7171 -1.7171 -1.7168 -1.7168 2.7235 2.7235 2.7245 2.7245 5.3974 5.3974 5.4176 5.4176 5.4918 5.4918 5.5237 5.5237 5.6259 5.6259 5.6506 5.6506 5.7413 5.7413 5.7805 5.7805 6.0455 6.0455 6.0475 6.0475 7.8550 7.8550 7.8864 7.8864 8.7520 8.7520 8.8691 8.8691 9.2119 9.2119 9.2950 9.2950 12.5535 12.5535 12.5689 12.5689 13.3193 13.3193 k = 0.0625 0.5000 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7108 -1.7108 -1.7105 -1.7105 2.7353 2.7353 2.7366 2.7366 5.3916 5.3916 5.4158 5.4158 5.4823 5.4823 5.5186 5.5186 5.6187 5.6187 5.6504 5.6504 5.7421 5.7421 5.7894 5.7894 6.0494 6.0494 6.0519 6.0519 7.7757 7.7757 7.8079 7.8079 8.7415 8.7415 8.8611 8.8611 9.2581 9.2581 9.3428 9.3428 12.4419 12.4419 12.4554 12.4554 13.4123 13.4123 k = 0.0750 0.5000 0.3175 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7031 -1.7031 -1.7028 -1.7028 2.7498 2.7498 2.7514 2.7514 5.3847 5.3847 5.4119 5.4119 5.4737 5.4737 5.5123 5.5123 5.6104 5.6104 5.6489 5.6489 5.7446 5.7446 5.7987 5.7987 6.0538 6.0538 6.0569 6.0569 7.6884 7.6884 7.7199 7.7199 8.7308 8.7308 8.8480 8.8480 9.3089 9.3089 9.3920 9.3920 12.3307 12.3307 12.3419 12.3419 13.5086 13.5086 k = 0.0875 0.5000 0.3175 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.6942 -1.6942 -1.6938 -1.6938 2.7669 2.7669 2.7687 2.7687 5.3766 5.3766 5.4053 5.4053 5.4664 5.4664 5.5049 5.5049 5.6013 5.6013 5.6461 5.6461 5.7484 5.7484 5.8082 5.8082 6.0585 6.0585 6.0622 6.0622 7.5955 7.5955 7.6251 7.6251 8.7186 8.7186 8.8308 8.8308 9.3615 9.3615 9.4417 9.4417 12.2219 12.2219 12.2305 12.2305 13.6120 13.6120 k = 0.1000 0.5000 0.3175 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.6839 -1.6839 -1.6834 -1.6834 2.7866 2.7866 2.7887 2.7887 5.3673 5.3673 5.3957 5.3957 5.4605 5.4605 5.4968 5.4968 5.5917 5.5917 5.6422 5.6422 5.7531 5.7531 5.8175 5.8175 6.0633 6.0633 6.0676 6.0676 7.4987 7.4987 7.5260 7.5260 8.7038 8.7038 8.8099 8.8099 9.4142 9.4142 9.4911 9.4911 12.1172 12.1172 12.1228 12.1228 13.7233 13.7233 k = 0.1125 0.5000 0.3175 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.6724 -1.6724 -1.6718 -1.6718 2.8088 2.8088 2.8112 2.8112 5.3565 5.3565 5.3835 5.3835 5.4554 5.4554 5.4880 5.4880 5.5821 5.5821 5.6378 5.6378 5.7581 5.7581 5.8265 5.8265 6.0680 6.0680 6.0729 6.0729 7.3999 7.3999 7.4245 7.4245 8.6857 8.6857 8.7850 8.7850 9.4659 9.4659 9.5396 9.5396 12.0181 12.0181 12.0206 12.0206 13.8420 13.8420 k = 0.1250 0.5000 0.3175 ( 5076 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.6596 -1.6596 -1.6591 -1.6591 2.8336 2.8336 2.8363 2.8363 5.3442 5.3442 5.3691 5.3691 5.4504 5.4504 5.4787 5.4787 5.5728 5.5728 5.6331 5.6331 5.7630 5.7630 5.8347 5.8347 6.0726 6.0726 6.0780 6.0780 7.3003 7.3003 7.3221 7.3221 8.6636 8.6636 8.7560 8.7560 9.5164 9.5164 9.5870 9.5870 11.9250 11.9250 11.9259 11.9259 13.9670 13.9670 k = 0.1375 0.5000 0.3175 ( 5076 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3027 -33.3027 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.6457 -1.6457 -1.6451 -1.6451 2.8610 2.8610 2.8640 2.8640 5.3303 5.3303 5.3528 5.3528 5.4445 5.4445 5.4688 5.4688 5.5646 5.5646 5.6285 5.6285 5.7672 5.7672 5.8418 5.8418 6.0769 6.0769 6.0827 6.0827 7.2015 7.2015 7.2203 7.2203 8.6370 8.6370 8.7225 8.7225 9.5653 9.5653 9.6332 9.6332 11.8372 11.8372 11.8415 11.8415 14.0967 14.0967 k = 0.1500 0.5000 0.3175 ( 5076 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5806 -33.5806 -33.3027 -33.3027 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.6307 -1.6307 -1.6300 -1.6300 2.8908 2.8908 2.8941 2.8941 5.3148 5.3148 5.3349 5.3349 5.4372 5.4372 5.4583 5.4583 5.5577 5.5577 5.6244 5.6244 5.7701 5.7701 5.8475 5.8475 6.0808 6.0808 6.0868 6.0868 7.1044 7.1044 7.1203 7.1203 8.6054 8.6054 8.6841 8.6841 9.6129 9.6129 9.6784 9.6784 11.7579 11.7579 11.7660 11.7660 14.2285 14.2285 k = 0.1625 0.5000 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.6146 -1.6146 -1.6139 -1.6139 2.9231 2.9231 2.9267 2.9267 5.2974 5.2974 5.3153 5.3153 5.4281 5.4281 5.4472 5.4472 5.5526 5.5526 5.6207 5.6207 5.7713 5.7713 5.8513 5.8513 6.0843 6.0843 6.0904 6.0904 7.0104 7.0104 7.0233 7.0233 8.5686 8.5686 8.6407 8.6407 9.6595 9.6595 9.7227 9.7227 11.6880 11.6880 11.6998 11.6998 14.3588 14.3588 k = 0.1750 0.5000 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5806 -33.5806 -33.3027 -33.3027 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.5976 -1.5976 -1.5968 -1.5968 2.9577 2.9577 2.9617 2.9617 5.2780 5.2780 5.2939 5.2939 5.4173 5.4173 5.4355 5.4355 5.5491 5.5491 5.6177 5.6177 5.7704 5.7704 5.8527 5.8527 6.0875 6.0875 6.0933 6.0933 6.9205 6.9205 6.9302 6.9302 8.5264 8.5264 8.5920 8.5920 9.7051 9.7051 9.7664 9.7664 11.6278 11.6278 11.6434 11.6434 14.4819 14.4819 k = 0.1875 0.5000 0.3175 ( 5068 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3026 -33.3026 -33.2815 -33.2815 -33.2815 -33.2815 -1.5796 -1.5796 -1.5789 -1.5789 2.9947 2.9947 2.9991 2.9991 5.2565 5.2565 5.2702 5.2702 5.4050 5.4050 5.4233 5.4233 5.5470 5.5470 5.6152 5.6152 5.7668 5.7668 5.8513 5.8513 6.0904 6.0904 6.0956 6.0956 6.8357 6.8357 6.8422 6.8422 8.4788 8.4788 8.5381 8.5381 9.7504 9.7504 9.8099 9.8099 11.5776 11.5776 11.5970 11.5970 14.5885 14.5885 k = 0.2000 0.5000 0.3175 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3026 -33.3026 -33.2815 -33.2815 -33.2815 -33.2815 -1.5609 -1.5609 -1.5601 -1.5601 3.0341 3.0341 3.0388 3.0388 5.2325 5.2325 5.2442 5.2442 5.3917 5.3917 5.4106 5.4106 5.5462 5.5462 5.6132 5.6132 5.7603 5.7603 5.8465 5.8465 6.0933 6.0933 6.0973 6.0973 6.7568 6.7568 6.7601 6.7601 8.4261 8.4261 8.4794 8.4794 9.7955 9.7955 9.8534 9.8534 11.5374 11.5374 11.5605 11.5605 14.6640 14.6640 k = 0.2125 0.5000 0.3175 ( 5068 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2815 -33.2815 -33.2815 -33.2815 -1.5414 -1.5414 -1.5406 -1.5406 3.0756 3.0756 3.0808 3.0808 5.2059 5.2059 5.2153 5.2153 5.3778 5.3778 5.3977 5.3977 5.5460 5.5460 5.6114 5.6114 5.7506 5.7506 5.8380 5.8380 6.0962 6.0962 6.0985 6.0985 6.6846 6.6846 6.6847 6.6847 8.3687 8.3687 8.4162 8.4162 9.8409 9.8409 9.8972 9.8972 11.5070 11.5070 11.5336 11.5336 14.6717 14.6717 k = 0.2250 0.5000 0.3175 ( 5068 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2815 -33.2815 -33.2815 -33.2815 -1.5213 -1.5213 -1.5204 -1.5204 3.1193 3.1193 3.1249 3.1249 5.1762 5.1762 5.1832 5.1832 5.3638 5.3638 5.3847 5.3847 5.5464 5.5464 5.6097 5.6097 5.7377 5.7377 5.8257 5.8257 6.0993 6.0993 6.0993 6.0993 6.6161 6.6161 6.6197 6.6197 8.3070 8.3070 8.3491 8.3491 9.8868 9.8868 9.9417 9.9417 11.4862 11.4862 11.5162 11.5162 14.6216 14.6216 k = 0.2375 0.5000 0.3175 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.5006 -1.5006 -1.4997 -1.4997 3.1650 3.1650 3.1711 3.1711 5.1432 5.1432 5.1478 5.1478 5.3499 5.3499 5.3717 5.3717 5.5468 5.5468 5.6078 5.6078 5.7220 5.7220 5.8097 5.8097 6.1000 6.1000 6.1026 6.1026 6.5549 6.5549 6.5619 6.5619 8.2418 8.2418 8.2788 8.2788 9.9336 9.9336 9.9871 9.9871 11.4743 11.4743 11.5075 11.5075 14.5395 14.5395 k = 0.2500 0.5000 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.4795 -1.4795 -1.4787 -1.4787 3.2128 3.2128 3.2194 3.2194 5.1069 5.1069 5.1090 5.1090 5.3365 5.3365 5.3590 5.3590 5.5471 5.5471 5.6050 5.6050 5.7042 5.7042 5.7905 5.7905 6.1004 6.1004 6.1062 6.1062 6.5007 6.5007 6.5111 6.5111 8.1739 8.1739 8.2061 8.2061 9.9814 9.9814 10.0337 10.0337 11.4710 11.4710 11.5071 11.5071 14.4403 14.4403 k = 0.2625 0.5000 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.4582 -1.4582 -1.4573 -1.4573 3.2623 3.2623 3.2695 3.2695 5.0669 5.0669 5.0673 5.0673 5.3236 5.3236 5.3465 5.3465 5.5468 5.5468 5.6007 5.6007 5.6857 5.6857 5.7689 5.7689 6.1008 6.1008 6.1099 6.1099 6.4530 6.4530 6.4667 6.4667 8.1041 8.1041 8.1320 8.1320 10.0304 10.0304 10.0815 10.0815 11.4755 11.4755 11.5144 11.5144 14.3321 14.3321 k = 0.2750 0.5000 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.4366 -1.4366 -1.4357 -1.4357 3.3136 3.3136 3.3213 3.3213 5.0217 5.0217 5.0245 5.0245 5.3113 5.3113 5.3345 5.3345 5.5459 5.5459 5.5938 5.5938 5.6679 5.6679 5.7458 5.7458 6.1009 6.1009 6.1135 6.1135 6.4110 6.4110 6.4279 6.4279 8.0334 8.0334 8.0572 8.0572 10.0807 10.0807 10.1308 10.1308 11.4872 11.4872 11.5287 11.5287 14.2191 14.2191 k = 0.2875 0.5000 0.3175 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.4150 -1.4150 -1.4141 -1.4141 3.3664 3.3664 3.3747 3.3747 4.9740 4.9740 4.9790 4.9790 5.2996 5.2996 5.3230 5.3230 5.5440 5.5440 5.5832 5.5832 5.6528 5.6528 5.7221 5.7221 6.1007 6.1007 6.1168 6.1168 6.3740 6.3740 6.3941 6.3941 7.9627 7.9627 7.9828 7.9828 10.1323 10.1323 10.1814 10.1814 11.5055 11.5055 11.5495 11.5495 14.1039 14.1039 k = 0.3000 0.5000 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3935 -1.3935 -1.3926 -1.3926 3.4205 3.4205 3.4296 3.4296 4.9243 4.9243 4.9314 4.9314 5.2887 5.2887 5.3121 5.3121 5.5409 5.5409 5.5684 5.5684 5.6411 5.6411 5.6985 5.6985 6.0998 6.0998 6.1193 6.1193 6.3413 6.3413 6.3643 6.3643 7.8928 7.8928 7.9097 7.9097 10.1854 10.1854 10.2335 10.2335 11.5297 11.5297 11.5759 11.5759 13.9884 13.9884 k = 0.3125 0.5000 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3722 -1.3722 -1.3713 -1.3713 3.4758 3.4758 3.4856 3.4856 4.8734 4.8734 4.8824 4.8824 5.2784 5.2784 5.3017 5.3017 5.5362 5.5362 5.5505 5.5505 5.6320 5.6320 5.6757 5.6757 6.0979 6.0979 6.1206 6.1206 6.3124 6.3124 6.3381 6.3381 7.8248 7.8248 7.8387 7.8387 10.2397 10.2397 10.2870 10.2870 11.5592 11.5592 11.6075 11.6075 13.8738 13.8738 k = 0.3250 0.5000 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3513 -1.3513 -1.3504 -1.3504 3.5320 3.5320 3.5426 3.5426 4.8222 4.8222 4.8330 4.8330 5.2687 5.2687 5.2920 5.2920 5.5298 5.5298 5.5307 5.5307 5.6243 5.6243 5.6541 5.6541 6.0946 6.0946 6.1200 6.1200 6.2873 6.2873 6.3152 6.3152 7.7593 7.7593 7.7705 7.7705 10.2952 10.2952 10.3417 10.3417 11.5933 11.5933 11.6436 11.6436 13.7612 13.7612 k = 0.3375 0.5000 0.3175 ( 5052 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3309 -1.3309 -1.3300 -1.3300 3.5886 3.5886 3.6001 3.6001 4.7715 4.7715 4.7840 4.7840 5.2597 5.2597 5.2829 5.2829 5.5101 5.5101 5.5214 5.5214 5.6168 5.6168 5.6338 5.6338 6.0895 6.0895 6.1166 6.1166 6.2662 6.2662 6.2954 6.2954 7.6970 7.6970 7.7059 7.7059 10.3518 10.3518 10.3974 10.3974 11.6313 11.6313 11.6835 11.6835 13.6516 13.6516 k = 0.3500 0.5000 0.3175 ( 5060 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.3112 -1.3112 -1.3104 -1.3104 3.6454 3.6454 3.6578 3.6578 4.7222 4.7222 4.7363 4.7363 5.2513 5.2513 5.2744 5.2744 5.4891 5.4891 5.5107 5.5107 5.6089 5.6089 5.6149 5.6149 6.0824 6.0824 6.1097 6.1097 6.2497 6.2497 6.2788 6.2788 7.6386 7.6386 7.6455 7.6455 10.4092 10.4092 10.4538 10.4538 11.6726 11.6726 11.7266 11.7266 13.5460 13.5460 k = 0.3625 0.5000 0.3175 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2923 -1.2923 -1.2915 -1.2915 3.7018 3.7018 3.7153 3.7153 4.6752 4.6752 4.6908 4.6908 5.2434 5.2434 5.2664 5.2664 5.4679 5.4679 5.4977 5.4977 5.5974 5.5974 5.6001 5.6001 6.0732 6.0732 6.0991 6.0991 6.2380 6.2380 6.2654 6.2654 7.5846 7.5846 7.5898 7.5898 10.4671 10.4671 10.5107 10.5107 11.7164 11.7164 11.7720 11.7720 13.4455 13.4455 k = 0.3750 0.5000 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2744 -1.2744 -1.2737 -1.2737 3.7572 3.7572 3.7718 3.7718 4.6313 4.6313 4.6484 4.6484 5.2361 5.2361 5.2591 5.2591 5.4462 5.4462 5.4821 5.4821 5.5812 5.5812 5.5904 5.5904 6.0621 6.0621 6.0855 6.0855 6.2305 6.2305 6.2551 6.2551 7.5353 7.5353 7.5390 7.5390 10.5251 10.5251 10.5675 10.5675 11.7618 11.7618 11.8189 11.8189 13.3513 13.3513 k = 0.3875 0.5000 0.3175 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2577 -1.2577 -1.2570 -1.2570 3.8109 3.8109 3.8266 3.8266 4.5914 4.5914 4.6100 4.6100 5.2293 5.2293 5.2523 5.2523 5.4239 5.4239 5.4636 5.4636 5.5665 5.5665 5.5799 5.5799 6.0498 6.0498 6.0699 6.0699 6.2264 6.2264 6.2474 6.2474 7.4909 7.4909 7.4934 7.4934 10.5827 10.5827 10.6237 10.6237 11.8079 11.8079 11.8662 11.8662 13.2646 13.2646 k = 0.4000 0.5000 0.3175 ( 5032 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2423 -1.2423 -1.2416 -1.2416 3.8621 3.8621 3.8787 3.8787 4.5565 4.5565 4.5764 4.5764 5.2228 5.2228 5.2460 5.2460 5.4008 5.4008 5.4425 5.4425 5.5534 5.5534 5.5688 5.5688 6.0371 6.0371 6.0537 6.0537 6.2246 6.2246 6.2420 6.2420 7.4515 7.4515 7.4531 7.4531 10.6394 10.6394 10.6787 10.6787 11.8536 11.8536 11.9124 11.9124 13.1872 13.1872 k = 0.4125 0.5000 0.3175 ( 5012 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2282 -1.2282 -1.2277 -1.2277 3.9096 3.9096 3.9269 3.9269 4.5274 4.5274 4.5481 4.5481 5.2167 5.2167 5.2399 5.2399 5.3771 5.3771 5.4189 5.4189 5.5420 5.5420 5.5577 5.5577 6.0247 6.0247 6.0382 6.0382 6.2241 6.2241 6.2382 6.2382 7.4171 7.4171 7.4181 7.4181 10.6944 10.6944 10.7314 10.7314 11.8975 11.8975 11.9561 11.9561 13.1208 13.1208 k = 0.4250 0.5000 0.3175 ( 5012 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2158 -1.2158 -1.2153 -1.2153 3.9523 3.9523 3.9700 3.9700 4.5048 4.5048 4.5259 4.5259 5.2109 5.2109 5.2340 5.2340 5.3532 5.3532 5.3937 5.3937 5.5324 5.5324 5.5471 5.5471 6.0133 6.0133 6.0241 6.0241 6.2246 6.2246 6.2357 6.2357 7.3878 7.3878 7.3882 7.3882 10.7467 10.7467 10.7808 10.7808 11.9383 11.9383 11.9953 11.9953 13.0676 13.0676 k = 0.4375 0.5000 0.3175 ( 5008 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2050 -1.2050 -1.2046 -1.2046 3.9893 3.9893 4.0065 4.0065 4.4893 4.4893 4.5099 4.5099 5.2053 5.2053 5.2278 5.2278 5.3302 5.3302 5.3681 5.3681 5.5246 5.5246 5.5373 5.5373 6.0034 6.0034 6.0117 6.0117 6.2254 6.2254 6.2341 6.2341 7.3633 7.3633 7.3634 7.3634 10.7952 10.7952 10.8258 10.8258 11.9745 11.9745 12.0282 12.0282 13.0295 13.0295 k = 0.4500 0.5000 0.3175 ( 5004 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1961 -1.1961 -1.1957 -1.1957 4.0198 4.0198 4.0355 4.0355 4.4809 4.4809 4.4997 4.4997 5.2000 5.2000 5.2208 5.2208 5.3099 5.3099 5.3435 5.3435 5.5185 5.5185 5.5289 5.5289 5.9952 5.9952 6.0015 6.0015 6.2265 6.2265 6.2330 6.2330 7.3434 7.3434 7.3435 7.3435 10.8387 10.8387 10.8648 10.8648 12.0051 12.0051 12.0529 12.0529 13.0085 13.0085 k = 0.4625 0.5000 0.3175 ( 5004 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1890 -1.1890 -1.1887 -1.1887 4.0433 4.0433 4.0563 4.0563 4.4786 4.4786 4.4942 4.4942 5.1951 5.1951 5.2127 5.2127 5.2943 5.2943 5.3216 5.3216 5.5140 5.5140 5.5218 5.5218 5.9889 5.9889 5.9935 5.9935 6.2275 6.2275 6.2322 6.2322 7.3281 7.3281 7.3282 7.3282 10.8757 10.8757 10.8964 10.8964 12.0296 12.0296 12.0688 12.0688 13.0054 13.0054 k = 0.4750 0.5000 0.3175 ( 5008 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1838 -1.1838 -1.1837 -1.1837 4.0602 4.0602 4.0695 4.0695 4.4805 4.4805 4.4917 4.4917 5.1914 5.1914 5.2039 5.2039 5.2846 5.2846 5.3039 5.3039 5.5113 5.5113 5.5164 5.5164 5.9847 5.9847 5.9876 5.9876 6.2285 6.2285 6.2315 6.2315 7.3173 7.3173 7.3174 7.3174 10.9047 10.9047 10.9192 10.9192 12.0483 12.0483 12.0762 12.0762 13.0200 13.0200 k = 0.4875 0.5000 0.3175 ( 5016 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1807 -1.1807 -1.1806 -1.1806 4.0710 4.0710 4.0758 4.0758 4.4842 4.4842 4.4900 4.4900 5.1897 5.1897 5.1961 5.1961 5.2812 5.2812 5.2910 5.2910 5.5101 5.5101 5.5127 5.5127 5.9824 5.9824 5.9838 5.9838 6.2294 6.2294 6.2309 6.2309 7.3109 7.3109 7.3110 7.3110 10.9243 10.9243 10.9318 10.9318 12.0620 12.0620 12.0766 12.0766 13.0499 13.0499 k = 0.5000 0.5000 0.3175 ( 5016 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1797 -1.1797 -1.1797 -1.1797 4.0762 4.0762 4.0762 4.0762 4.4877 4.4877 4.4877 4.4877 5.1911 5.1911 5.1911 5.1911 5.2834 5.2834 5.2834 5.2834 5.5106 5.5106 5.5106 5.5106 5.9821 5.9821 5.9821 5.9821 6.2302 6.2302 6.2302 6.2302 7.3088 7.3088 7.3088 7.3088 10.9335 10.9335 10.9335 10.9335 12.0715 12.0715 12.0715 12.0715 13.0832 13.0832 k = 0.5000 0.5000 0.3175 ( 5016 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1797 -1.1797 -1.1797 -1.1797 4.0762 4.0762 4.0762 4.0762 4.4877 4.4877 4.4877 4.4877 5.1911 5.1911 5.1911 5.1911 5.2834 5.2834 5.2834 5.2834 5.5106 5.5106 5.5106 5.5106 5.9821 5.9821 5.9821 5.9821 6.2302 6.2302 6.2302 6.2302 7.3088 7.3088 7.3088 7.3088 10.9335 10.9335 10.9335 10.9335 12.0715 12.0715 12.0715 12.0715 13.0832 13.0832 k = 0.4912 0.4912 0.3175 ( 5016 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1815 -1.1815 -1.1798 -1.1798 4.0688 4.0688 4.0782 4.0782 4.4838 4.4838 4.4903 4.4903 5.1896 5.1896 5.1961 5.1961 5.2811 5.2811 5.2910 5.2910 5.5101 5.5101 5.5127 5.5127 5.9821 5.9821 5.9841 5.9841 6.2295 6.2295 6.2309 6.2309 7.3089 7.3089 7.3129 7.3129 10.9244 10.9244 10.9318 10.9318 12.0618 12.0618 12.0771 12.0771 13.0366 13.0366 k = 0.4825 0.4825 0.3175 ( 5012 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1871 -1.1871 -1.1803 -1.1803 4.0491 4.0491 4.0824 4.0824 4.4771 4.4771 4.4936 4.4936 5.1912 5.1912 5.2039 5.2039 5.2840 5.2840 5.3042 5.3042 5.5112 5.5112 5.5165 5.5165 5.9829 5.9829 5.9893 5.9893 6.2286 6.2286 6.2315 6.2315 7.3094 7.3094 7.3251 7.3251 10.9046 10.9046 10.9193 10.9193 12.0468 12.0468 12.0809 12.0809 12.9787 12.9787 k = 0.4737 0.4737 0.3175 ( 5002 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1963 -1.1963 -1.1812 -1.1812 4.0177 4.0177 4.0894 4.0894 4.4674 4.4674 4.4982 4.4982 5.1946 5.1946 5.2126 5.2126 5.2923 5.2923 5.3230 5.3230 5.5139 5.5139 5.5224 5.5224 5.9844 5.9844 5.9981 5.9981 6.2276 6.2276 6.2320 6.2320 7.3100 7.3100 7.3456 7.3456 10.8746 10.8746 10.8962 10.8962 12.0280 12.0280 12.0845 12.0845 12.9285 12.9285 k = 0.4649 0.4649 0.3175 ( 5000 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2092 -1.2092 -1.1824 -1.1824 3.9765 3.9765 4.0991 4.0991 4.4553 4.4553 4.5045 4.5045 5.1990 5.1990 5.2206 5.2206 5.3055 5.3055 5.3471 5.3471 5.5184 5.5184 5.5306 5.5306 5.9864 5.9864 6.0109 6.0109 6.2266 6.2266 6.2324 6.2324 7.3110 7.3110 7.3744 7.3744 10.8351 10.8351 10.8632 10.8632 12.0082 12.0082 12.0886 12.0886 12.8882 12.8882 k = 0.4561 0.4561 0.3175 ( 5012 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2255 -1.2255 -1.1840 -1.1840 3.9276 3.9276 4.1115 4.1115 4.4417 4.4417 4.5125 4.5125 5.2037 5.2037 5.2269 5.2269 5.3215 5.3215 5.3754 5.3754 5.5248 5.5248 5.5413 5.5413 5.9891 5.9891 6.0283 6.0283 6.2256 6.2256 6.2329 6.2329 7.3122 7.3122 7.4117 7.4117 10.7867 10.7867 10.8211 10.8211 11.9902 11.9902 12.0935 12.0935 12.8579 12.8579 k = 0.4474 0.4474 0.3175 ( 5012 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2453 -1.2453 -1.1860 -1.1860 3.8729 3.8729 4.1267 4.1267 4.4273 4.4273 4.5222 4.5222 5.2087 5.2087 5.2319 5.2319 5.3381 5.3381 5.4060 5.4060 5.5336 5.5336 5.5545 5.5545 5.9923 5.9923 6.0506 6.0506 6.2246 6.2246 6.2333 6.2333 7.3137 7.3137 7.4576 7.4576 10.7304 10.7304 10.7712 10.7712 11.9760 11.9760 12.0993 12.0993 12.8375 12.8375 k = 0.4386 0.4386 0.3175 ( 5016 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2682 -1.2682 -1.1884 -1.1884 3.8141 3.8141 4.1445 4.1445 4.4131 4.4131 4.5336 4.5336 5.2137 5.2137 5.2360 5.2360 5.3530 5.3530 5.4366 5.4366 5.5456 5.5456 5.5699 5.5699 5.9961 5.9961 6.0784 6.0784 6.2239 6.2239 6.2340 6.2340 7.3155 7.3155 7.5120 7.5120 10.6674 10.6674 10.7149 10.7149 11.9669 11.9669 12.1060 12.1060 12.8263 12.8263 k = 0.4298 0.4298 0.3175 ( 5032 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.2943 -1.2943 -1.1914 -1.1914 3.7527 3.7527 4.1649 4.1649 4.3995 4.3995 4.5467 4.5467 5.2188 5.2188 5.2397 5.2397 5.3656 5.3656 5.4648 5.4648 5.5615 5.5615 5.5866 5.5866 6.0005 6.0005 6.1116 6.1116 6.2238 6.2238 6.2353 6.2353 7.3176 7.3176 7.5750 7.5750 10.5988 10.5988 10.6537 10.6537 11.9634 11.9634 12.1138 12.1138 12.8240 12.8240 k = 0.4211 0.4211 0.3175 ( 5032 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.3234 -1.3234 -1.1949 -1.1949 3.6900 3.6900 4.1879 4.1879 4.3873 4.3873 4.5615 4.5615 5.2239 5.2239 5.2433 5.2433 5.3756 5.3756 5.4888 5.4888 5.5816 5.5816 5.6036 5.6036 6.0054 6.0054 6.1487 6.1487 6.2250 6.2250 6.2385 6.2385 7.3199 7.3199 7.6462 7.6462 10.5257 10.5257 10.5889 10.5889 11.9656 11.9656 12.1226 12.1226 12.8298 12.8298 k = 0.4123 0.4123 0.3175 ( 5036 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.3551 -1.3551 -1.1991 -1.1991 3.6269 3.6269 4.2133 4.2133 4.3767 4.3767 4.5777 4.5777 5.2290 5.2290 5.2469 5.2469 5.3834 5.3834 5.5085 5.5085 5.6050 5.6050 5.6198 5.6198 6.0108 6.0108 6.1825 6.1825 6.2277 6.2277 6.2509 6.2509 7.3225 7.3225 7.7253 7.7253 10.4494 10.4494 10.5221 10.5221 11.9733 11.9733 12.1325 12.1325 12.8432 12.8432 k = 0.4035 0.4035 0.3175 ( 5036 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.3894 -1.3894 -1.2039 -1.2039 3.5644 3.5644 4.2407 4.2407 4.3683 4.3683 4.5954 4.5954 5.2337 5.2337 5.2509 5.2509 5.3895 5.3895 5.5250 5.5250 5.6281 5.6281 5.6361 5.6361 6.0166 6.0166 6.1997 6.1997 6.2301 6.2301 6.2876 6.2876 7.3255 7.3255 7.8117 7.8117 10.3708 10.3708 10.4545 10.4545 11.9862 11.9862 12.1436 12.1436 12.8636 12.8636 k = 0.3947 0.3947 0.3175 ( 5036 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.4261 -1.4261 -1.2093 -1.2093 3.5030 3.5030 4.2695 4.2695 4.3629 4.3629 4.6144 4.6144 5.2378 5.2378 5.2555 5.2555 5.3945 5.3945 5.5397 5.5397 5.6429 5.6429 5.6585 5.6585 6.0228 6.0228 6.2049 6.2049 6.2317 6.2317 6.3438 6.3438 7.3287 7.3287 7.9048 7.9048 10.2911 10.2911 10.3873 10.3873 12.0040 12.0040 12.1558 12.1558 12.8905 12.8905 k = 0.3860 0.3860 0.3175 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.4649 -1.4649 -1.2156 -1.2156 3.4435 3.4435 4.2973 4.2973 4.3629 4.3629 4.6347 4.6347 5.2411 5.2411 5.2609 5.2609 5.3987 5.3987 5.5538 5.5538 5.6521 5.6521 5.6829 5.6829 6.0293 6.0293 6.2065 6.2065 6.2332 6.2332 6.4098 6.4098 7.3323 7.3323 8.0038 8.0038 10.2111 10.2111 10.3215 10.3215 12.0263 12.0263 12.1695 12.1695 12.9234 12.9234 k = 0.3772 0.3772 0.3175 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2817 -33.2817 -33.2817 -33.2817 -1.5056 -1.5056 -1.2227 -1.2227 3.3861 3.3861 4.3181 4.3181 4.3742 4.3742 4.6561 4.6561 5.2433 5.2433 5.2671 5.2671 5.4024 5.4024 5.5676 5.5676 5.6582 5.6582 5.7068 5.7068 6.0362 6.0362 6.2071 6.2071 6.2349 6.2349 6.4816 6.4816 7.3361 7.3361 8.1077 8.1077 10.1316 10.1316 10.2583 10.2583 12.0526 12.0526 12.1848 12.1848 12.9620 12.9620 k = 0.3684 0.3684 0.3175 ( 5038 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3026 -33.3026 -33.2817 -33.2817 -33.2817 -33.2817 -1.5481 -1.5481 -1.2306 -1.2306 3.3315 3.3315 4.3274 4.3274 4.4013 4.4013 4.6786 4.6786 5.2447 5.2447 5.2740 5.2740 5.4059 5.4059 5.5815 5.5815 5.6616 5.6616 5.7302 5.7302 6.0432 6.0432 6.2074 6.2074 6.2372 6.2372 6.5572 6.5572 7.3403 7.3403 8.2156 8.2156 10.0535 10.0535 10.1987 10.1987 12.0822 12.0822 12.2023 12.2023 13.0057 13.0057 k = 0.3596 0.3596 0.3175 ( 5046 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3026 -33.3026 -33.2817 -33.2817 -33.2816 -33.2816 -1.5920 -1.5920 -1.2395 -1.2395 3.2798 3.2798 4.3311 4.3311 4.4381 4.4381 4.7018 4.7018 5.2451 5.2451 5.2814 5.2814 5.4094 5.4094 5.5955 5.5955 5.6628 5.6628 5.7533 5.7533 6.0505 6.0505 6.2076 6.2076 6.2401 6.2401 6.6350 6.6350 7.3448 7.3448 8.3263 8.3263 9.9776 9.9776 10.1437 10.1437 12.1141 12.1141 12.2230 12.2230 13.0544 13.0544 k = 0.3509 0.3509 0.3175 ( 5054 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3026 -33.3026 -33.2816 -33.2816 -33.2816 -33.2816 -1.6373 -1.6373 -1.2494 -1.2494 3.2313 3.2313 4.3339 4.3339 4.4797 4.4797 4.7258 4.7258 5.2447 5.2447 5.2892 5.2892 5.4128 5.4128 5.6090 5.6090 5.6626 5.6626 5.7765 5.7765 6.0579 6.0579 6.2078 6.2078 6.2441 6.2441 6.7134 6.7134 7.3497 7.3497 8.4382 8.4382 9.9047 9.9047 10.0943 10.0943 12.1467 12.1467 12.2485 12.2485 13.1076 13.1076 k = 0.3421 0.3421 0.3175 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.6836 -1.6836 -1.2602 -1.2602 3.1864 3.1864 4.3370 4.3370 4.5247 4.5247 4.7502 4.7502 5.2435 5.2435 5.2974 5.2974 5.4163 5.4163 5.6207 5.6207 5.6628 5.6628 5.8001 5.8001 6.0654 6.0654 6.2082 6.2082 6.2493 6.2493 6.7912 6.7912 7.3549 7.3549 8.5498 8.5498 9.8362 9.8362 10.0517 10.0517 12.1777 12.1777 12.2810 12.2810 13.1650 13.1650 k = 0.3333 0.3333 0.3175 ( 5078 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3027 -33.3027 -33.2816 -33.2816 -33.2816 -33.2816 -1.7308 -1.7308 -1.2721 -1.2721 3.1451 3.1451 4.3410 4.3410 4.5723 4.5723 4.7750 4.7750 5.2416 5.2416 5.3059 5.3059 5.4198 5.4198 5.6274 5.6274 5.6672 5.6672 5.8245 5.8245 6.0731 6.0731 6.2086 6.2086 6.2558 6.2558 6.8669 6.8669 7.3605 7.3605 8.6586 8.6586 9.7735 9.7735 10.0168 10.0168 12.2055 12.2055 12.3223 12.3223 13.2264 13.2264 k = 0.3246 0.3246 0.3175 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3026 -33.3026 -33.2816 -33.2816 -33.2815 -33.2815 -1.7787 -1.7787 -1.2850 -1.2850 3.1076 3.1076 4.3457 4.3457 4.6223 4.6223 4.7999 4.7999 5.2388 5.2388 5.3146 5.3146 5.4231 5.4231 5.6269 5.6269 5.6783 5.6783 5.8501 5.8501 6.0808 6.0808 6.2092 6.2092 6.2640 6.2640 6.9393 6.9393 7.3664 7.3664 8.7617 8.7617 9.7193 9.7193 9.9909 9.9909 12.2300 12.2300 12.3724 12.3724 13.2913 13.2913 k = 0.3158 0.3158 0.3175 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5807 -33.5807 -33.3027 -33.3027 -33.3026 -33.3026 -33.2816 -33.2816 -33.2815 -33.2815 -1.8272 -1.8272 -1.2989 -1.2989 3.0740 3.0740 4.3513 4.3513 4.6745 4.6745 4.8247 4.8247 5.2353 5.2353 5.3234 5.3234 5.4260 5.4260 5.6220 5.6220 5.6938 5.6938 5.8771 5.8771 6.0886 6.0886 6.2100 6.2100 6.2740 6.2740 7.0070 7.0070 7.3728 7.3728 8.8545 8.8545 9.6771 9.6771 9.9750 9.9750 12.2522 12.2522 12.4305 12.4305 13.3594 13.3594 k = 0.3070 0.3070 0.3175 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5806 -33.5806 -33.3027 -33.3027 -33.3026 -33.3026 -33.2815 -33.2815 -33.2815 -33.2815 -1.8760 -1.8760 -1.3139 -1.3139 3.0443 3.0443 4.3575 4.3575 4.7286 4.7286 4.8492 4.8492 5.2312 5.2312 5.3324 5.3324 5.4284 5.4284 5.6154 5.6154 5.7117 5.7117 5.9059 5.9059 6.0964 6.0964 6.2113 6.2113 6.2860 6.2860 7.0687 7.0687 7.3796 7.3796 8.9308 8.9308 9.6525 9.6525 9.9701 9.9701 12.2730 12.2730 12.4959 12.4959 13.4302 13.4302 k = 0.2982 0.2982 0.3175 ( 5050 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5807 -33.5807 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2815 -33.2815 -33.2814 -33.2814 -1.9249 -1.9249 -1.3299 -1.3299 3.0187 3.0187 4.3643 4.3643 4.7845 4.7845 4.8732 4.8732 5.2264 5.2264 5.3414 5.3414 5.4299 5.4299 5.6086 5.6086 5.7311 5.7311 5.9365 5.9365 6.1040 6.1040 6.2131 6.2131 6.3002 6.3002 7.1236 7.1236 7.3868 7.3868 8.9835 8.9835 9.6518 9.6518 9.9772 9.9772 12.2930 12.2930 12.5680 12.5680 13.5030 13.5030 k = 0.2895 0.2895 0.3175 ( 5042 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2814 -33.2814 -1.9739 -1.9739 -1.3469 -1.3469 2.9970 2.9970 4.3714 4.3714 4.8419 4.8419 4.8965 4.8965 5.2212 5.2212 5.3501 5.3501 5.4303 5.4303 5.6025 5.6025 5.7515 5.7515 5.9691 5.9691 6.1113 6.1113 6.2156 6.2156 6.3168 6.3168 7.1707 7.1707 7.3945 7.3945 9.0081 9.0081 9.6784 9.6784 9.9969 9.9969 12.3126 12.3126 12.6465 12.6465 13.5768 13.5768 k = 0.2807 0.2807 0.3175 ( 5042 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2813 -33.2813 -2.0227 -2.0227 -1.3648 -1.3648 2.9793 2.9793 4.3787 4.3787 4.9005 4.9005 4.9190 4.9190 5.2155 5.2155 5.3582 5.3582 5.4298 5.4298 5.5979 5.5979 5.7728 5.7728 6.0039 6.0039 6.1180 6.1180 6.2190 6.2190 6.3360 6.3360 7.2095 7.2095 7.4027 7.4027 9.0064 9.0064 9.7299 9.7299 10.0297 10.0297 12.3318 12.3318 12.7313 12.7313 13.6503 13.6503 k = 0.2719 0.2719 0.3175 ( 5048 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2814 -33.2814 -33.2813 -33.2813 -2.0713 -2.0713 -1.3836 -1.3836 2.9655 2.9655 4.3861 4.3861 4.9396 4.9396 4.9606 4.9606 5.2098 5.2098 5.3647 5.3647 5.4288 5.4288 5.5954 5.5954 5.7950 5.7950 6.0409 6.0409 6.1241 6.1241 6.2236 6.2236 6.3580 6.3580 7.2396 7.2396 7.4115 7.4115 8.9849 8.9849 9.7987 9.7987 10.0758 10.0758 12.3508 12.3508 12.8223 12.8223 13.7216 13.7216 k = 0.2632 0.2632 0.3175 ( 5046 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -2.1194 -2.1194 -1.4032 -1.4032 2.9555 2.9555 4.3934 4.3934 4.9596 4.9596 5.0202 5.0202 5.2044 5.2044 5.3684 5.3684 5.4289 5.4289 5.5951 5.5951 5.8181 5.8181 6.0798 6.0798 6.1294 6.1294 6.2296 6.2296 6.3831 6.3831 7.2612 7.2612 7.4209 7.4209 8.9507 8.9507 9.8770 9.8770 10.1348 10.1348 12.3694 12.3694 12.9190 12.9190 13.7873 13.7873 k = 0.2544 0.2544 0.3175 ( 5058 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -2.1669 -2.1669 -1.4236 -1.4236 2.9492 2.9492 4.4006 4.4006 4.9780 4.9780 5.0784 5.0784 5.2008 5.2008 5.3676 5.3676 5.4319 5.4319 5.5971 5.5971 5.8419 5.8419 6.1202 6.1202 6.1341 6.1341 6.2372 6.2372 6.4114 6.4114 7.2747 7.2747 7.4309 7.4309 8.9089 8.9089 9.9591 9.9591 10.2061 10.2061 12.3875 12.3875 13.0209 13.0209 13.8427 13.8427 k = 0.2456 0.2456 0.3175 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2812 -33.2812 -2.2138 -2.2138 -1.4446 -1.4446 2.9464 2.9464 4.4075 4.4075 4.9949 4.9949 5.1285 5.1285 5.2053 5.2053 5.3620 5.3620 5.4384 5.4384 5.6010 5.6010 5.8667 5.8667 6.1364 6.1364 6.1628 6.1628 6.2474 6.2474 6.4430 6.4430 7.2806 7.2806 7.4416 7.4416 8.8628 8.8628 10.0410 10.0410 10.2888 10.2888 12.4051 12.4051 13.1267 13.1267 13.8804 13.8804 k = 0.2368 0.2368 0.3175 ( 5054 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3025 -33.3025 -33.2812 -33.2812 -33.2812 -33.2812 -2.2599 -2.2599 -1.4662 -1.4662 2.9470 2.9470 4.4140 4.4140 5.0101 5.0101 5.1523 5.1523 5.2356 5.2356 5.3528 5.3528 5.4480 5.4480 5.6067 5.6067 5.8925 5.8925 6.1390 6.1390 6.2026 6.2026 6.2621 6.2621 6.4782 6.4782 7.2800 7.2800 7.4532 7.4532 8.8144 8.8144 10.1202 10.1202 10.3818 10.3818 12.4220 12.4220 13.2339 13.2339 13.8909 13.8909 k = 0.2281 0.2281 0.3175 ( 5046 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3025 -33.3025 -33.2812 -33.2812 -33.2811 -33.2811 -2.3051 -2.3051 -1.4882 -1.4882 2.9508 2.9508 4.4202 4.4202 5.0237 5.0237 5.1535 5.1535 5.2877 5.2877 5.3413 5.3413 5.4599 5.4599 5.6139 5.6139 5.9195 5.9195 6.1406 6.1406 6.2342 6.2342 6.2877 6.2877 6.5169 6.5169 7.2740 7.2740 7.4655 7.4655 8.7649 8.7649 10.1949 10.1949 10.4840 10.4840 12.4379 12.4379 13.3378 13.3378 13.8656 13.8656 k = 0.2193 0.2193 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3026 -33.3026 -33.3025 -33.3025 -33.2812 -33.2812 -33.2811 -33.2811 -2.3493 -2.3493 -1.5106 -1.5106 2.9576 2.9576 4.4258 4.4258 5.0357 5.0357 5.1481 5.1481 5.3284 5.3284 5.3448 5.3448 5.4737 5.4737 5.6223 5.6223 5.9479 5.9479 6.1416 6.1416 6.2539 6.2539 6.3271 6.3271 6.5591 6.5591 7.2637 7.2637 7.4787 7.4787 8.7150 8.7150 10.2634 10.2634 10.5945 10.5945 12.4527 12.4527 13.4290 13.4290 13.8027 13.8027 k = 0.2105 0.2105 0.3175 ( 5052 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3026 -33.3026 -33.3025 -33.3025 -33.2811 -33.2811 -33.2811 -33.2811 -2.3924 -2.3924 -1.5333 -1.5333 2.9671 2.9671 4.4310 4.4310 5.0459 5.0459 5.1408 5.1408 5.3151 5.3151 5.4004 5.4004 5.4901 5.4901 5.6319 5.6319 5.9778 5.9778 6.1420 6.1420 6.2679 6.2679 6.3733 6.3733 6.6048 6.6048 7.2506 7.2506 7.4929 7.4929 8.6651 8.6651 10.3247 10.3247 10.7123 10.7123 12.4659 12.4659 13.4922 13.4922 13.7080 13.7080 k = 0.2018 0.2018 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3025 -33.3025 -33.3025 -33.3025 -33.2811 -33.2811 -33.2810 -33.2810 -2.4343 -2.4343 -1.5560 -1.5560 2.9792 2.9792 4.4356 4.4356 5.0544 5.0544 5.1330 5.1330 5.3016 5.3016 5.4499 5.4499 5.5119 5.5119 5.6425 5.6425 6.0097 6.0097 6.1421 6.1421 6.2800 6.2800 6.4216 6.4216 6.6539 6.6539 7.2362 7.2362 7.5081 7.5081 8.6156 8.6156 10.3779 10.3779 10.8366 10.8366 12.4774 12.4774 13.5122 13.5122 13.5926 13.5926 k = 0.1930 0.1930 0.3175 ( 5052 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5804 -33.5804 -33.3026 -33.3026 -33.3025 -33.3025 -33.2811 -33.2811 -33.2810 -33.2810 -2.4749 -2.4749 -1.5788 -1.5788 2.9936 2.9936 4.4397 4.4397 5.0612 5.0612 5.1253 5.1253 5.2883 5.2883 5.4859 5.4859 5.5448 5.5448 5.6542 5.6542 6.0438 6.0438 6.1418 6.1418 6.2914 6.2914 6.4695 6.4695 6.7061 6.7061 7.2221 7.2221 7.5245 7.5245 8.5667 8.5667 10.4224 10.4224 10.9664 10.9664 12.4866 12.4866 13.4457 13.4457 13.5109 13.5109 k = 0.1842 0.1842 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5804 -33.5804 -33.3025 -33.3025 -33.3025 -33.3025 -33.2810 -33.2810 -33.2809 -33.2809 -2.5143 -2.5143 -1.6014 -1.6014 3.0099 3.0099 4.4433 4.4433 5.0662 5.0662 5.1181 5.1181 5.2754 5.2754 5.5091 5.5091 5.5871 5.5871 5.6676 5.6676 6.0802 6.0802 6.1414 6.1414 6.3023 6.3023 6.5150 6.5150 6.7614 6.7614 7.2106 7.2106 7.5421 7.5421 8.5184 8.5184 10.4581 10.4581 11.1008 11.1008 12.4932 12.4932 13.3061 13.3061 13.4719 13.4719 k = 0.1754 0.1754 0.3175 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5804 -33.5804 -33.3025 -33.3025 -33.3025 -33.3025 -33.2810 -33.2810 -33.2809 -33.2809 -2.5522 -2.5522 -1.6239 -1.6239 3.0280 3.0280 4.4464 4.4464 5.0691 5.0691 5.1119 5.1119 5.2630 5.2630 5.5268 5.5268 5.6293 5.6293 5.6838 5.6838 6.1188 6.1188 6.1413 6.1413 6.3130 6.3130 6.5560 6.5560 6.8196 6.8196 7.2039 7.2039 7.5612 7.5612 8.4709 8.4709 10.4847 10.4847 11.2389 11.2389 12.4964 12.4964 13.1574 13.1574 13.4290 13.4290 k = 0.1667 0.1667 0.3175 ( 5036 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3025 -33.3025 -33.2809 -33.2809 -33.2809 -33.2809 -2.5886 -2.5886 -1.6460 -1.6460 3.0475 3.0475 4.4489 4.4489 5.0697 5.0697 5.1074 5.1074 5.2512 5.2512 5.5424 5.5424 5.6644 5.6644 5.7058 5.7058 6.1385 6.1385 6.1625 6.1625 6.3234 6.3234 6.5901 6.5901 6.8802 6.8802 7.2046 7.2046 7.5818 7.5818 8.4243 8.4243 10.5026 10.5026 11.3798 11.3798 12.4955 12.4955 13.0056 13.0056 13.3868 13.3868 k = 0.1579 0.1579 0.3175 ( 5036 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3025 -33.3025 -33.2809 -33.2809 -33.2808 -33.2808 -2.6235 -2.6235 -1.6676 -1.6676 3.0682 3.0682 4.4511 4.4511 5.0682 5.0682 5.1047 5.1047 5.2401 5.2401 5.5568 5.5568 5.6894 5.6894 5.7355 5.7355 6.1382 6.1382 6.2060 6.2060 6.3335 6.3335 6.6148 6.6148 6.9432 6.9432 7.2153 7.2153 7.6041 7.6041 8.3785 8.3785 10.5121 10.5121 11.5227 11.5227 12.4896 12.4896 12.8534 12.8534 13.3366 13.3366 k = 0.1491 0.1491 0.3175 ( 5040 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2809 -33.2809 -33.2808 -33.2808 -2.6568 -2.6568 -1.6888 -1.6888 3.0896 3.0896 4.4528 4.4528 5.0651 5.0651 5.1034 5.1034 5.2297 5.2297 5.5702 5.5702 5.7090 5.7090 5.7677 5.7677 6.1373 6.1373 6.2518 6.2518 6.3434 6.3434 6.6289 6.6289 7.0082 7.0082 7.2374 7.2374 7.6281 7.6281 8.3337 8.3337 10.5138 10.5138 11.6667 11.6667 12.4764 12.4764 12.7037 12.7037 13.2071 13.2071 k = 0.1404 0.1404 0.3175 ( 5046 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2809 -33.2809 -33.2808 -33.2808 -2.6884 -2.6884 -1.7092 -1.7092 3.1117 3.1117 4.4541 4.4541 5.0613 5.0613 5.1030 5.1030 5.2200 5.2200 5.5826 5.5826 5.7273 5.7273 5.7986 5.7986 6.1362 6.1362 6.2983 6.2983 6.3534 6.3534 6.6320 6.6320 7.0748 7.0748 7.2712 7.2712 7.6540 7.6540 8.2900 8.2900 10.5085 10.5085 11.8106 11.8106 12.4480 12.4480 12.5655 12.5655 13.0715 13.0715 k = 0.1316 0.1316 0.3175 ( 5044 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2808 -33.2808 -2.7184 -2.7184 -1.7289 -1.7289 3.1340 3.1340 4.4551 4.4551 5.0575 5.0575 5.1030 5.1030 5.2110 5.2110 5.5941 5.5941 5.7459 5.7459 5.8267 5.8267 6.1352 6.1352 6.3419 6.3419 6.3663 6.3663 6.6255 6.6255 7.1426 7.1426 7.3154 7.3154 7.6818 7.6818 8.2474 8.2474 10.4972 10.4972 11.9524 11.9524 12.3662 12.3662 12.4782 12.4782 12.9360 12.9360 k = 0.1228 0.1228 0.3175 ( 5048 PWs) bands (ev): -66.6353 -66.6353 -66.6352 -66.6352 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.7466 -2.7466 -1.7478 -1.7478 3.1562 3.1562 4.4558 4.4558 5.0541 5.0541 5.1031 5.1031 5.2026 5.2026 5.6045 5.6045 5.7653 5.7653 5.8520 5.8520 6.1340 6.1340 6.3642 6.3642 6.3992 6.3992 6.6115 6.6115 7.2110 7.2110 7.3681 7.3681 7.7116 7.7116 8.2062 8.2062 10.4809 10.4809 12.0832 12.0832 12.2433 12.2433 12.4379 12.4379 12.8022 12.8022 k = 0.1140 0.1140 0.3175 ( 5056 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5804 -33.5804 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.7730 -2.7730 -1.7657 -1.7657 3.1781 3.1781 4.4563 4.4563 5.0513 5.0513 5.1033 5.1033 5.1948 5.1948 5.6139 5.6139 5.7857 5.7857 5.8747 5.8747 6.1329 6.1329 6.3735 6.3735 6.4424 6.4424 6.5926 6.5926 7.2794 7.2794 7.4272 7.4272 7.7433 7.7433 8.1663 8.1663 10.4606 10.4606 12.0723 12.0723 12.2465 12.2465 12.4076 12.4076 12.6715 12.6715 k = 0.1053 0.1053 0.3175 ( 5052 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5803 -33.5803 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.7977 -2.7977 -1.7827 -1.7827 3.1995 3.1995 4.4565 4.4565 5.0493 5.0493 5.1035 5.1035 5.1877 5.1877 5.6223 5.6223 5.8072 5.8072 5.8948 5.8948 6.1318 6.1318 6.3805 6.3805 6.4821 6.4821 6.5727 6.5727 7.3472 7.3472 7.4907 7.4907 7.7768 7.7768 8.1282 8.1282 10.4374 10.4374 11.9431 11.9431 12.3102 12.3102 12.4280 12.4280 12.5465 12.5465 k = 0.0965 0.0965 0.3175 ( 5046 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.8204 -2.8204 -1.7985 -1.7985 3.2200 3.2200 4.4566 4.4566 5.0481 5.0481 5.1038 5.1038 5.1812 5.1812 5.6296 5.6296 5.8297 5.8297 5.9128 5.9128 6.1306 6.1306 6.3859 6.3859 6.5055 6.5055 6.5647 6.5647 7.4138 7.4138 7.5568 7.5568 7.8117 7.8117 8.0919 8.0919 10.4125 10.4125 11.8113 11.8113 12.2803 12.2803 12.4178 12.4178 12.5480 12.5480 k = 0.0877 0.0877 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2808 -33.2808 -33.2807 -33.2807 -2.8413 -2.8413 -1.8132 -1.8132 3.2394 3.2394 4.4565 4.4565 5.0476 5.0476 5.1042 5.1042 5.1752 5.1752 5.6360 5.6360 5.8531 5.8531 5.9288 5.9288 6.1295 6.1295 6.3891 6.3891 6.4956 6.4956 6.5864 6.5864 7.4784 7.4784 7.6239 7.6239 7.8478 7.8478 8.0579 8.0579 10.3866 10.3866 11.6839 11.6839 12.2289 12.2289 12.3036 12.3036 12.6725 12.6725 k = 0.0789 0.0789 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.8603 -2.8603 -1.8267 -1.8267 3.2576 3.2576 4.4563 4.4563 5.0477 5.0477 5.1048 5.1048 5.1698 5.1698 5.6415 5.6415 5.8775 5.8775 5.9430 5.9430 6.1284 6.1284 6.3887 6.3887 6.4741 6.4741 6.6182 6.6182 7.5401 7.5401 7.6906 7.6906 7.8845 7.8845 8.0265 8.0265 10.3608 10.3608 11.5626 11.5626 12.1712 12.1712 12.1948 12.1948 12.7957 12.7957 k = 0.0702 0.0702 0.3175 ( 5054 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.8773 -2.8773 -1.8389 -1.8389 3.2743 3.2743 4.4561 4.4561 5.0482 5.0482 5.1057 5.1057 5.1649 5.1649 5.6462 5.6462 5.9028 5.9028 5.9555 5.9555 6.1274 6.1274 6.3811 6.3811 6.4553 6.4553 6.6492 6.6492 7.5981 7.5981 7.7553 7.7553 7.9207 7.9207 7.9987 7.9987 10.3358 10.3358 11.4488 11.4488 12.0927 12.0927 12.1121 12.1121 12.9123 12.9123 k = 0.0614 0.0614 0.3175 ( 5046 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.8924 -2.8924 -1.8498 -1.8498 3.2893 3.2893 4.4558 4.4558 5.0491 5.0491 5.1068 5.1068 5.1605 5.1605 5.6501 5.6501 5.9286 5.9286 5.9667 5.9667 6.1264 6.1264 6.3635 6.3635 6.4446 6.4446 6.6772 6.6772 7.6513 7.6513 7.8164 7.8164 7.9512 7.9512 7.9797 7.9797 10.3123 10.3123 11.3437 11.3437 12.0003 12.0003 12.0523 12.0523 13.0188 13.0188 k = 0.0526 0.0526 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9055 -2.9055 -1.8594 -1.8594 3.3026 3.3026 4.4555 4.4555 5.0501 5.0501 5.1081 5.1081 5.1567 5.1567 5.6533 5.6533 5.9545 5.9545 5.9770 5.9770 6.1256 6.1256 6.3379 6.3379 6.4408 6.4408 6.7018 6.7018 7.6986 7.6986 7.8720 7.8720 7.9464 7.9464 7.9992 7.9992 10.2909 10.2909 11.2486 11.2486 11.9174 11.9174 11.9954 11.9954 13.1109 13.1109 k = 0.0439 0.0439 0.3175 ( 5046 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9167 -2.9167 -1.8675 -1.8675 3.3141 3.3141 4.4552 4.4552 5.0511 5.0511 5.1096 5.1096 5.1533 5.1533 5.6558 5.6558 5.9769 5.9769 5.9899 5.9899 6.1251 6.1251 6.3083 6.3083 6.4403 6.4403 6.7226 6.7226 7.7385 7.7385 7.9164 7.9164 7.9364 7.9364 8.0315 8.0315 10.2720 10.2720 11.1647 11.1647 11.8452 11.8452 11.9434 11.9434 13.1818 13.1818 k = 0.0351 0.0351 0.3175 ( 5046 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9258 -2.9258 -1.8742 -1.8742 3.3235 3.3235 4.4549 4.4549 5.0520 5.0520 5.1112 5.1112 5.1505 5.1505 5.6578 5.6578 5.9875 5.9875 6.0134 6.0134 6.1250 6.1250 6.2771 6.2771 6.4410 6.4410 6.7396 6.7396 7.7695 7.7695 7.9176 7.9176 7.9661 7.9661 8.0620 8.0620 10.2561 10.2561 11.0935 11.0935 11.7846 11.7846 11.8981 11.8981 13.2263 13.2263 k = 0.0263 0.0263 0.3175 ( 5050 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9329 -2.9329 -1.8794 -1.8794 3.3310 3.3310 4.4547 4.4547 5.0528 5.0528 5.1127 5.1127 5.1482 5.1482 5.6593 5.6593 5.9933 5.9933 6.0397 6.0397 6.1259 6.1259 6.2455 6.2455 6.4421 6.4421 6.7528 6.7528 7.7903 7.7903 7.9139 7.9139 7.9978 7.9978 8.0887 8.0887 10.2434 10.2434 11.0363 11.0363 11.7364 11.7364 11.8611 11.8611 13.2497 13.2497 k = 0.0175 0.0175 0.3175 ( 5052 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2806 -33.2806 -33.2806 -33.2806 -2.9380 -2.9380 -1.8832 -1.8832 3.3363 3.3363 4.4545 4.4545 5.0533 5.0533 5.1140 5.1140 5.1465 5.1465 5.6603 5.6603 5.9972 5.9972 6.0645 6.0645 6.1290 6.1290 6.2146 6.2146 6.4430 6.4430 6.7621 6.7621 7.8018 7.8018 7.9147 7.9147 8.0207 8.0207 8.1095 8.1095 10.2342 10.2342 10.9943 10.9943 11.7015 11.7015 11.8337 11.8337 13.2616 13.2616 k = 0.0088 0.0088 0.3175 ( 5056 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9410 -2.9410 -1.8854 -1.8854 3.3395 3.3395 4.4544 4.4544 5.0537 5.0537 5.1149 5.1149 5.1454 5.1454 5.6609 5.6609 5.9995 5.9995 6.0830 6.0830 6.1379 6.1379 6.1853 6.1853 6.4436 6.4436 6.7677 6.7677 7.8067 7.8067 7.9173 7.9173 8.0344 8.0344 8.1228 8.1228 10.2286 10.2286 10.9687 10.9687 11.6803 11.6803 11.8169 11.8169 13.2674 13.2674 k = 0.0000 0.0000 0.3175 ( 5060 PWs) bands (ev): -66.6353 -66.6353 -66.6353 -66.6353 -33.5803 -33.5803 -33.5802 -33.5802 -33.3025 -33.3025 -33.3024 -33.3024 -33.2807 -33.2807 -33.2806 -33.2806 -2.9420 -2.9420 -1.8862 -1.8862 3.3406 3.3406 4.4544 4.4544 5.0538 5.0538 5.1152 5.1152 5.1450 5.1450 5.6611 5.6611 6.0003 6.0003 6.0897 6.0897 6.1513 6.1513 6.1646 6.1646 6.4438 6.4438 6.7696 6.7696 7.8080 7.8080 7.9185 7.9185 8.0390 8.0390 8.1274 8.1274 10.2268 10.2268 10.9601 10.9601 11.6732 11.6732 11.8112 11.8112 13.2692 13.2692 k = 0.0000 0.5000-0.0000 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7963 -1.7963 -1.7963 -1.7963 3.6957 3.6957 3.6957 3.6957 4.4739 4.4739 4.4739 4.4739 5.5634 5.5634 5.5634 5.5634 5.6572 5.6572 5.6572 5.6572 5.8419 5.8419 5.8419 5.8419 6.0287 6.0287 6.0287 6.0287 6.4825 6.4825 6.4825 6.4825 8.7021 8.7021 8.7021 8.7021 11.3578 11.3578 11.3578 11.3578 12.2589 12.2589 12.2589 12.2589 14.1099 14.1099 k = 0.0000 0.5000 0.0122 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7961 -1.7961 -1.7961 -1.7961 3.6870 3.6870 3.6870 3.6870 4.4828 4.4828 4.4828 4.4828 5.5633 5.5633 5.5633 5.5633 5.6572 5.6572 5.6572 5.6572 5.8415 5.8415 5.8415 5.8415 6.0288 6.0288 6.0288 6.0288 6.4854 6.4854 6.4854 6.4854 8.7026 8.7026 8.7026 8.7026 11.3505 11.3505 11.3505 11.3505 12.2612 12.2612 12.2612 12.2612 14.1018 14.1018 k = 0.0000 0.5000 0.0244 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7954 -1.7954 -1.7954 -1.7954 3.6621 3.6621 3.6621 3.6621 4.5082 4.5082 4.5082 4.5082 5.5630 5.5630 5.5630 5.5630 5.6573 5.6573 5.6573 5.6573 5.8403 5.8403 5.8403 5.8403 6.0290 6.0290 6.0290 6.0290 6.4939 6.4939 6.4939 6.4939 8.7039 8.7039 8.7039 8.7039 11.3289 11.3289 11.3289 11.3289 12.2678 12.2678 12.2678 12.2678 14.0784 14.0784 k = 0.0000 0.5000 0.0366 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7942 -1.7942 -1.7942 -1.7942 3.6241 3.6241 3.6241 3.6241 4.5471 4.5471 4.5471 4.5471 5.5627 5.5627 5.5627 5.5627 5.6574 5.6574 5.6574 5.6574 5.8384 5.8384 5.8384 5.8384 6.0295 6.0295 6.0295 6.0295 6.5082 6.5082 6.5082 6.5082 8.7060 8.7060 8.7060 8.7060 11.2937 11.2937 11.2937 11.2937 12.2785 12.2785 12.2785 12.2785 14.0415 14.0415 k = 0.0000 0.5000 0.0488 ( 5078 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7926 -1.7926 -1.7926 -1.7926 3.5766 3.5766 3.5766 3.5766 4.5956 4.5956 4.5956 4.5956 5.5621 5.5621 5.5621 5.5621 5.6576 5.6576 5.6576 5.6576 5.8358 5.8358 5.8358 5.8358 6.0300 6.0300 6.0300 6.0300 6.5284 6.5284 6.5284 6.5284 8.7089 8.7089 8.7089 8.7089 11.2458 11.2458 11.2458 11.2458 12.2929 12.2929 12.2929 12.2929 13.9938 13.9938 k = 0.0000 0.5000 0.0611 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7905 -1.7905 -1.7905 -1.7905 3.5227 3.5227 3.5227 3.5227 4.6505 4.6505 4.6505 4.6505 5.5614 5.5614 5.5614 5.5614 5.6578 5.6578 5.6578 5.6578 5.8326 5.8326 5.8326 5.8326 6.0306 6.0306 6.0306 6.0306 6.5545 6.5545 6.5545 6.5545 8.7126 8.7126 8.7126 8.7126 11.1863 11.1863 11.1863 11.1863 12.3106 12.3106 12.3106 12.3106 13.9381 13.9381 k = 0.0000 0.5000 0.0733 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7881 -1.7881 -1.7881 -1.7881 3.4649 3.4649 3.4649 3.4649 4.7092 4.7092 4.7092 4.7092 5.5606 5.5606 5.5606 5.5606 5.6579 5.6579 5.6579 5.6579 5.8288 5.8288 5.8288 5.8288 6.0313 6.0313 6.0313 6.0313 6.5868 6.5868 6.5868 6.5868 8.7170 8.7170 8.7170 8.7170 11.1163 11.1163 11.1163 11.1163 12.3312 12.3312 12.3312 12.3312 13.8767 13.8767 k = 0.0000 0.5000 0.0855 ( 5058 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7852 -1.7852 -1.7852 -1.7852 3.4051 3.4051 3.4051 3.4051 4.7694 4.7694 4.7694 4.7694 5.5597 5.5597 5.5597 5.5597 5.6581 5.6581 5.6581 5.6581 5.8246 5.8246 5.8246 5.8246 6.0320 6.0320 6.0320 6.0320 6.6254 6.6254 6.6254 6.6254 8.7221 8.7221 8.7221 8.7221 11.0371 11.0371 11.0371 11.0371 12.3544 12.3544 12.3544 12.3544 13.8118 13.8118 k = 0.0000 0.5000 0.0977 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7821 -1.7821 -1.7821 -1.7821 3.3445 3.3445 3.3445 3.3445 4.8297 4.8297 4.8297 4.8297 5.5586 5.5586 5.5586 5.5586 5.6582 5.6582 5.6582 5.6582 5.8201 5.8201 5.8201 5.8201 6.0327 6.0327 6.0327 6.0327 6.6703 6.6703 6.6703 6.6703 8.7278 8.7278 8.7278 8.7278 10.9497 10.9497 10.9497 10.9497 12.3800 12.3800 12.3800 12.3800 13.7450 13.7450 k = 0.0000 0.5000 0.1099 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7786 -1.7786 -1.7786 -1.7786 3.2843 3.2843 3.2843 3.2843 4.8890 4.8890 4.8890 4.8890 5.5575 5.5575 5.5575 5.5575 5.6583 5.6583 5.6583 5.6583 5.8152 5.8152 5.8152 5.8152 6.0334 6.0334 6.0334 6.0334 6.7217 6.7217 6.7217 6.7217 8.7340 8.7340 8.7340 8.7340 10.8551 10.8551 10.8551 10.8551 12.4078 12.4078 12.4078 12.4078 13.6776 13.6776 k = 0.0000 0.5000 0.1221 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7750 -1.7750 -1.7750 -1.7750 3.2252 3.2252 3.2252 3.2252 4.9463 4.9463 4.9463 4.9463 5.5562 5.5562 5.5562 5.5562 5.6583 5.6583 5.6583 5.6583 5.8101 5.8101 5.8101 5.8101 6.0340 6.0340 6.0340 6.0340 6.7796 6.7796 6.7796 6.7796 8.7406 8.7406 8.7406 8.7406 10.7544 10.7544 10.7544 10.7544 12.4378 12.4378 12.4378 12.4378 13.6109 13.6109 k = 0.0000 0.5000 0.1343 ( 5066 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7711 -1.7711 -1.7711 -1.7711 3.1676 3.1676 3.1676 3.1676 5.0009 5.0009 5.0009 5.0009 5.5548 5.5548 5.5548 5.5548 5.6582 5.6582 5.6582 5.6582 5.8049 5.8049 5.8049 5.8049 6.0346 6.0346 6.0346 6.0346 6.8439 6.8439 6.8439 6.8439 8.7476 8.7476 8.7476 8.7476 10.6483 10.6483 10.6483 10.6483 12.4698 12.4698 12.4698 12.4698 13.5454 13.5454 k = 0.0000 0.5000 0.1465 ( 5076 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7671 -1.7671 -1.7671 -1.7671 3.1123 3.1123 3.1123 3.1123 5.0525 5.0525 5.0525 5.0525 5.5533 5.5533 5.5533 5.5533 5.6579 5.6579 5.6579 5.6579 5.7996 5.7996 5.7996 5.7996 6.0352 6.0352 6.0352 6.0352 6.9143 6.9143 6.9143 6.9143 8.7549 8.7549 8.7549 8.7549 10.5378 10.5378 10.5378 10.5378 12.5037 12.5037 12.5037 12.5037 13.4820 13.4820 k = 0.0000 0.5000 0.1587 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7630 -1.7630 -1.7630 -1.7630 3.0594 3.0594 3.0594 3.0594 5.1007 5.1007 5.1007 5.1007 5.5517 5.5517 5.5517 5.5517 5.6575 5.6575 5.6575 5.6575 5.7943 5.7943 5.7943 5.7943 6.0356 6.0356 6.0356 6.0356 6.9907 6.9907 6.9907 6.9907 8.7623 8.7623 8.7623 8.7623 10.4236 10.4236 10.4236 10.4236 12.5393 12.5393 12.5393 12.5393 13.4212 13.4212 k = 0.0000 0.5000 0.1710 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7589 -1.7589 -1.7589 -1.7589 3.0094 3.0094 3.0094 3.0094 5.1454 5.1454 5.1454 5.1454 5.5500 5.5500 5.5500 5.5500 5.6569 5.6569 5.6569 5.6569 5.7891 5.7891 5.7891 5.7891 6.0361 6.0361 6.0361 6.0361 7.0727 7.0727 7.0727 7.0727 8.7698 8.7698 8.7698 8.7698 10.3066 10.3066 10.3066 10.3066 12.5766 12.5766 12.5766 12.5766 13.3634 13.3634 k = 0.0000 0.5000 0.1832 ( 5078 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7548 -1.7548 -1.7548 -1.7548 2.9625 2.9625 2.9625 2.9625 5.1865 5.1865 5.1865 5.1865 5.5482 5.5482 5.5482 5.5482 5.6561 5.6561 5.6561 5.6561 5.7840 5.7840 5.7840 5.7840 6.0365 6.0365 6.0365 6.0365 7.1596 7.1596 7.1596 7.1596 8.7771 8.7771 8.7771 8.7771 10.1873 10.1873 10.1873 10.1873 12.6152 12.6152 12.6152 12.6152 13.3090 13.3090 k = 0.0000 0.5000 0.1954 ( 5074 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7509 -1.7509 -1.7509 -1.7509 2.9190 2.9190 2.9190 2.9190 5.2240 5.2240 5.2240 5.2240 5.5462 5.5462 5.5462 5.5462 5.6551 5.6551 5.6551 5.6551 5.7791 5.7791 5.7791 5.7791 6.0368 6.0368 6.0368 6.0368 7.2509 7.2509 7.2509 7.2509 8.7843 8.7843 8.7843 8.7843 10.0668 10.0668 10.0668 10.0668 12.6548 12.6548 12.6548 12.6548 13.2584 13.2584 k = 0.0000 0.5000 0.2076 ( 5068 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7470 -1.7470 -1.7470 -1.7470 2.8791 2.8791 2.8791 2.8791 5.2580 5.2580 5.2580 5.2580 5.5441 5.5441 5.5441 5.5441 5.6540 5.6540 5.6540 5.6540 5.7744 5.7744 5.7744 5.7744 6.0371 6.0371 6.0371 6.0371 7.3457 7.3457 7.3457 7.3457 8.7912 8.7912 8.7912 8.7912 9.9457 9.9457 9.9457 9.9457 12.6951 12.6951 12.6951 12.6951 13.2118 13.2118 k = 0.0000 0.5000 0.2198 ( 5058 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7435 -1.7435 -1.7435 -1.7435 2.8429 2.8429 2.8429 2.8429 5.2887 5.2887 5.2887 5.2887 5.5418 5.5418 5.5418 5.5418 5.6526 5.6526 5.6526 5.6526 5.7701 5.7701 5.7701 5.7701 6.0373 6.0373 6.0373 6.0373 7.4431 7.4431 7.4431 7.4431 8.7976 8.7976 8.7976 8.7976 9.8252 9.8252 9.8252 9.8252 12.7355 12.7355 12.7355 12.7355 13.1695 13.1695 k = 0.0000 0.5000 0.2320 ( 5062 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7401 -1.7401 -1.7401 -1.7401 2.8106 2.8106 2.8106 2.8106 5.3161 5.3161 5.3161 5.3161 5.5393 5.5393 5.5393 5.5393 5.6511 5.6511 5.6511 5.6511 5.7662 5.7662 5.7662 5.7662 6.0376 6.0376 6.0376 6.0376 7.5418 7.5418 7.5418 7.5418 8.8035 8.8035 8.8035 8.8035 9.7064 9.7064 9.7064 9.7064 12.7753 12.7753 12.7753 12.7753 13.1317 13.1317 k = 0.0000 0.5000 0.2442 ( 5070 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7371 -1.7371 -1.7371 -1.7371 2.7823 2.7823 2.7823 2.7823 5.3402 5.3402 5.3402 5.3402 5.5366 5.5366 5.5366 5.5366 5.6496 5.6496 5.6496 5.6496 5.7627 5.7627 5.7627 5.7627 6.0377 6.0377 6.0377 6.0377 7.6402 7.6402 7.6402 7.6402 8.8088 8.8088 8.8088 8.8088 9.5909 9.5909 9.5909 9.5909 12.8136 12.8136 12.8136 12.8136 13.0986 13.0986 k = 0.0000 0.5000 0.2564 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7345 -1.7345 -1.7345 -1.7345 2.7582 2.7582 2.7582 2.7582 5.3612 5.3612 5.3612 5.3612 5.5338 5.5338 5.5338 5.5338 5.6480 5.6480 5.6480 5.6480 5.7596 5.7596 5.7596 5.7596 6.0379 6.0379 6.0379 6.0379 7.7362 7.7362 7.7362 7.7362 8.8132 8.8132 8.8132 8.8132 9.4808 9.4808 9.4808 9.4808 12.8496 12.8496 12.8496 12.8496 13.0704 13.0704 k = 0.0000 0.5000 0.2686 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7323 -1.7323 -1.7323 -1.7323 2.7383 2.7383 2.7383 2.7383 5.3790 5.3790 5.3790 5.3790 5.5309 5.5309 5.5309 5.5309 5.6465 5.6465 5.6465 5.6465 5.7571 5.7571 5.7571 5.7571 6.0380 6.0380 6.0380 6.0380 7.8268 7.8268 7.8268 7.8268 8.8167 8.8167 8.8167 8.8167 9.3789 9.3789 9.3789 9.3789 12.8817 12.8817 12.8817 12.8817 13.0472 13.0472 k = 0.0000 0.5000 0.2809 ( 5056 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7306 -1.7306 -1.7306 -1.7306 2.7228 2.7228 2.7228 2.7228 5.3934 5.3934 5.3934 5.3934 5.5281 5.5281 5.5281 5.5281 5.6452 5.6452 5.6452 5.6452 5.7552 5.7552 5.7552 5.7552 6.0381 6.0381 6.0381 6.0381 7.9079 7.9079 7.9079 7.9079 8.8192 8.8192 8.8192 8.8192 9.2895 9.2895 9.2895 9.2895 12.9088 12.9088 12.9088 12.9088 13.0291 13.0291 k = 0.0000 0.5000 0.2931 ( 5050 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5806 -33.5806 -33.5806 -33.5806 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7293 -1.7293 -1.7293 -1.7293 2.7116 2.7116 2.7116 2.7116 5.4041 5.4041 5.4041 5.4041 5.5257 5.5257 5.5257 5.5257 5.6441 5.6441 5.6441 5.6441 5.7537 5.7537 5.7537 5.7537 6.0381 6.0381 6.0381 6.0381 7.9738 7.9738 7.9738 7.9738 8.8207 8.8207 8.8207 8.8207 9.2180 9.2180 9.2180 9.2180 12.9292 12.9292 12.9292 12.9292 13.0163 13.0163 k = 0.0000 0.5000 0.3053 ( 5046 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2813 -33.2813 -33.2813 -33.2813 -1.7285 -1.7285 -1.7285 -1.7285 2.7049 2.7049 2.7049 2.7049 5.4107 5.4107 5.4107 5.4107 5.5241 5.5241 5.5241 5.5241 5.6435 5.6435 5.6435 5.6435 5.7529 5.7529 5.7529 5.7529 6.0382 6.0382 6.0382 6.0382 8.0177 8.0177 8.0177 8.0177 8.8214 8.8214 8.8214 8.8214 9.1710 9.1710 9.1710 9.1710 12.9419 12.9419 12.9419 12.9419 13.0089 13.0089 k = 0.0000 0.5000 0.3175 ( 5044 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5805 -33.5805 -33.5805 -33.5805 -33.3026 -33.3026 -33.3026 -33.3026 -33.2812 -33.2812 -33.2812 -33.2812 -1.7283 -1.7283 -1.7283 -1.7283 2.7027 2.7027 2.7027 2.7027 5.4130 5.4130 5.4130 5.4130 5.5235 5.5235 5.5235 5.5235 5.6432 5.6432 5.6432 5.6432 5.7526 5.7526 5.7526 5.7526 6.0382 6.0382 6.0382 6.0382 8.0332 8.0332 8.0332 8.0332 8.8215 8.8215 8.8215 8.8215 9.1545 9.1545 9.1545 9.1545 12.9462 12.9462 12.9462 12.9462 13.0064 13.0064 k = 0.5000 0.5000-0.0000 ( 5088 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1985 -1.1985 -1.1985 -1.1985 3.4049 3.4049 3.4049 3.4049 4.8192 4.8192 4.8192 4.8192 5.3005 5.3005 5.3005 5.3005 5.9704 5.9704 5.9704 5.9704 6.2173 6.2173 6.2173 6.2173 6.2956 6.2956 6.2956 6.2956 6.5470 6.5470 6.5470 6.5470 6.7301 6.7301 6.7301 6.7301 8.8701 8.8701 8.8701 8.8701 9.4232 9.4232 9.4232 9.4232 16.3707 16.3707 k = 0.5000 0.5000 0.0122 ( 5084 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1984 -1.1984 -1.1984 -1.1984 3.4062 3.4062 3.4062 3.4062 4.8197 4.8197 4.8197 4.8197 5.3000 5.3000 5.3000 5.3000 5.9703 5.9703 5.9703 5.9703 6.2169 6.2169 6.2169 6.2169 6.2918 6.2918 6.2918 6.2918 6.5229 6.5229 6.5229 6.5229 6.7514 6.7514 6.7514 6.7514 8.8766 8.8766 8.8766 8.8766 9.4296 9.4296 9.4296 9.4296 16.3552 16.3552 k = 0.5000 0.5000 0.0244 ( 5084 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1982 -1.1982 -1.1982 -1.1982 3.4100 3.4100 3.4100 3.4100 4.8213 4.8213 4.8213 4.8213 5.2982 5.2982 5.2982 5.2982 5.9699 5.9699 5.9699 5.9699 6.2155 6.2155 6.2155 6.2155 6.2804 6.2804 6.2804 6.2804 6.4694 6.4694 6.4694 6.4694 6.7970 6.7970 6.7970 6.7970 8.8960 8.8960 8.8960 8.8960 9.4486 9.4486 9.4486 9.4486 16.3097 16.3097 k = 0.5000 0.5000 0.0366 ( 5084 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1979 -1.1979 -1.1979 -1.1979 3.4164 3.4164 3.4164 3.4164 4.8239 4.8239 4.8239 4.8239 5.2953 5.2953 5.2953 5.2953 5.9692 5.9692 5.9692 5.9692 6.2122 6.2122 6.2122 6.2122 6.2618 6.2618 6.2618 6.2618 6.4059 6.4059 6.4059 6.4059 6.8485 6.8485 6.8485 6.8485 8.9277 8.9277 8.9277 8.9277 9.4801 9.4801 9.4801 9.4801 16.2363 16.2363 k = 0.5000 0.5000 0.0488 ( 5084 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1974 -1.1974 -1.1974 -1.1974 3.4254 3.4254 3.4254 3.4254 4.8276 4.8276 4.8276 4.8276 5.2909 5.2909 5.2909 5.2909 5.9679 5.9679 5.9679 5.9679 6.2049 6.2049 6.2049 6.2049 6.2367 6.2367 6.2367 6.2367 6.3415 6.3415 6.3415 6.3415 6.8995 6.8995 6.8995 6.8995 8.9713 8.9713 8.9713 8.9713 9.5237 9.5237 9.5237 9.5237 16.1387 16.1387 k = 0.5000 0.5000 0.0611 ( 5092 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1969 -1.1969 -1.1969 -1.1969 3.4368 3.4368 3.4368 3.4368 4.8324 4.8324 4.8324 4.8324 5.2849 5.2849 5.2849 5.2849 5.9659 5.9659 5.9659 5.9659 6.1859 6.1859 6.1859 6.1859 6.2059 6.2059 6.2059 6.2059 6.2869 6.2869 6.2869 6.2869 6.9479 6.9479 6.9479 6.9479 9.0259 9.0259 9.0259 9.0259 9.5791 9.5791 9.5791 9.5791 16.0209 16.0209 k = 0.5000 0.5000 0.0733 ( 5068 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1962 -1.1962 -1.1962 -1.1962 3.4508 3.4508 3.4508 3.4508 4.8382 4.8382 4.8382 4.8382 5.2771 5.2771 5.2771 5.2771 5.9623 5.9623 5.9623 5.9623 6.1439 6.1439 6.1439 6.1439 6.1700 6.1700 6.1700 6.1700 6.2559 6.2559 6.2559 6.2559 6.9928 6.9928 6.9928 6.9928 9.0907 9.0907 9.0907 9.0907 9.6458 9.6458 9.6458 9.6458 15.8868 15.8868 k = 0.5000 0.5000 0.0855 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1954 -1.1954 -1.1954 -1.1954 3.4674 3.4674 3.4674 3.4674 4.8452 4.8452 4.8452 4.8452 5.2670 5.2670 5.2670 5.2670 5.9551 5.9551 5.9551 5.9551 6.0868 6.0868 6.0868 6.0868 6.1301 6.1301 6.1301 6.1301 6.2437 6.2437 6.2437 6.2437 7.0338 7.0338 7.0338 7.0338 9.1647 9.1647 9.1647 9.1647 9.7232 9.7232 9.7232 9.7232 15.7400 15.7400 k = 0.5000 0.5000 0.0977 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1945 -1.1945 -1.1945 -1.1945 3.4864 3.4864 3.4864 3.4864 4.8532 4.8532 4.8532 4.8532 5.2541 5.2541 5.2541 5.2541 5.9381 5.9381 5.9381 5.9381 6.0332 6.0332 6.0332 6.0332 6.0876 6.0876 6.0876 6.0876 6.2385 6.2385 6.2385 6.2385 7.0710 7.0710 7.0710 7.0710 9.2470 9.2470 9.2470 9.2470 9.8107 9.8107 9.8107 9.8107 15.5837 15.5837 k = 0.5000 0.5000 0.1099 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1935 -1.1935 -1.1935 -1.1935 3.5078 3.5078 3.5078 3.5078 4.8624 4.8624 4.8624 4.8624 5.2378 5.2378 5.2378 5.2378 5.9008 5.9008 5.9008 5.9008 5.9972 5.9972 5.9972 5.9972 6.0453 6.0453 6.0453 6.0453 6.2358 6.2358 6.2358 6.2358 7.1044 7.1044 7.1044 7.1044 9.3367 9.3367 9.3367 9.3367 9.9075 9.9075 9.9075 9.9075 15.4203 15.4203 k = 0.5000 0.5000 0.1221 ( 5080 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1925 -1.1925 -1.1925 -1.1925 3.5317 3.5317 3.5317 3.5317 4.8727 4.8727 4.8727 4.8727 5.2173 5.2173 5.2173 5.2173 5.8478 5.8478 5.8478 5.8478 5.9687 5.9687 5.9687 5.9687 6.0120 6.0120 6.0120 6.0120 6.2342 6.2342 6.2342 6.2342 7.1342 7.1342 7.1342 7.1342 9.4328 9.4328 9.4328 9.4328 10.0131 10.0131 10.0131 10.0131 15.2520 15.2520 k = 0.5000 0.5000 0.1343 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1914 -1.1914 -1.1914 -1.1914 3.5580 3.5580 3.5580 3.5580 4.8841 4.8841 4.8841 4.8841 5.1919 5.1919 5.1919 5.1919 5.7919 5.7919 5.7919 5.7919 5.9280 5.9280 5.9280 5.9280 5.9971 5.9971 5.9971 5.9971 6.2332 6.2332 6.2332 6.2332 7.1607 7.1607 7.1607 7.1607 9.5346 9.5346 9.5346 9.5346 10.1266 10.1266 10.1266 10.1266 15.0807 15.0807 k = 0.5000 0.5000 0.1465 ( 5072 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1903 -1.1903 -1.1903 -1.1903 3.5866 3.5866 3.5866 3.5866 4.8967 4.8967 4.8967 4.8967 5.1608 5.1608 5.1608 5.1608 5.7393 5.7393 5.7393 5.7393 5.8801 5.8801 5.8801 5.8801 5.9911 5.9911 5.9911 5.9911 6.2325 6.2325 6.2325 6.2325 7.1841 7.1841 7.1841 7.1841 9.6412 9.6412 9.6412 9.6412 10.2475 10.2475 10.2475 10.2475 14.9076 14.9076 k = 0.5000 0.5000 0.1587 ( 5064 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3028 -33.3028 -33.3028 -33.3028 -33.2819 -33.2819 -33.2819 -33.2819 -1.1891 -1.1891 -1.1891 -1.1891 3.6176 3.6176 3.6176 3.6176 4.9103 4.9103 4.9103 4.9103 5.1237 5.1237 5.1237 5.1237 5.6924 5.6924 5.6924 5.6924 5.8302 5.8302 5.8302 5.8302 5.9881 5.9881 5.9881 5.9881 6.2319 6.2319 6.2319 6.2319 7.2047 7.2047 7.2047 7.2047 9.7518 9.7518 9.7518 9.7518 10.3751 10.3751 10.3751 10.3751 14.7342 14.7342 k = 0.5000 0.5000 0.1710 ( 5048 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5809 -33.5809 -33.5809 -33.5809 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1880 -1.1880 -1.1880 -1.1880 3.6507 3.6507 3.6507 3.6507 4.9246 4.9246 4.9246 4.9246 5.0809 5.0809 5.0809 5.0809 5.6521 5.6521 5.6521 5.6521 5.7798 5.7798 5.7798 5.7798 5.9863 5.9863 5.9863 5.9863 6.2316 6.2316 6.2316 6.2316 7.2228 7.2228 7.2228 7.2228 9.8655 9.8655 9.8655 9.8655 10.5086 10.5086 10.5086 10.5086 14.5616 14.5616 k = 0.5000 0.5000 0.1832 ( 5024 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1869 -1.1869 -1.1869 -1.1869 3.6860 3.6860 3.6860 3.6860 4.9383 4.9383 4.9383 4.9383 5.0342 5.0342 5.0342 5.0342 5.6183 5.6183 5.6183 5.6183 5.7298 5.7298 5.7298 5.7298 5.9852 5.9852 5.9852 5.9852 6.2313 6.2313 6.2313 6.2313 7.2385 7.2385 7.2385 7.2385 9.9815 9.9815 9.9815 9.9815 10.6474 10.6474 10.6474 10.6474 14.3910 14.3910 k = 0.5000 0.5000 0.1954 ( 5012 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1858 -1.1858 -1.1858 -1.1858 3.7232 3.7232 3.7232 3.7232 4.9423 4.9423 4.9423 4.9423 4.9939 4.9939 4.9939 4.9939 5.5903 5.5903 5.5903 5.5903 5.6808 5.6808 5.6808 5.6808 5.9843 5.9843 5.9843 5.9843 6.2310 6.2310 6.2310 6.2310 7.2522 7.2522 7.2522 7.2522 10.0988 10.0988 10.0988 10.0988 10.7908 10.7908 10.7908 10.7908 14.2236 14.2236 k = 0.5000 0.5000 0.2076 ( 5004 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1847 -1.1847 -1.1847 -1.1847 3.7623 3.7623 3.7623 3.7623 4.9061 4.9061 4.9061 4.9061 4.9917 4.9917 4.9917 4.9917 5.5666 5.5666 5.5666 5.5666 5.6337 5.6337 5.6337 5.6337 5.9837 5.9837 5.9837 5.9837 6.2309 6.2309 6.2309 6.2309 7.2640 7.2640 7.2640 7.2640 10.2162 10.2162 10.2162 10.2162 10.9382 10.9382 10.9382 10.9382 14.0604 14.0604 k = 0.5000 0.5000 0.2198 ( 5012 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1838 -1.1838 -1.1838 -1.1838 3.8030 3.8030 3.8030 3.8030 4.8501 4.8501 4.8501 4.8501 5.0085 5.0085 5.0085 5.0085 5.5441 5.5441 5.5441 5.5441 5.5908 5.5908 5.5908 5.5908 5.9833 5.9833 5.9833 5.9833 6.2307 6.2307 6.2307 6.2307 7.2742 7.2742 7.2742 7.2742 10.3324 10.3324 10.3324 10.3324 11.0886 11.0886 11.0886 11.0886 13.9031 13.9031 k = 0.5000 0.5000 0.2320 ( 5000 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1829 -1.1829 -1.1829 -1.1829 3.8450 3.8450 3.8450 3.8450 4.7905 4.7905 4.7905 4.7905 5.0294 5.0294 5.0294 5.0294 5.5160 5.5160 5.5160 5.5160 5.5588 5.5588 5.5588 5.5588 5.9829 5.9829 5.9829 5.9829 6.2306 6.2306 6.2306 6.2306 7.2828 7.2828 7.2828 7.2828 10.4458 10.4458 10.4458 10.4458 11.2412 11.2412 11.2412 11.2412 13.7532 13.7532 k = 0.5000 0.5000 0.2442 ( 4996 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1820 -1.1820 -1.1820 -1.1820 3.8878 3.8878 3.8878 3.8878 4.7305 4.7305 4.7305 4.7305 5.0525 5.0525 5.0525 5.0525 5.4785 5.4785 5.4785 5.4785 5.5405 5.5405 5.5405 5.5405 5.9827 5.9827 5.9827 5.9827 6.2305 6.2305 6.2305 6.2305 7.2900 7.2900 7.2900 7.2900 10.5545 10.5545 10.5545 10.5545 11.3944 11.3944 11.3944 11.3944 13.6128 13.6128 k = 0.5000 0.5000 0.2564 ( 5004 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1813 -1.1813 -1.1813 -1.1813 3.9306 3.9306 3.9306 3.9306 4.6719 4.6719 4.6719 4.6719 5.0771 5.0771 5.0771 5.0771 5.4380 5.4380 5.4380 5.4380 5.5294 5.5294 5.5294 5.5294 5.9825 5.9825 5.9825 5.9825 6.2304 6.2304 6.2304 6.2304 7.2959 7.2959 7.2959 7.2959 10.6559 10.6559 10.6559 10.6559 11.5465 11.5465 11.5465 11.5465 13.4844 13.4844 k = 0.5000 0.5000 0.2686 ( 5008 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1807 -1.1807 -1.1807 -1.1807 3.9725 3.9725 3.9725 3.9725 4.6166 4.6166 4.6166 4.6166 5.1031 5.1031 5.1031 5.1031 5.3978 5.3978 5.3978 5.3978 5.5219 5.5219 5.5219 5.5219 5.9823 5.9823 5.9823 5.9823 6.2303 6.2303 6.2303 6.2303 7.3007 7.3007 7.3007 7.3007 10.7470 10.7470 10.7470 10.7470 11.6945 11.6945 11.6945 11.6945 13.3708 13.3708 k = 0.5000 0.5000 0.2809 ( 5008 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1803 -1.1803 -1.1803 -1.1803 4.0114 4.0114 4.0114 4.0114 4.5668 4.5668 4.5668 4.5668 5.1299 5.1299 5.1299 5.1299 5.3596 5.3596 5.3596 5.3596 5.5167 5.5167 5.5167 5.5167 5.9822 5.9822 5.9822 5.9822 6.2303 6.2303 6.2303 6.2303 7.3043 7.3043 7.3043 7.3043 10.8241 10.8241 10.8241 10.8241 11.8330 11.8330 11.8330 11.8330 13.2750 13.2750 k = 0.5000 0.5000 0.2931 ( 5008 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1799 -1.1799 -1.1799 -1.1799 4.0446 4.0446 4.0446 4.0446 4.5257 4.5257 4.5257 4.5257 5.1566 5.1566 5.1566 5.1566 5.3246 5.3246 5.3246 5.3246 5.5132 5.5132 5.5132 5.5132 5.9821 5.9821 5.9821 5.9821 6.2303 6.2303 6.2303 6.2303 7.3068 7.3068 7.3068 7.3068 10.8833 10.8833 10.8833 10.8833 11.9531 11.9531 11.9531 11.9531 13.1944 13.1944 k = 0.5000 0.5000 0.3053 ( 5016 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1797 -1.1797 -1.1797 -1.1797 4.0677 4.0677 4.0677 4.0677 4.4977 4.4977 4.4977 4.4977 5.1801 5.1801 5.1801 5.1801 5.2961 5.2961 5.2961 5.2961 5.5112 5.5112 5.5112 5.5112 5.9821 5.9821 5.9821 5.9821 6.2302 6.2302 6.2302 6.2302 7.3083 7.3083 7.3083 7.3083 10.9207 10.9207 10.9207 10.9207 12.0392 12.0392 12.0392 12.0392 13.1161 13.1161 k = 0.5000 0.5000 0.3175 ( 5016 PWs) bands (ev): -66.6352 -66.6352 -66.6352 -66.6352 -33.5808 -33.5808 -33.5808 -33.5808 -33.3027 -33.3027 -33.3027 -33.3027 -33.2818 -33.2818 -33.2818 -33.2818 -1.1797 -1.1797 -1.1797 -1.1797 4.0762 4.0762 4.0762 4.0762 4.4877 4.4877 4.4877 4.4877 5.1911 5.1911 5.1911 5.1911 5.2834 5.2834 5.2834 5.2834 5.5106 5.5106 5.5106 5.5106 5.9821 5.9821 5.9821 5.9821 6.2302 6.2302 6.2302 6.2302 7.3088 7.3088 7.3088 7.3088 10.9335 10.9335 10.9335 10.9335 12.0715 12.0715 12.0715 12.0715 13.0832 13.0832 Writing output data file MgCuAs.save init_run : 0.27s CPU 0.40s WALL ( 1 calls) electrons : 176.93s CPU 179.70s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 176.91s CPU 179.69s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.05s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.07s WALL ( 361 calls) cegterg : 160.02s CPU 162.07s WALL ( 411 calls) Called by sum_band: Called by *egterg: h_psi : 86.64s CPU 88.07s WALL ( 7125 calls) s_psi : 4.63s CPU 4.68s WALL ( 7125 calls) g_psi : 0.32s CPU 0.30s WALL ( 6353 calls) cdiaghg : 57.01s CPU 57.83s WALL ( 6714 calls) cegterg:over : 8.42s CPU 8.53s WALL ( 6353 calls) cegterg:upda : 7.06s CPU 7.25s WALL ( 6353 calls) cegterg:last : 4.19s CPU 4.16s WALL ( 1133 calls) cdiaghg:chol : 3.37s CPU 3.32s WALL ( 6714 calls) cdiaghg:inve : 2.18s CPU 2.31s WALL ( 6714 calls) cdiaghg:para : 3.80s CPU 3.70s WALL ( 13428 calls) Called by h_psi: h_psi:vloc : 75.13s CPU 76.42s WALL ( 7125 calls) h_psi:vnl : 11.20s CPU 11.33s WALL ( 7125 calls) add_vuspsi : 5.34s CPU 5.48s WALL ( 7125 calls) General routines calbec : 5.83s CPU 5.83s WALL ( 7125 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 69.83s CPU 70.92s WALL ( 886064 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.25s CPU 0.30s WALL ( 722 calls) Parallel routines fft_scatter : 26.29s CPU 26.29s WALL ( 886087 calls) PWSCF : 3m18.89s CPU 3m34.88s WALL This run was terminated on: 20:41:11 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=