Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:56:21 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: ./SrCuP.save/ 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 30 21 6 1696 983 156 Max 31 22 8 1707 1008 161 Sum 1111 769 235 61289 35865 5671 bravais-lattice index = 14 lattice parameter (alat) = 7.8348 a.u. unit-cell volume = 851.4844 (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 = 46.0000 Ry charge density cutoff = 263.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.834804 celldm(2)= 1.000000 celldm(3)= 2.044380 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 2.044380 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.489146 ) PseudoPot. # 1 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 PseudoPot. # 2 for Sr read from file: /users/gautes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 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 1221 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 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 1147 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 Cu 11.00 63.54600 Cu( 1.00) Sr 10.00 87.62000 Sr( 1.00) P 5.00 30.97380 P( 1.00) 24 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 =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.0221901 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0221901 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 60 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.0221901 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.0221901 ) isym = 7 120 deg rotation - cryst. axis [0,0,1] cryst. s( 7) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 8) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 9) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0221901 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0221901 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(14) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0221901 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.0221901 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0221901 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0221901 ) isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s(19) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(20) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(20) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(21) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(21) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.0221901 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.0221901 ) isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(23) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(24) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_6h(6/mmm) there are 18 classes and 6 irreducible representations the character table: E -E 2C6 -2C6 2C3 -2C3 C2 3C2' 3C2'' i -i 2S3 -C2 -3C2' -3C2' G_7+ 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 1.73 G_8+ 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 -1.73 G_9+ 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 2.00 -2.00 0.00 G_7- 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 -1.73 G_8- 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 1.73 G_9- 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 -2.00 2.00 0.00 -2S3 2S6 -2S6 s_h 3s_v 3s_d -s_h -3s_v -3s_d G_7+ -1.73 1.00 -1.00 0.00 0.00 0.00 G_8+ 1.73 1.00 -1.00 0.00 0.00 0.00 G_9+ 0.00 -2.00 2.00 0.00 0.00 0.00 G_7- 1.73 -1.00 1.00 0.00 0.00 0.00 G_8- -1.73 -1.00 1.00 0.00 0.00 0.00 G_9- 0.00 2.00 -2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C6 5 6 60 deg rotation - cryst. axis [0,0,1] -2C6 -5 -6 60 deg rotation - cryst. axis [0,0,1] E 2C3 7 8 120 deg rotation - cryst. axis [0,0,1] -2C3 -7 -8 120 deg rotation - cryst. axis [0,0,1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 3C2'-3C2' 4 -4 12 -11 11 -12 180 deg rotation - cart. axis [1,0,0] 3C2''-3C2' 3 -3 9 10 -10 -9 180 deg rotation - cart. axis [0,1,0] i 13 inversion -i -13 inversion E 2S3 17 18 inv. 60 deg rotation - cryst. axis [0,0,1] -2S3 -17 -18 inv. 60 deg rotation - cryst. axis [0,0,1] E 2S6 19 20 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -19 -20 inv. 120 deg rotation - cryst. axis [0,0,1] E s_h -s_h 14 -14 inv. 180 deg rotation - cart. axis [0,0,1] 3s_v-3s_v 16 -16 24 -23 23 -24 inv. 180 deg rotation - cart. axis [1,0,0] 3s_d-3s_d 15 -15 21 22 -22 -21 inv. 180 deg rotation - cart. axis [0,1,0] Cartesian axes number of k points= 308 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0113636 0.0065608 -0.0000000), wk = 0.0032468 k( 3) = ( 0.0227273 0.0131216 -0.0000000), wk = 0.0032468 k( 4) = ( 0.0340909 0.0196824 -0.0000000), wk = 0.0032468 k( 5) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0032468 k( 6) = ( 0.0568182 0.0328040 -0.0000000), wk = 0.0032468 k( 7) = ( 0.0681818 0.0393648 -0.0000000), wk = 0.0032468 k( 8) = ( 0.0795455 0.0459256 -0.0000000), wk = 0.0032468 k( 9) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0032468 k( 10) = ( 0.1022727 0.0590472 -0.0000000), wk = 0.0032468 k( 11) = ( 0.1136364 0.0656080 -0.0000000), wk = 0.0032468 k( 12) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0032468 k( 13) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0032468 k( 14) = ( 0.1477273 0.0852904 -0.0000000), wk = 0.0032468 k( 15) = ( 0.1590909 0.0918512 -0.0000000), wk = 0.0032468 k( 16) = ( 0.1704546 0.0984120 -0.0000000), wk = 0.0032468 k( 17) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0032468 k( 18) = ( 0.1931818 0.1115336 -0.0000000), wk = 0.0032468 k( 19) = ( 0.2045454 0.1180944 -0.0000000), wk = 0.0032468 k( 20) = ( 0.2159091 0.1246552 -0.0000000), wk = 0.0032468 k( 21) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0032468 k( 22) = ( 0.2386364 0.1377768 -0.0000000), wk = 0.0032468 k( 23) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0032468 k( 24) = ( 0.2613636 0.1508984 -0.0000000), wk = 0.0032468 k( 25) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0032468 k( 26) = ( 0.2840909 0.1640200 -0.0000000), wk = 0.0032468 k( 27) = ( 0.2954545 0.1705808 -0.0000000), wk = 0.0032468 k( 28) = ( 0.3068182 0.1771416 -0.0000000), wk = 0.0032468 k( 29) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0032468 k( 30) = ( 0.3295455 0.1902632 -0.0000000), wk = 0.0032468 k( 31) = ( 0.3409091 0.1968240 -0.0000000), wk = 0.0032468 k( 32) = ( 0.3522727 0.2033848 -0.0000000), wk = 0.0032468 k( 33) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0032468 k( 34) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0032468 k( 35) = ( 0.3863636 0.2230672 -0.0000000), wk = 0.0032468 k( 36) = ( 0.3977273 0.2296279 -0.0000000), wk = 0.0032468 k( 37) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0032468 k( 38) = ( 0.4204545 0.2427495 -0.0000000), wk = 0.0032468 k( 39) = ( 0.4318182 0.2493103 -0.0000000), wk = 0.0032468 k( 40) = ( 0.4431818 0.2558711 -0.0000000), wk = 0.0032468 k( 41) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0032468 k( 42) = ( 0.4659091 0.2689927 -0.0000000), wk = 0.0032468 k( 43) = ( 0.4772727 0.2755535 -0.0000000), wk = 0.0032468 k( 44) = ( 0.4886364 0.2821143 -0.0000000), wk = 0.0032468 k( 45) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0032468 k( 46) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0032468 k( 47) = ( 0.4935897 0.2997780 -0.0000000), wk = 0.0032468 k( 48) = ( 0.4871795 0.3108809 -0.0000000), wk = 0.0032468 k( 49) = ( 0.4807692 0.3219838 -0.0000000), wk = 0.0032468 k( 50) = ( 0.4743590 0.3330867 -0.0000000), wk = 0.0032468 k( 51) = ( 0.4679487 0.3441896 -0.0000000), wk = 0.0032468 k( 52) = ( 0.4615385 0.3552925 -0.0000000), wk = 0.0032468 k( 53) = ( 0.4551282 0.3663954 -0.0000000), wk = 0.0032468 k( 54) = ( 0.4487179 0.3774983 -0.0000000), wk = 0.0032468 k( 55) = ( 0.4423077 0.3886011 -0.0000000), wk = 0.0032468 k( 56) = ( 0.4358974 0.3997040 -0.0000000), wk = 0.0032468 k( 57) = ( 0.4294872 0.4108069 -0.0000000), wk = 0.0032468 k( 58) = ( 0.4230769 0.4219098 -0.0000000), wk = 0.0032468 k( 59) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0032468 k( 60) = ( 0.4102564 0.4441156 -0.0000000), wk = 0.0032468 k( 61) = ( 0.4038462 0.4552185 -0.0000000), wk = 0.0032468 k( 62) = ( 0.3974359 0.4663214 -0.0000000), wk = 0.0032468 k( 63) = ( 0.3910256 0.4774243 -0.0000000), wk = 0.0032468 k( 64) = ( 0.3846154 0.4885271 -0.0000000), wk = 0.0032468 k( 65) = ( 0.3782051 0.4996300 -0.0000000), wk = 0.0032468 k( 66) = ( 0.3717949 0.5107329 -0.0000000), wk = 0.0032468 k( 67) = ( 0.3653846 0.5218358 -0.0000000), wk = 0.0032468 k( 68) = ( 0.3589744 0.5329387 -0.0000000), wk = 0.0032468 k( 69) = ( 0.3525641 0.5440416 -0.0000000), wk = 0.0032468 k( 70) = ( 0.3461538 0.5551445 -0.0000000), wk = 0.0032468 k( 71) = ( 0.3397436 0.5662474 -0.0000000), wk = 0.0032468 k( 72) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0032468 k( 73) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0032468 k( 74) = ( 0.3267974 0.5660297 -0.0000000), wk = 0.0032468 k( 75) = ( 0.3202614 0.5547091 -0.0000000), wk = 0.0032468 k( 76) = ( 0.3137255 0.5433885 -0.0000000), wk = 0.0032468 k( 77) = ( 0.3071895 0.5320679 -0.0000000), wk = 0.0032468 k( 78) = ( 0.3006536 0.5207473 -0.0000000), wk = 0.0032468 k( 79) = ( 0.2941177 0.5094267 -0.0000000), wk = 0.0032468 k( 80) = ( 0.2875817 0.4981061 -0.0000000), wk = 0.0032468 k( 81) = ( 0.2810457 0.4867855 -0.0000000), wk = 0.0032468 k( 82) = ( 0.2745098 0.4754649 -0.0000000), wk = 0.0032468 k( 83) = ( 0.2679739 0.4641443 -0.0000000), wk = 0.0032468 k( 84) = ( 0.2614379 0.4528237 -0.0000000), wk = 0.0032468 k( 85) = ( 0.2549020 0.4415031 -0.0000000), wk = 0.0032468 k( 86) = ( 0.2483660 0.4301825 -0.0000000), wk = 0.0032468 k( 87) = ( 0.2418301 0.4188620 -0.0000000), wk = 0.0032468 k( 88) = ( 0.2352941 0.4075414 -0.0000000), wk = 0.0032468 k( 89) = ( 0.2287582 0.3962208 -0.0000000), wk = 0.0032468 k( 90) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0032468 k( 91) = ( 0.2156863 0.3735796 -0.0000000), wk = 0.0032468 k( 92) = ( 0.2091503 0.3622590 -0.0000000), wk = 0.0032468 k( 93) = ( 0.2026144 0.3509384 -0.0000000), wk = 0.0032468 k( 94) = ( 0.1960784 0.3396178 -0.0000000), wk = 0.0032468 k( 95) = ( 0.1895425 0.3282972 -0.0000000), wk = 0.0032468 k( 96) = ( 0.1830065 0.3169766 -0.0000000), wk = 0.0032468 k( 97) = ( 0.1764706 0.3056560 -0.0000000), wk = 0.0032468 k( 98) = ( 0.1699346 0.2943354 -0.0000000), wk = 0.0032468 k( 99) = ( 0.1633987 0.2830148 -0.0000000), wk = 0.0032468 k( 100) = ( 0.1568627 0.2716943 -0.0000000), wk = 0.0032468 k( 101) = ( 0.1503268 0.2603737 -0.0000000), wk = 0.0032468 k( 102) = ( 0.1437908 0.2490531 -0.0000000), wk = 0.0032468 k( 103) = ( 0.1372549 0.2377325 -0.0000000), wk = 0.0032468 k( 104) = ( 0.1307190 0.2264119 -0.0000000), wk = 0.0032468 k( 105) = ( 0.1241830 0.2150913 -0.0000000), wk = 0.0032468 k( 106) = ( 0.1176471 0.2037707 -0.0000000), wk = 0.0032468 k( 107) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0032468 k( 108) = ( 0.1045752 0.1811295 -0.0000000), wk = 0.0032468 k( 109) = ( 0.0980392 0.1698089 -0.0000000), wk = 0.0032468 k( 110) = ( 0.0915033 0.1584883 -0.0000000), wk = 0.0032468 k( 111) = ( 0.0849673 0.1471677 -0.0000000), wk = 0.0032468 k( 112) = ( 0.0784314 0.1358471 -0.0000000), wk = 0.0032468 k( 113) = ( 0.0718954 0.1245265 -0.0000000), wk = 0.0032468 k( 114) = ( 0.0653595 0.1132059 -0.0000000), wk = 0.0032468 k( 115) = ( 0.0588235 0.1018853 -0.0000000), wk = 0.0032468 k( 116) = ( 0.0522876 0.0905647 -0.0000000), wk = 0.0032468 k( 117) = ( 0.0457516 0.0792441 -0.0000000), wk = 0.0032468 k( 118) = ( 0.0392157 0.0679236 -0.0000000), wk = 0.0032468 k( 119) = ( 0.0326797 0.0566030 -0.0000000), wk = 0.0032468 k( 120) = ( 0.0261438 0.0452824 -0.0000000), wk = 0.0032468 k( 121) = ( 0.0196078 0.0339618 -0.0000000), wk = 0.0032468 k( 122) = ( 0.0130719 0.0226412 -0.0000000), wk = 0.0032468 k( 123) = ( 0.0065359 0.0113206 -0.0000000), wk = 0.0032468 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 126) = ( 0.0000000 0.0000000 0.0128723), wk = 0.0032468 k( 127) = ( 0.0000000 0.0000000 0.0257445), wk = 0.0032468 k( 128) = ( 0.0000000 0.0000000 0.0386168), wk = 0.0032468 k( 129) = ( 0.0000000 0.0000000 0.0514890), wk = 0.0032468 k( 130) = ( 0.0000000 0.0000000 0.0643613), wk = 0.0032468 k( 131) = ( 0.0000000 0.0000000 0.0772336), wk = 0.0032468 k( 132) = ( 0.0000000 0.0000000 0.0901058), wk = 0.0032468 k( 133) = ( 0.0000000 0.0000000 0.1029781), wk = 0.0032468 k( 134) = ( 0.0000000 0.0000000 0.1158503), wk = 0.0032468 k( 135) = ( 0.0000000 0.0000000 0.1287226), wk = 0.0032468 k( 136) = ( 0.0000000 0.0000000 0.1415948), wk = 0.0032468 k( 137) = ( 0.0000000 0.0000000 0.1544671), wk = 0.0032468 k( 138) = ( 0.0000000 0.0000000 0.1673394), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.1802116), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.1930839), wk = 0.0032468 k( 141) = ( 0.0000000 0.0000000 0.2059561), wk = 0.0032468 k( 142) = ( 0.0000000 0.0000000 0.2188284), wk = 0.0032468 k( 143) = ( 0.0000000 0.0000000 0.2317007), wk = 0.0032468 k( 144) = ( 0.0000000 0.0000000 0.2445729), wk = 0.0032468 k( 145) = ( 0.0000000 0.0000000 0.2445729), wk = 0.0032468 k( 146) = ( 0.0113636 0.0065608 0.2445729), wk = 0.0032468 k( 147) = ( 0.0227273 0.0131216 0.2445729), wk = 0.0032468 k( 148) = ( 0.0340909 0.0196824 0.2445729), wk = 0.0032468 k( 149) = ( 0.0454546 0.0262432 0.2445729), wk = 0.0032468 k( 150) = ( 0.0568182 0.0328040 0.2445729), wk = 0.0032468 k( 151) = ( 0.0681818 0.0393648 0.2445729), wk = 0.0032468 k( 152) = ( 0.0795455 0.0459256 0.2445729), wk = 0.0032468 k( 153) = ( 0.0909091 0.0524864 0.2445729), wk = 0.0032468 k( 154) = ( 0.1022727 0.0590472 0.2445729), wk = 0.0032468 k( 155) = ( 0.1136364 0.0656080 0.2445729), wk = 0.0032468 k( 156) = ( 0.1250000 0.0721688 0.2445729), wk = 0.0032468 k( 157) = ( 0.1363636 0.0787296 0.2445729), wk = 0.0032468 k( 158) = ( 0.1477273 0.0852904 0.2445729), wk = 0.0032468 k( 159) = ( 0.1590909 0.0918512 0.2445729), wk = 0.0032468 k( 160) = ( 0.1704546 0.0984120 0.2445729), wk = 0.0032468 k( 161) = ( 0.1818182 0.1049728 0.2445729), wk = 0.0032468 k( 162) = ( 0.1931818 0.1115336 0.2445729), wk = 0.0032468 k( 163) = ( 0.2045454 0.1180944 0.2445729), wk = 0.0032468 k( 164) = ( 0.2159091 0.1246552 0.2445729), wk = 0.0032468 k( 165) = ( 0.2272727 0.1312160 0.2445729), wk = 0.0032468 k( 166) = ( 0.2386364 0.1377768 0.2445729), wk = 0.0032468 k( 167) = ( 0.2500000 0.1443376 0.2445729), wk = 0.0032468 k( 168) = ( 0.2613636 0.1508984 0.2445729), wk = 0.0032468 k( 169) = ( 0.2727273 0.1574592 0.2445729), wk = 0.0032468 k( 170) = ( 0.2840909 0.1640200 0.2445729), wk = 0.0032468 k( 171) = ( 0.2954545 0.1705808 0.2445729), wk = 0.0032468 k( 172) = ( 0.3068182 0.1771416 0.2445729), wk = 0.0032468 k( 173) = ( 0.3181818 0.1837024 0.2445729), wk = 0.0032468 k( 174) = ( 0.3295455 0.1902632 0.2445729), wk = 0.0032468 k( 175) = ( 0.3409091 0.1968240 0.2445729), wk = 0.0032468 k( 176) = ( 0.3522727 0.2033848 0.2445729), wk = 0.0032468 k( 177) = ( 0.3636364 0.2099456 0.2445729), wk = 0.0032468 k( 178) = ( 0.3750000 0.2165064 0.2445729), wk = 0.0032468 k( 179) = ( 0.3863636 0.2230672 0.2445729), wk = 0.0032468 k( 180) = ( 0.3977273 0.2296279 0.2445729), wk = 0.0032468 k( 181) = ( 0.4090909 0.2361887 0.2445729), wk = 0.0032468 k( 182) = ( 0.4204545 0.2427495 0.2445729), wk = 0.0032468 k( 183) = ( 0.4318182 0.2493103 0.2445729), wk = 0.0032468 k( 184) = ( 0.4431818 0.2558711 0.2445729), wk = 0.0032468 k( 185) = ( 0.4545455 0.2624319 0.2445729), wk = 0.0032468 k( 186) = ( 0.4659091 0.2689927 0.2445729), wk = 0.0032468 k( 187) = ( 0.4772727 0.2755535 0.2445729), wk = 0.0032468 k( 188) = ( 0.4886364 0.2821143 0.2445729), wk = 0.0032468 k( 189) = ( 0.5000000 0.2886751 0.2445729), wk = 0.0032468 k( 190) = ( 0.5000000 0.2886751 0.2445729), wk = 0.0032468 k( 191) = ( 0.4935897 0.2997780 0.2445729), wk = 0.0032468 k( 192) = ( 0.4871795 0.3108809 0.2445729), wk = 0.0032468 k( 193) = ( 0.4807692 0.3219838 0.2445729), wk = 0.0032468 k( 194) = ( 0.4743590 0.3330867 0.2445729), wk = 0.0032468 k( 195) = ( 0.4679487 0.3441896 0.2445729), wk = 0.0032468 k( 196) = ( 0.4615385 0.3552925 0.2445729), wk = 0.0032468 k( 197) = ( 0.4551282 0.3663954 0.2445729), wk = 0.0032468 k( 198) = ( 0.4487179 0.3774983 0.2445729), wk = 0.0032468 k( 199) = ( 0.4423077 0.3886011 0.2445729), wk = 0.0032468 k( 200) = ( 0.4358974 0.3997040 0.2445729), wk = 0.0032468 k( 201) = ( 0.4294872 0.4108069 0.2445729), wk = 0.0032468 k( 202) = ( 0.4230769 0.4219098 0.2445729), wk = 0.0032468 k( 203) = ( 0.4166667 0.4330127 0.2445729), wk = 0.0032468 k( 204) = ( 0.4102564 0.4441156 0.2445729), wk = 0.0032468 k( 205) = ( 0.4038462 0.4552185 0.2445729), wk = 0.0032468 k( 206) = ( 0.3974359 0.4663214 0.2445729), wk = 0.0032468 k( 207) = ( 0.3910256 0.4774243 0.2445729), wk = 0.0032468 k( 208) = ( 0.3846154 0.4885271 0.2445729), wk = 0.0032468 k( 209) = ( 0.3782051 0.4996300 0.2445729), wk = 0.0032468 k( 210) = ( 0.3717949 0.5107329 0.2445729), wk = 0.0032468 k( 211) = ( 0.3653846 0.5218358 0.2445729), wk = 0.0032468 k( 212) = ( 0.3589744 0.5329387 0.2445729), wk = 0.0032468 k( 213) = ( 0.3525641 0.5440416 0.2445729), wk = 0.0032468 k( 214) = ( 0.3461538 0.5551445 0.2445729), wk = 0.0032468 k( 215) = ( 0.3397436 0.5662474 0.2445729), wk = 0.0032468 k( 216) = ( 0.3333333 0.5773503 0.2445729), wk = 0.0032468 k( 217) = ( 0.3333333 0.5773503 0.2445729), wk = 0.0032468 k( 218) = ( 0.3267974 0.5660297 0.2445729), wk = 0.0032468 k( 219) = ( 0.3202614 0.5547091 0.2445729), wk = 0.0032468 k( 220) = ( 0.3137255 0.5433885 0.2445729), wk = 0.0032468 k( 221) = ( 0.3071895 0.5320679 0.2445729), wk = 0.0032468 k( 222) = ( 0.3006536 0.5207473 0.2445729), wk = 0.0032468 k( 223) = ( 0.2941177 0.5094267 0.2445729), wk = 0.0032468 k( 224) = ( 0.2875817 0.4981061 0.2445729), wk = 0.0032468 k( 225) = ( 0.2810457 0.4867855 0.2445729), wk = 0.0032468 k( 226) = ( 0.2745098 0.4754649 0.2445729), wk = 0.0032468 k( 227) = ( 0.2679739 0.4641443 0.2445729), wk = 0.0032468 k( 228) = ( 0.2614379 0.4528237 0.2445729), wk = 0.0032468 k( 229) = ( 0.2549020 0.4415031 0.2445729), wk = 0.0032468 k( 230) = ( 0.2483660 0.4301825 0.2445729), wk = 0.0032468 k( 231) = ( 0.2418301 0.4188620 0.2445729), wk = 0.0032468 k( 232) = ( 0.2352941 0.4075414 0.2445729), wk = 0.0032468 k( 233) = ( 0.2287582 0.3962208 0.2445729), wk = 0.0032468 k( 234) = ( 0.2222222 0.3849002 0.2445729), wk = 0.0032468 k( 235) = ( 0.2156863 0.3735796 0.2445729), wk = 0.0032468 k( 236) = ( 0.2091503 0.3622590 0.2445729), wk = 0.0032468 k( 237) = ( 0.2026144 0.3509384 0.2445729), wk = 0.0032468 k( 238) = ( 0.1960784 0.3396178 0.2445729), wk = 0.0032468 k( 239) = ( 0.1895425 0.3282972 0.2445729), wk = 0.0032468 k( 240) = ( 0.1830065 0.3169766 0.2445729), wk = 0.0032468 k( 241) = ( 0.1764706 0.3056560 0.2445729), wk = 0.0032468 k( 242) = ( 0.1699346 0.2943354 0.2445729), wk = 0.0032468 k( 243) = ( 0.1633987 0.2830148 0.2445729), wk = 0.0032468 k( 244) = ( 0.1568627 0.2716943 0.2445729), wk = 0.0032468 k( 245) = ( 0.1503268 0.2603737 0.2445729), wk = 0.0032468 k( 246) = ( 0.1437908 0.2490531 0.2445729), wk = 0.0032468 k( 247) = ( 0.1372549 0.2377325 0.2445729), wk = 0.0032468 k( 248) = ( 0.1307190 0.2264119 0.2445729), wk = 0.0032468 k( 249) = ( 0.1241830 0.2150913 0.2445729), wk = 0.0032468 k( 250) = ( 0.1176471 0.2037707 0.2445729), wk = 0.0032468 k( 251) = ( 0.1111111 0.1924501 0.2445729), wk = 0.0032468 k( 252) = ( 0.1045752 0.1811295 0.2445729), wk = 0.0032468 k( 253) = ( 0.0980392 0.1698089 0.2445729), wk = 0.0032468 k( 254) = ( 0.0915033 0.1584883 0.2445729), wk = 0.0032468 k( 255) = ( 0.0849673 0.1471677 0.2445729), wk = 0.0032468 k( 256) = ( 0.0784314 0.1358471 0.2445729), wk = 0.0032468 k( 257) = ( 0.0718954 0.1245265 0.2445729), wk = 0.0032468 k( 258) = ( 0.0653595 0.1132059 0.2445729), wk = 0.0032468 k( 259) = ( 0.0588235 0.1018853 0.2445729), wk = 0.0032468 k( 260) = ( 0.0522876 0.0905647 0.2445729), wk = 0.0032468 k( 261) = ( 0.0457516 0.0792441 0.2445729), wk = 0.0032468 k( 262) = ( 0.0392157 0.0679236 0.2445729), wk = 0.0032468 k( 263) = ( 0.0326797 0.0566030 0.2445729), wk = 0.0032468 k( 264) = ( 0.0261438 0.0452824 0.2445729), wk = 0.0032468 k( 265) = ( 0.0196078 0.0339618 0.2445729), wk = 0.0032468 k( 266) = ( 0.0130719 0.0226412 0.2445729), wk = 0.0032468 k( 267) = ( 0.0065359 0.0113206 0.2445729), wk = 0.0032468 k( 268) = ( 0.0000000 0.0000000 0.2445729), wk = 0.0032468 k( 269) = ( 0.5000000 0.2886751 0.2445729), wk = 0.0032468 k( 270) = ( 0.5000000 0.2886751 0.2317007), wk = 0.0032468 k( 271) = ( 0.5000000 0.2886751 0.2188284), wk = 0.0032468 k( 272) = ( 0.5000000 0.2886751 0.2059561), wk = 0.0032468 k( 273) = ( 0.5000000 0.2886751 0.1930839), wk = 0.0032468 k( 274) = ( 0.5000000 0.2886751 0.1802116), wk = 0.0032468 k( 275) = ( 0.5000000 0.2886751 0.1673394), wk = 0.0032468 k( 276) = ( 0.5000000 0.2886751 0.1544671), wk = 0.0032468 k( 277) = ( 0.5000000 0.2886751 0.1415948), wk = 0.0032468 k( 278) = ( 0.5000000 0.2886751 0.1287226), wk = 0.0032468 k( 279) = ( 0.5000000 0.2886751 0.1158503), wk = 0.0032468 k( 280) = ( 0.5000000 0.2886751 0.1029781), wk = 0.0032468 k( 281) = ( 0.5000000 0.2886751 0.0901058), wk = 0.0032468 k( 282) = ( 0.5000000 0.2886751 0.0772336), wk = 0.0032468 k( 283) = ( 0.5000000 0.2886751 0.0643613), wk = 0.0032468 k( 284) = ( 0.5000000 0.2886751 0.0514890), wk = 0.0032468 k( 285) = ( 0.5000000 0.2886751 0.0386168), wk = 0.0032468 k( 286) = ( 0.5000000 0.2886751 0.0257445), wk = 0.0032468 k( 287) = ( 0.5000000 0.2886751 0.0128723), wk = 0.0032468 k( 288) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0032468 k( 289) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0032468 k( 290) = ( 0.3333333 0.5773503 0.0128723), wk = 0.0032468 k( 291) = ( 0.3333333 0.5773503 0.0257445), wk = 0.0032468 k( 292) = ( 0.3333333 0.5773503 0.0386168), wk = 0.0032468 k( 293) = ( 0.3333333 0.5773503 0.0514890), wk = 0.0032468 k( 294) = ( 0.3333333 0.5773503 0.0643613), wk = 0.0032468 k( 295) = ( 0.3333333 0.5773503 0.0772336), wk = 0.0032468 k( 296) = ( 0.3333333 0.5773503 0.0901058), wk = 0.0032468 k( 297) = ( 0.3333333 0.5773503 0.1029781), wk = 0.0032468 k( 298) = ( 0.3333333 0.5773503 0.1158503), wk = 0.0032468 k( 299) = ( 0.3333333 0.5773503 0.1287226), wk = 0.0032468 k( 300) = ( 0.3333333 0.5773503 0.1415948), wk = 0.0032468 k( 301) = ( 0.3333333 0.5773503 0.1544671), wk = 0.0032468 k( 302) = ( 0.3333333 0.5773503 0.1673394), wk = 0.0032468 k( 303) = ( 0.3333333 0.5773503 0.1802116), wk = 0.0032468 k( 304) = ( 0.3333333 0.5773503 0.1930839), wk = 0.0032468 k( 305) = ( 0.3333333 0.5773503 0.2059561), wk = 0.0032468 k( 306) = ( 0.3333333 0.5773503 0.2188284), wk = 0.0032468 k( 307) = ( 0.3333333 0.5773503 0.2317007), wk = 0.0032468 k( 308) = ( 0.3333333 0.5773503 0.2445729), wk = 0.0032468 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0113636 -0.0000000 0.0000000), wk = 0.0032468 k( 3) = ( 0.0227273 -0.0000000 0.0000000), wk = 0.0032468 k( 4) = ( 0.0340909 0.0000000 0.0000000), wk = 0.0032468 k( 5) = ( 0.0454546 -0.0000000 -0.0000000), wk = 0.0032468 k( 6) = ( 0.0568182 -0.0000000 0.0000000), wk = 0.0032468 k( 7) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0032468 k( 8) = ( 0.0795455 0.0000000 0.0000000), wk = 0.0032468 k( 9) = ( 0.0909091 -0.0000000 -0.0000000), wk = 0.0032468 k( 10) = ( 0.1022727 0.0000000 0.0000000), wk = 0.0032468 k( 11) = ( 0.1136364 -0.0000000 0.0000000), wk = 0.0032468 k( 12) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0032468 k( 13) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0032468 k( 14) = ( 0.1477273 -0.0000000 -0.0000000), wk = 0.0032468 k( 15) = ( 0.1590909 0.0000000 0.0000000), wk = 0.0032468 k( 16) = ( 0.1704546 0.0000000 0.0000000), wk = 0.0032468 k( 17) = ( 0.1818182 -0.0000000 -0.0000000), wk = 0.0032468 k( 18) = ( 0.1931818 0.0000000 -0.0000000), wk = 0.0032468 k( 19) = ( 0.2045454 0.0000000 0.0000000), wk = 0.0032468 k( 20) = ( 0.2159091 -0.0000000 0.0000000), wk = 0.0032468 k( 21) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0032468 k( 22) = ( 0.2386364 -0.0000000 0.0000000), wk = 0.0032468 k( 23) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0032468 k( 24) = ( 0.2613636 0.0000000 0.0000000), wk = 0.0032468 k( 25) = ( 0.2727273 0.0000000 0.0000000), wk = 0.0032468 k( 26) = ( 0.2840909 0.0000000 0.0000000), wk = 0.0032468 k( 27) = ( 0.2954545 0.0000000 0.0000000), wk = 0.0032468 k( 28) = ( 0.3068182 0.0000000 0.0000000), wk = 0.0032468 k( 29) = ( 0.3181818 0.0000000 0.0000000), wk = 0.0032468 k( 30) = ( 0.3295455 0.0000000 0.0000000), wk = 0.0032468 k( 31) = ( 0.3409091 -0.0000000 0.0000000), wk = 0.0032468 k( 32) = ( 0.3522727 -0.0000000 0.0000000), wk = 0.0032468 k( 33) = ( 0.3636364 -0.0000000 -0.0000000), wk = 0.0032468 k( 34) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0032468 k( 35) = ( 0.3863636 0.0000000 -0.0000000), wk = 0.0032468 k( 36) = ( 0.3977273 0.0000000 0.0000000), wk = 0.0032468 k( 37) = ( 0.4090909 0.0000000 -0.0000000), wk = 0.0032468 k( 38) = ( 0.4204545 -0.0000000 0.0000000), wk = 0.0032468 k( 39) = ( 0.4318182 -0.0000000 0.0000000), wk = 0.0032468 k( 40) = ( 0.4431818 0.0000000 0.0000000), wk = 0.0032468 k( 41) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0032468 k( 42) = ( 0.4659091 0.0000000 0.0000000), wk = 0.0032468 k( 43) = ( 0.4772727 0.0000000 0.0000000), wk = 0.0032468 k( 44) = ( 0.4886364 0.0000000 0.0000000), wk = 0.0032468 k( 45) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0032468 k( 46) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0032468 k( 47) = ( 0.4935897 0.0128205 0.0000000), wk = 0.0032468 k( 48) = ( 0.4871795 0.0256410 0.0000000), wk = 0.0032468 k( 49) = ( 0.4807692 0.0384615 0.0000000), wk = 0.0032468 k( 50) = ( 0.4743590 0.0512821 0.0000000), wk = 0.0032468 k( 51) = ( 0.4679487 0.0641026 0.0000000), wk = 0.0032468 k( 52) = ( 0.4615385 0.0769231 0.0000000), wk = 0.0032468 k( 53) = ( 0.4551282 0.0897436 0.0000000), wk = 0.0032468 k( 54) = ( 0.4487179 0.1025641 0.0000000), wk = 0.0032468 k( 55) = ( 0.4423077 0.1153846 0.0000000), wk = 0.0032468 k( 56) = ( 0.4358974 0.1282051 -0.0000000), wk = 0.0032468 k( 57) = ( 0.4294872 0.1410256 0.0000000), wk = 0.0032468 k( 58) = ( 0.4230769 0.1538461 0.0000000), wk = 0.0032468 k( 59) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0032468 k( 60) = ( 0.4102564 0.1794872 0.0000000), wk = 0.0032468 k( 61) = ( 0.4038462 0.1923077 0.0000000), wk = 0.0032468 k( 62) = ( 0.3974359 0.2051282 -0.0000000), wk = 0.0032468 k( 63) = ( 0.3910256 0.2179487 -0.0000000), wk = 0.0032468 k( 64) = ( 0.3846154 0.2307692 0.0000000), wk = 0.0032468 k( 65) = ( 0.3782051 0.2435897 0.0000000), wk = 0.0032468 k( 66) = ( 0.3717949 0.2564103 0.0000000), wk = 0.0032468 k( 67) = ( 0.3653846 0.2692308 0.0000000), wk = 0.0032468 k( 68) = ( 0.3589744 0.2820513 0.0000000), wk = 0.0032468 k( 69) = ( 0.3525641 0.2948718 0.0000000), wk = 0.0032468 k( 70) = ( 0.3461538 0.3076923 0.0000000), wk = 0.0032468 k( 71) = ( 0.3397436 0.3205128 0.0000000), wk = 0.0032468 k( 72) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0032468 k( 73) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0032468 k( 74) = ( 0.3267974 0.3267974 -0.0000000), wk = 0.0032468 k( 75) = ( 0.3202614 0.3202614 -0.0000000), wk = 0.0032468 k( 76) = ( 0.3137255 0.3137255 -0.0000000), wk = 0.0032468 k( 77) = ( 0.3071895 0.3071895 0.0000000), wk = 0.0032468 k( 78) = ( 0.3006536 0.3006536 0.0000000), wk = 0.0032468 k( 79) = ( 0.2941177 0.2941177 0.0000000), wk = 0.0032468 k( 80) = ( 0.2875817 0.2875817 -0.0000000), wk = 0.0032468 k( 81) = ( 0.2810457 0.2810457 -0.0000000), wk = 0.0032468 k( 82) = ( 0.2745098 0.2745098 0.0000000), wk = 0.0032468 k( 83) = ( 0.2679739 0.2679739 -0.0000000), wk = 0.0032468 k( 84) = ( 0.2614379 0.2614379 0.0000000), wk = 0.0032468 k( 85) = ( 0.2549020 0.2549020 0.0000000), wk = 0.0032468 k( 86) = ( 0.2483660 0.2483660 0.0000000), wk = 0.0032468 k( 87) = ( 0.2418301 0.2418301 -0.0000000), wk = 0.0032468 k( 88) = ( 0.2352941 0.2352941 0.0000000), wk = 0.0032468 k( 89) = ( 0.2287582 0.2287582 0.0000000), wk = 0.0032468 k( 90) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0032468 k( 91) = ( 0.2156863 0.2156863 0.0000000), wk = 0.0032468 k( 92) = ( 0.2091503 0.2091503 0.0000000), wk = 0.0032468 k( 93) = ( 0.2026144 0.2026144 0.0000000), wk = 0.0032468 k( 94) = ( 0.1960784 0.1960784 0.0000000), wk = 0.0032468 k( 95) = ( 0.1895425 0.1895425 0.0000000), wk = 0.0032468 k( 96) = ( 0.1830065 0.1830065 0.0000000), wk = 0.0032468 k( 97) = ( 0.1764706 0.1764706 -0.0000000), wk = 0.0032468 k( 98) = ( 0.1699346 0.1699346 0.0000000), wk = 0.0032468 k( 99) = ( 0.1633987 0.1633987 -0.0000000), wk = 0.0032468 k( 100) = ( 0.1568627 0.1568628 -0.0000000), wk = 0.0032468 k( 101) = ( 0.1503268 0.1503268 -0.0000000), wk = 0.0032468 k( 102) = ( 0.1437908 0.1437909 -0.0000000), wk = 0.0032468 k( 103) = ( 0.1372549 0.1372549 0.0000000), wk = 0.0032468 k( 104) = ( 0.1307190 0.1307190 0.0000000), wk = 0.0032468 k( 105) = ( 0.1241830 0.1241830 0.0000000), wk = 0.0032468 k( 106) = ( 0.1176471 0.1176471 0.0000000), wk = 0.0032468 k( 107) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0032468 k( 108) = ( 0.1045752 0.1045752 0.0000000), wk = 0.0032468 k( 109) = ( 0.0980392 0.0980392 0.0000000), wk = 0.0032468 k( 110) = ( 0.0915033 0.0915033 0.0000000), wk = 0.0032468 k( 111) = ( 0.0849673 0.0849673 0.0000000), wk = 0.0032468 k( 112) = ( 0.0784314 0.0784314 0.0000000), wk = 0.0032468 k( 113) = ( 0.0718954 0.0718954 -0.0000000), wk = 0.0032468 k( 114) = ( 0.0653595 0.0653595 0.0000000), wk = 0.0032468 k( 115) = ( 0.0588235 0.0588235 0.0000000), wk = 0.0032468 k( 116) = ( 0.0522876 0.0522876 0.0000000), wk = 0.0032468 k( 117) = ( 0.0457516 0.0457516 0.0000000), wk = 0.0032468 k( 118) = ( 0.0392157 0.0392157 0.0000000), wk = 0.0032468 k( 119) = ( 0.0326797 0.0326797 0.0000000), wk = 0.0032468 k( 120) = ( 0.0261438 0.0261438 0.0000000), wk = 0.0032468 k( 121) = ( 0.0196078 0.0196078 0.0000000), wk = 0.0032468 k( 122) = ( 0.0130719 0.0130719 0.0000000), wk = 0.0032468 k( 123) = ( 0.0065359 0.0065360 0.0000000), wk = 0.0032468 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 126) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0032468 k( 127) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0032468 k( 128) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0032468 k( 129) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0032468 k( 130) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0032468 k( 131) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0032468 k( 132) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0032468 k( 133) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0032468 k( 134) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0032468 k( 135) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0032468 k( 136) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0032468 k( 137) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0032468 k( 138) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0032468 k( 141) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0032468 k( 142) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0032468 k( 143) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0032468 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032468 k( 145) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032468 k( 146) = ( 0.0113636 -0.0000000 0.5000000), wk = 0.0032468 k( 147) = ( 0.0227273 -0.0000000 0.5000000), wk = 0.0032468 k( 148) = ( 0.0340909 0.0000000 0.5000000), wk = 0.0032468 k( 149) = ( 0.0454546 -0.0000000 0.5000000), wk = 0.0032468 k( 150) = ( 0.0568182 -0.0000000 0.5000000), wk = 0.0032468 k( 151) = ( 0.0681818 0.0000000 0.5000000), wk = 0.0032468 k( 152) = ( 0.0795455 0.0000000 0.5000000), wk = 0.0032468 k( 153) = ( 0.0909091 -0.0000000 0.5000000), wk = 0.0032468 k( 154) = ( 0.1022727 0.0000000 0.5000000), wk = 0.0032468 k( 155) = ( 0.1136364 -0.0000000 0.5000000), wk = 0.0032468 k( 156) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0032468 k( 157) = ( 0.1363636 0.0000000 0.5000000), wk = 0.0032468 k( 158) = ( 0.1477273 -0.0000000 0.5000000), wk = 0.0032468 k( 159) = ( 0.1590909 0.0000000 0.5000000), wk = 0.0032468 k( 160) = ( 0.1704546 0.0000000 0.5000000), wk = 0.0032468 k( 161) = ( 0.1818182 -0.0000000 0.5000000), wk = 0.0032468 k( 162) = ( 0.1931818 0.0000000 0.5000000), wk = 0.0032468 k( 163) = ( 0.2045454 0.0000000 0.5000000), wk = 0.0032468 k( 164) = ( 0.2159091 -0.0000000 0.5000000), wk = 0.0032468 k( 165) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0032468 k( 166) = ( 0.2386364 -0.0000000 0.5000000), wk = 0.0032468 k( 167) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0032468 k( 168) = ( 0.2613636 0.0000000 0.5000000), wk = 0.0032468 k( 169) = ( 0.2727273 0.0000000 0.5000000), wk = 0.0032468 k( 170) = ( 0.2840909 0.0000000 0.5000000), wk = 0.0032468 k( 171) = ( 0.2954545 0.0000000 0.5000000), wk = 0.0032468 k( 172) = ( 0.3068182 0.0000000 0.5000000), wk = 0.0032468 k( 173) = ( 0.3181818 0.0000000 0.5000000), wk = 0.0032468 k( 174) = ( 0.3295455 0.0000000 0.5000000), wk = 0.0032468 k( 175) = ( 0.3409091 -0.0000000 0.5000000), wk = 0.0032468 k( 176) = ( 0.3522727 -0.0000000 0.5000000), wk = 0.0032468 k( 177) = ( 0.3636364 -0.0000000 0.5000000), wk = 0.0032468 k( 178) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0032468 k( 179) = ( 0.3863636 0.0000000 0.5000000), wk = 0.0032468 k( 180) = ( 0.3977273 0.0000000 0.5000000), wk = 0.0032468 k( 181) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0032468 k( 182) = ( 0.4204545 -0.0000000 0.5000000), wk = 0.0032468 k( 183) = ( 0.4318182 -0.0000000 0.5000000), wk = 0.0032468 k( 184) = ( 0.4431818 0.0000000 0.5000000), wk = 0.0032468 k( 185) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0032468 k( 186) = ( 0.4659091 0.0000000 0.5000000), wk = 0.0032468 k( 187) = ( 0.4772727 0.0000000 0.5000000), wk = 0.0032468 k( 188) = ( 0.4886364 0.0000000 0.5000000), wk = 0.0032468 k( 189) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 k( 190) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 k( 191) = ( 0.4935897 0.0128205 0.5000000), wk = 0.0032468 k( 192) = ( 0.4871795 0.0256410 0.5000000), wk = 0.0032468 k( 193) = ( 0.4807692 0.0384615 0.5000000), wk = 0.0032468 k( 194) = ( 0.4743590 0.0512821 0.5000000), wk = 0.0032468 k( 195) = ( 0.4679487 0.0641026 0.5000000), wk = 0.0032468 k( 196) = ( 0.4615385 0.0769231 0.5000000), wk = 0.0032468 k( 197) = ( 0.4551282 0.0897436 0.5000000), wk = 0.0032468 k( 198) = ( 0.4487179 0.1025641 0.5000000), wk = 0.0032468 k( 199) = ( 0.4423077 0.1153846 0.5000000), wk = 0.0032468 k( 200) = ( 0.4358974 0.1282051 0.5000000), wk = 0.0032468 k( 201) = ( 0.4294872 0.1410256 0.5000000), wk = 0.0032468 k( 202) = ( 0.4230769 0.1538461 0.5000000), wk = 0.0032468 k( 203) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0032468 k( 204) = ( 0.4102564 0.1794872 0.5000000), wk = 0.0032468 k( 205) = ( 0.4038462 0.1923077 0.5000000), wk = 0.0032468 k( 206) = ( 0.3974359 0.2051282 0.5000000), wk = 0.0032468 k( 207) = ( 0.3910256 0.2179487 0.5000000), wk = 0.0032468 k( 208) = ( 0.3846154 0.2307692 0.5000000), wk = 0.0032468 k( 209) = ( 0.3782051 0.2435897 0.5000000), wk = 0.0032468 k( 210) = ( 0.3717949 0.2564103 0.5000000), wk = 0.0032468 k( 211) = ( 0.3653846 0.2692308 0.5000000), wk = 0.0032468 k( 212) = ( 0.3589744 0.2820513 0.5000000), wk = 0.0032468 k( 213) = ( 0.3525641 0.2948718 0.5000000), wk = 0.0032468 k( 214) = ( 0.3461538 0.3076923 0.5000000), wk = 0.0032468 k( 215) = ( 0.3397436 0.3205128 0.5000000), wk = 0.0032468 k( 216) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0032468 k( 217) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0032468 k( 218) = ( 0.3267974 0.3267974 0.5000000), wk = 0.0032468 k( 219) = ( 0.3202614 0.3202614 0.5000000), wk = 0.0032468 k( 220) = ( 0.3137255 0.3137255 0.5000000), wk = 0.0032468 k( 221) = ( 0.3071895 0.3071895 0.5000000), wk = 0.0032468 k( 222) = ( 0.3006536 0.3006536 0.5000000), wk = 0.0032468 k( 223) = ( 0.2941177 0.2941177 0.5000000), wk = 0.0032468 k( 224) = ( 0.2875817 0.2875817 0.5000000), wk = 0.0032468 k( 225) = ( 0.2810457 0.2810457 0.5000000), wk = 0.0032468 k( 226) = ( 0.2745098 0.2745098 0.5000000), wk = 0.0032468 k( 227) = ( 0.2679739 0.2679739 0.5000000), wk = 0.0032468 k( 228) = ( 0.2614379 0.2614379 0.5000000), wk = 0.0032468 k( 229) = ( 0.2549020 0.2549020 0.5000000), wk = 0.0032468 k( 230) = ( 0.2483660 0.2483660 0.5000000), wk = 0.0032468 k( 231) = ( 0.2418301 0.2418301 0.5000000), wk = 0.0032468 k( 232) = ( 0.2352941 0.2352941 0.5000000), wk = 0.0032468 k( 233) = ( 0.2287582 0.2287582 0.5000000), wk = 0.0032468 k( 234) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0032468 k( 235) = ( 0.2156863 0.2156863 0.5000000), wk = 0.0032468 k( 236) = ( 0.2091503 0.2091503 0.5000000), wk = 0.0032468 k( 237) = ( 0.2026144 0.2026144 0.5000000), wk = 0.0032468 k( 238) = ( 0.1960784 0.1960784 0.5000000), wk = 0.0032468 k( 239) = ( 0.1895425 0.1895425 0.5000000), wk = 0.0032468 k( 240) = ( 0.1830065 0.1830065 0.5000000), wk = 0.0032468 k( 241) = ( 0.1764706 0.1764706 0.5000000), wk = 0.0032468 k( 242) = ( 0.1699346 0.1699346 0.5000000), wk = 0.0032468 k( 243) = ( 0.1633987 0.1633987 0.5000000), wk = 0.0032468 k( 244) = ( 0.1568627 0.1568628 0.5000000), wk = 0.0032468 k( 245) = ( 0.1503268 0.1503268 0.5000000), wk = 0.0032468 k( 246) = ( 0.1437908 0.1437909 0.5000000), wk = 0.0032468 k( 247) = ( 0.1372549 0.1372549 0.5000000), wk = 0.0032468 k( 248) = ( 0.1307190 0.1307190 0.5000000), wk = 0.0032468 k( 249) = ( 0.1241830 0.1241830 0.5000000), wk = 0.0032468 k( 250) = ( 0.1176471 0.1176471 0.5000000), wk = 0.0032468 k( 251) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0032468 k( 252) = ( 0.1045752 0.1045752 0.5000000), wk = 0.0032468 k( 253) = ( 0.0980392 0.0980392 0.5000000), wk = 0.0032468 k( 254) = ( 0.0915033 0.0915033 0.5000000), wk = 0.0032468 k( 255) = ( 0.0849673 0.0849673 0.5000000), wk = 0.0032468 k( 256) = ( 0.0784314 0.0784314 0.5000000), wk = 0.0032468 k( 257) = ( 0.0718954 0.0718954 0.5000000), wk = 0.0032468 k( 258) = ( 0.0653595 0.0653595 0.5000000), wk = 0.0032468 k( 259) = ( 0.0588235 0.0588235 0.5000000), wk = 0.0032468 k( 260) = ( 0.0522876 0.0522876 0.5000000), wk = 0.0032468 k( 261) = ( 0.0457516 0.0457516 0.5000000), wk = 0.0032468 k( 262) = ( 0.0392157 0.0392157 0.5000000), wk = 0.0032468 k( 263) = ( 0.0326797 0.0326797 0.5000000), wk = 0.0032468 k( 264) = ( 0.0261438 0.0261438 0.5000000), wk = 0.0032468 k( 265) = ( 0.0196078 0.0196078 0.5000000), wk = 0.0032468 k( 266) = ( 0.0130719 0.0130719 0.5000000), wk = 0.0032468 k( 267) = ( 0.0065359 0.0065360 0.5000000), wk = 0.0032468 k( 268) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032468 k( 269) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 k( 270) = ( 0.5000000 0.0000000 0.4736842), wk = 0.0032468 k( 271) = ( 0.5000000 0.0000000 0.4473684), wk = 0.0032468 k( 272) = ( 0.5000000 0.0000000 0.4210526), wk = 0.0032468 k( 273) = ( 0.5000000 0.0000000 0.3947368), wk = 0.0032468 k( 274) = ( 0.5000000 0.0000000 0.3684211), wk = 0.0032468 k( 275) = ( 0.5000000 0.0000000 0.3421053), wk = 0.0032468 k( 276) = ( 0.5000000 0.0000000 0.3157895), wk = 0.0032468 k( 277) = ( 0.5000000 0.0000000 0.2894737), wk = 0.0032468 k( 278) = ( 0.5000000 0.0000000 0.2631579), wk = 0.0032468 k( 279) = ( 0.5000000 0.0000000 0.2368421), wk = 0.0032468 k( 280) = ( 0.5000000 0.0000000 0.2105263), wk = 0.0032468 k( 281) = ( 0.5000000 0.0000000 0.1842105), wk = 0.0032468 k( 282) = ( 0.5000000 0.0000000 0.1578947), wk = 0.0032468 k( 283) = ( 0.5000000 0.0000000 0.1315790), wk = 0.0032468 k( 284) = ( 0.5000000 0.0000000 0.1052632), wk = 0.0032468 k( 285) = ( 0.5000000 0.0000000 0.0789474), wk = 0.0032468 k( 286) = ( 0.5000000 0.0000000 0.0526316), wk = 0.0032468 k( 287) = ( 0.5000000 0.0000000 0.0263158), wk = 0.0032468 k( 288) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0032468 k( 289) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0032468 k( 290) = ( 0.3333333 0.3333333 0.0263158), wk = 0.0032468 k( 291) = ( 0.3333333 0.3333333 0.0526316), wk = 0.0032468 k( 292) = ( 0.3333333 0.3333333 0.0789474), wk = 0.0032468 k( 293) = ( 0.3333333 0.3333333 0.1052632), wk = 0.0032468 k( 294) = ( 0.3333333 0.3333333 0.1315790), wk = 0.0032468 k( 295) = ( 0.3333333 0.3333333 0.1578947), wk = 0.0032468 k( 296) = ( 0.3333333 0.3333333 0.1842105), wk = 0.0032468 k( 297) = ( 0.3333333 0.3333333 0.2105263), wk = 0.0032468 k( 298) = ( 0.3333333 0.3333333 0.2368421), wk = 0.0032468 k( 299) = ( 0.3333333 0.3333333 0.2631579), wk = 0.0032468 k( 300) = ( 0.3333333 0.3333333 0.2894737), wk = 0.0032468 k( 301) = ( 0.3333333 0.3333333 0.3157895), wk = 0.0032468 k( 302) = ( 0.3333333 0.3333333 0.3421053), wk = 0.0032468 k( 303) = ( 0.3333333 0.3333333 0.3684211), wk = 0.0032468 k( 304) = ( 0.3333333 0.3333333 0.3947368), wk = 0.0032468 k( 305) = ( 0.3333333 0.3333333 0.4210526), wk = 0.0032468 k( 306) = ( 0.3333333 0.3333333 0.4473684), wk = 0.0032468 k( 307) = ( 0.3333333 0.3333333 0.4736842), wk = 0.0032468 k( 308) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0032468 Dense grid: 61289 G-vectors FFT dimensions: ( 45, 45, 90) Smooth grid: 35865 G-vectors FFT dimensions: ( 36, 36, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.24 Mb ( 254, 62) NL pseudopotentials 0.40 Mb ( 127, 204) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.01 Mb ( 1698) G-vector shells 0.01 Mb ( 806) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.96 Mb ( 254, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.39 Mb ( 204, 2, 62) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./SrCuP.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 4.0 secs Computing kpt #: 3 total cpu time spent up to now is 4.5 secs Computing kpt #: 4 total cpu time spent up to now is 5.1 secs Computing kpt #: 5 total cpu time spent up to now is 5.7 secs Computing kpt #: 6 total cpu time spent up to now is 6.2 secs Computing kpt #: 7 total cpu time spent up to now is 6.8 secs Computing kpt #: 8 total cpu time spent up to now is 7.5 secs Computing kpt #: 9 total cpu time spent up to now is 8.0 secs Computing kpt #: 10 total cpu time spent up to now is 8.6 secs Computing kpt #: 11 total cpu time spent up to now is 9.2 secs Computing kpt #: 12 total cpu time spent up to now is 9.8 secs Computing kpt #: 13 total cpu time spent up to now is 10.4 secs Computing kpt #: 14 total cpu time spent up to now is 10.9 secs Computing kpt #: 15 total cpu time spent up to now is 11.5 secs Computing kpt #: 16 total cpu time spent up to now is 12.2 secs Computing kpt #: 17 total cpu time spent up to now is 12.8 secs Computing kpt #: 18 total cpu time spent up to now is 13.5 secs Computing kpt #: 19 total cpu time spent up to now is 14.1 secs Computing kpt #: 20 total cpu time spent up to now is 14.8 secs Computing kpt #: 21 total cpu time spent up to now is 15.5 secs Computing kpt #: 22 total cpu time spent up to now is 16.1 secs Computing kpt #: 23 total cpu time spent up to now is 16.7 secs Computing kpt #: 24 total cpu time spent up to now is 17.2 secs Computing kpt #: 25 total cpu time spent up to now is 17.8 secs Computing kpt #: 26 total cpu time spent up to now is 18.3 secs Computing kpt #: 27 total cpu time spent up to now is 18.9 secs Computing kpt #: 28 total cpu time spent up to now is 19.5 secs Computing kpt #: 29 total cpu time spent up to now is 20.0 secs Computing kpt #: 30 total cpu time spent up to now is 20.6 secs Computing kpt #: 31 total cpu time spent up to now is 21.1 secs Computing kpt #: 32 total cpu time spent up to now is 21.7 secs Computing kpt #: 33 total cpu time spent up to now is 22.3 secs Computing kpt #: 34 total cpu time spent up to now is 22.8 secs Computing kpt #: 35 total cpu time spent up to now is 23.4 secs Computing kpt #: 36 total cpu time spent up to now is 24.0 secs Computing kpt #: 37 total cpu time spent up to now is 24.6 secs Computing kpt #: 38 total cpu time spent up to now is 25.1 secs Computing kpt #: 39 total cpu time spent up to now is 25.7 secs Computing kpt #: 40 total cpu time spent up to now is 26.2 secs Computing kpt #: 41 total cpu time spent up to now is 26.8 secs Computing kpt #: 42 total cpu time spent up to now is 27.4 secs Computing kpt #: 43 total cpu time spent up to now is 27.9 secs Computing kpt #: 44 total cpu time spent up to now is 28.5 secs Computing kpt #: 45 total cpu time spent up to now is 29.0 secs Computing kpt #: 46 total cpu time spent up to now is 29.5 secs Computing kpt #: 47 total cpu time spent up to now is 30.1 secs Computing kpt #: 48 total cpu time spent up to now is 30.6 secs Computing kpt #: 49 total cpu time spent up to now is 31.2 secs Computing kpt #: 50 total cpu time spent up to now is 31.7 secs Computing kpt #: 51 total cpu time spent up to now is 32.3 secs Computing kpt #: 52 total cpu time spent up to now is 32.8 secs Computing kpt #: 53 total cpu time spent up to now is 33.4 secs Computing kpt #: 54 total cpu time spent up to now is 34.0 secs Computing kpt #: 55 total cpu time spent up to now is 34.5 secs Computing kpt #: 56 total cpu time spent up to now is 35.1 secs Computing kpt #: 57 total cpu time spent up to now is 35.7 secs Computing kpt #: 58 total cpu time spent up to now is 36.3 secs Computing kpt #: 59 total cpu time spent up to now is 36.9 secs Computing kpt #: 60 total cpu time spent up to now is 37.6 secs Computing kpt #: 61 total cpu time spent up to now is 38.2 secs Computing kpt #: 62 total cpu time spent up to now is 38.9 secs Computing kpt #: 63 total cpu time spent up to now is 39.6 secs Computing kpt #: 64 total cpu time spent up to now is 40.3 secs Computing kpt #: 65 total cpu time spent up to now is 40.9 secs Computing kpt #: 66 total cpu time spent up to now is 41.6 secs Computing kpt #: 67 total cpu time spent up to now is 42.3 secs Computing kpt #: 68 total cpu time spent up to now is 43.0 secs Computing kpt #: 69 total cpu time spent up to now is 43.7 secs Computing kpt #: 70 total cpu time spent up to now is 44.3 secs Computing kpt #: 71 total cpu time spent up to now is 45.0 secs Computing kpt #: 72 total cpu time spent up to now is 45.6 secs Computing kpt #: 73 total cpu time spent up to now is 46.3 secs Computing kpt #: 74 total cpu time spent up to now is 46.9 secs Computing kpt #: 75 total cpu time spent up to now is 47.6 secs Computing kpt #: 76 total cpu time spent up to now is 48.3 secs Computing kpt #: 77 total cpu time spent up to now is 48.9 secs Computing kpt #: 78 total cpu time spent up to now is 49.6 secs Computing kpt #: 79 total cpu time spent up to now is 50.3 secs Computing kpt #: 80 total cpu time spent up to now is 51.0 secs Computing kpt #: 81 total cpu time spent up to now is 51.7 secs Computing kpt #: 82 total cpu time spent up to now is 52.3 secs Computing kpt #: 83 total cpu time spent up to now is 52.9 secs Computing kpt #: 84 total cpu time spent up to now is 53.4 secs Computing kpt #: 85 total cpu time spent up to now is 54.0 secs Computing kpt #: 86 total cpu time spent up to now is 54.5 secs Computing kpt #: 87 total cpu time spent up to now is 55.0 secs Computing kpt #: 88 total cpu time spent up to now is 55.6 secs Computing kpt #: 89 total cpu time spent up to now is 56.1 secs Computing kpt #: 90 total cpu time spent up to now is 56.6 secs Computing kpt #: 91 total cpu time spent up to now is 57.2 secs Computing kpt #: 92 total cpu time spent up to now is 57.7 secs Computing kpt #: 93 total cpu time spent up to now is 58.2 secs Computing kpt #: 94 total cpu time spent up to now is 58.7 secs Computing kpt #: 95 total cpu time spent up to now is 59.3 secs Computing kpt #: 96 total cpu time spent up to now is 60.0 secs Computing kpt #: 97 total cpu time spent up to now is 60.8 secs Computing kpt #: 98 total cpu time spent up to now is 61.4 secs Computing kpt #: 99 total cpu time spent up to now is 62.0 secs Computing kpt #: 100 total cpu time spent up to now is 62.5 secs Computing kpt #: 101 total cpu time spent up to now is 63.1 secs Computing kpt #: 102 total cpu time spent up to now is 63.7 secs Computing kpt #: 103 total cpu time spent up to now is 64.2 secs Computing kpt #: 104 total cpu time spent up to now is 64.9 secs Computing kpt #: 105 total cpu time spent up to now is 65.5 secs Computing kpt #: 106 total cpu time spent up to now is 66.1 secs Computing kpt #: 107 total cpu time spent up to now is 66.7 secs Computing kpt #: 108 total cpu time spent up to now is 67.3 secs Computing kpt #: 109 total cpu time spent up to now is 68.0 secs Computing kpt #: 110 total cpu time spent up to now is 68.6 secs Computing kpt #: 111 total cpu time spent up to now is 69.2 secs Computing kpt #: 112 total cpu time spent up to now is 69.9 secs Computing kpt #: 113 total cpu time spent up to now is 70.5 secs Computing kpt #: 114 total cpu time spent up to now is 71.1 secs Computing kpt #: 115 total cpu time spent up to now is 71.8 secs Computing kpt #: 116 total cpu time spent up to now is 72.4 secs Computing kpt #: 117 total cpu time spent up to now is 73.0 secs Computing kpt #: 118 total cpu time spent up to now is 73.6 secs Computing kpt #: 119 total cpu time spent up to now is 74.2 secs Computing kpt #: 120 total cpu time spent up to now is 74.8 secs Computing kpt #: 121 total cpu time spent up to now is 75.3 secs Computing kpt #: 122 total cpu time spent up to now is 75.9 secs Computing kpt #: 123 total cpu time spent up to now is 76.5 secs Computing kpt #: 124 total cpu time spent up to now is 77.0 secs Computing kpt #: 125 total cpu time spent up to now is 77.6 secs Computing kpt #: 126 total cpu time spent up to now is 78.1 secs Computing kpt #: 127 total cpu time spent up to now is 78.7 secs Computing kpt #: 128 total cpu time spent up to now is 79.3 secs Computing kpt #: 129 total cpu time spent up to now is 79.9 secs Computing kpt #: 130 total cpu time spent up to now is 80.4 secs Computing kpt #: 131 total cpu time spent up to now is 81.0 secs Computing kpt #: 132 total cpu time spent up to now is 81.6 secs Computing kpt #: 133 total cpu time spent up to now is 82.1 secs Computing kpt #: 134 total cpu time spent up to now is 82.7 secs Computing kpt #: 135 total cpu time spent up to now is 83.3 secs Computing kpt #: 136 total cpu time spent up to now is 83.8 secs Computing kpt #: 137 total cpu time spent up to now is 84.5 secs Computing kpt #: 138 total cpu time spent up to now is 85.1 secs Computing kpt #: 139 total cpu time spent up to now is 85.7 secs Computing kpt #: 140 total cpu time spent up to now is 86.3 secs Computing kpt #: 141 total cpu time spent up to now is 86.9 secs Computing kpt #: 142 total cpu time spent up to now is 87.5 secs Computing kpt #: 143 total cpu time spent up to now is 88.1 secs Computing kpt #: 144 total cpu time spent up to now is 88.8 secs Computing kpt #: 145 total cpu time spent up to now is 89.4 secs Computing kpt #: 146 total cpu time spent up to now is 90.0 secs Computing kpt #: 147 total cpu time spent up to now is 90.5 secs Computing kpt #: 148 total cpu time spent up to now is 91.1 secs Computing kpt #: 149 total cpu time spent up to now is 91.7 secs Computing kpt #: 150 total cpu time spent up to now is 92.3 secs Computing kpt #: 151 total cpu time spent up to now is 92.9 secs Computing kpt #: 152 total cpu time spent up to now is 93.5 secs Computing kpt #: 153 total cpu time spent up to now is 94.0 secs Computing kpt #: 154 total cpu time spent up to now is 94.6 secs Computing kpt #: 155 total cpu time spent up to now is 95.2 secs Computing kpt #: 156 total cpu time spent up to now is 95.8 secs Computing kpt #: 157 total cpu time spent up to now is 96.3 secs Computing kpt #: 158 total cpu time spent up to now is 96.9 secs Computing kpt #: 159 total cpu time spent up to now is 97.4 secs Computing kpt #: 160 total cpu time spent up to now is 98.0 secs Computing kpt #: 161 total cpu time spent up to now is 98.6 secs Computing kpt #: 162 total cpu time spent up to now is 99.1 secs Computing kpt #: 163 total cpu time spent up to now is 99.7 secs Computing kpt #: 164 total cpu time spent up to now is 100.3 secs Computing kpt #: 165 total cpu time spent up to now is 100.9 secs Computing kpt #: 166 total cpu time spent up to now is 101.6 secs Computing kpt #: 167 total cpu time spent up to now is 102.2 secs Computing kpt #: 168 total cpu time spent up to now is 102.9 secs Computing kpt #: 169 total cpu time spent up to now is 103.5 secs Computing kpt #: 170 total cpu time spent up to now is 104.1 secs Computing kpt #: 171 total cpu time spent up to now is 104.8 secs Computing kpt #: 172 total cpu time spent up to now is 105.4 secs Computing kpt #: 173 total cpu time spent up to now is 106.0 secs Computing kpt #: 174 total cpu time spent up to now is 106.6 secs Computing kpt #: 175 total cpu time spent up to now is 107.3 secs Computing kpt #: 176 total cpu time spent up to now is 107.9 secs Computing kpt #: 177 total cpu time spent up to now is 108.5 secs Computing kpt #: 178 total cpu time spent up to now is 109.1 secs Computing kpt #: 179 total cpu time spent up to now is 109.8 secs Computing kpt #: 180 total cpu time spent up to now is 110.5 secs Computing kpt #: 181 total cpu time spent up to now is 111.2 secs Computing kpt #: 182 total cpu time spent up to now is 111.9 secs Computing kpt #: 183 total cpu time spent up to now is 112.6 secs Computing kpt #: 184 total cpu time spent up to now is 113.2 secs Computing kpt #: 185 total cpu time spent up to now is 113.8 secs Computing kpt #: 186 total cpu time spent up to now is 114.5 secs Computing kpt #: 187 total cpu time spent up to now is 115.2 secs Computing kpt #: 188 total cpu time spent up to now is 115.8 secs Computing kpt #: 189 total cpu time spent up to now is 116.5 secs Computing kpt #: 190 total cpu time spent up to now is 117.2 secs Computing kpt #: 191 total cpu time spent up to now is 118.0 secs Computing kpt #: 192 total cpu time spent up to now is 118.9 secs Computing kpt #: 193 total cpu time spent up to now is 119.9 secs Computing kpt #: 194 total cpu time spent up to now is 120.8 secs Computing kpt #: 195 total cpu time spent up to now is 121.5 secs Computing kpt #: 196 total cpu time spent up to now is 122.3 secs Computing kpt #: 197 total cpu time spent up to now is 123.1 secs Computing kpt #: 198 total cpu time spent up to now is 123.8 secs Computing kpt #: 199 total cpu time spent up to now is 124.5 secs Computing kpt #: 200 total cpu time spent up to now is 125.2 secs Computing kpt #: 201 total cpu time spent up to now is 125.8 secs Computing kpt #: 202 total cpu time spent up to now is 126.6 secs Computing kpt #: 203 total cpu time spent up to now is 127.3 secs Computing kpt #: 204 total cpu time spent up to now is 127.8 secs Computing kpt #: 205 total cpu time spent up to now is 128.6 secs Computing kpt #: 206 total cpu time spent up to now is 129.3 secs Computing kpt #: 207 total cpu time spent up to now is 130.1 secs Computing kpt #: 208 total cpu time spent up to now is 130.8 secs Computing kpt #: 209 total cpu time spent up to now is 131.6 secs Computing kpt #: 210 total cpu time spent up to now is 132.3 secs Computing kpt #: 211 total cpu time spent up to now is 133.1 secs Computing kpt #: 212 total cpu time spent up to now is 133.8 secs Computing kpt #: 213 total cpu time spent up to now is 134.4 secs Computing kpt #: 214 total cpu time spent up to now is 135.3 secs Computing kpt #: 215 total cpu time spent up to now is 137.0 secs Computing kpt #: 216 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 138.8 secs Computing kpt #: 217 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 140.6 secs Computing kpt #: 218 total cpu time spent up to now is 141.4 secs Computing kpt #: 219 total cpu time spent up to now is 142.1 secs Computing kpt #: 220 total cpu time spent up to now is 142.9 secs Computing kpt #: 221 total cpu time spent up to now is 143.6 secs Computing kpt #: 222 total cpu time spent up to now is 144.3 secs Computing kpt #: 223 total cpu time spent up to now is 144.9 secs Computing kpt #: 224 total cpu time spent up to now is 145.6 secs Computing kpt #: 225 total cpu time spent up to now is 146.3 secs Computing kpt #: 226 total cpu time spent up to now is 147.0 secs Computing kpt #: 227 total cpu time spent up to now is 147.8 secs Computing kpt #: 228 total cpu time spent up to now is 148.6 secs Computing kpt #: 229 total cpu time spent up to now is 149.3 secs Computing kpt #: 230 total cpu time spent up to now is 150.0 secs Computing kpt #: 231 total cpu time spent up to now is 150.7 secs Computing kpt #: 232 total cpu time spent up to now is 151.3 secs Computing kpt #: 233 total cpu time spent up to now is 152.0 secs Computing kpt #: 234 total cpu time spent up to now is 152.7 secs Computing kpt #: 235 total cpu time spent up to now is 153.3 secs Computing kpt #: 236 total cpu time spent up to now is 153.9 secs Computing kpt #: 237 total cpu time spent up to now is 154.6 secs Computing kpt #: 238 total cpu time spent up to now is 155.2 secs Computing kpt #: 239 total cpu time spent up to now is 155.8 secs Computing kpt #: 240 total cpu time spent up to now is 156.4 secs Computing kpt #: 241 total cpu time spent up to now is 157.0 secs Computing kpt #: 242 total cpu time spent up to now is 157.6 secs Computing kpt #: 243 total cpu time spent up to now is 158.2 secs Computing kpt #: 244 total cpu time spent up to now is 158.8 secs Computing kpt #: 245 total cpu time spent up to now is 159.4 secs Computing kpt #: 246 total cpu time spent up to now is 160.1 secs Computing kpt #: 247 total cpu time spent up to now is 160.6 secs Computing kpt #: 248 total cpu time spent up to now is 161.3 secs Computing kpt #: 249 total cpu time spent up to now is 161.8 secs Computing kpt #: 250 total cpu time spent up to now is 162.4 secs Computing kpt #: 251 total cpu time spent up to now is 163.0 secs Computing kpt #: 252 total cpu time spent up to now is 163.6 secs Computing kpt #: 253 total cpu time spent up to now is 164.1 secs Computing kpt #: 254 total cpu time spent up to now is 164.7 secs Computing kpt #: 255 total cpu time spent up to now is 165.3 secs Computing kpt #: 256 total cpu time spent up to now is 165.9 secs Computing kpt #: 257 total cpu time spent up to now is 166.5 secs Computing kpt #: 258 total cpu time spent up to now is 167.1 secs Computing kpt #: 259 total cpu time spent up to now is 167.6 secs Computing kpt #: 260 total cpu time spent up to now is 168.2 secs Computing kpt #: 261 total cpu time spent up to now is 168.8 secs Computing kpt #: 262 total cpu time spent up to now is 169.4 secs Computing kpt #: 263 total cpu time spent up to now is 170.0 secs Computing kpt #: 264 total cpu time spent up to now is 170.6 secs Computing kpt #: 265 total cpu time spent up to now is 171.2 secs Computing kpt #: 266 total cpu time spent up to now is 171.9 secs Computing kpt #: 267 total cpu time spent up to now is 172.5 secs Computing kpt #: 268 total cpu time spent up to now is 173.1 secs Computing kpt #: 269 total cpu time spent up to now is 173.7 secs Computing kpt #: 270 total cpu time spent up to now is 174.4 secs Computing kpt #: 271 total cpu time spent up to now is 175.1 secs Computing kpt #: 272 total cpu time spent up to now is 175.8 secs Computing kpt #: 273 total cpu time spent up to now is 176.4 secs Computing kpt #: 274 total cpu time spent up to now is 177.0 secs Computing kpt #: 275 total cpu time spent up to now is 177.6 secs Computing kpt #: 276 total cpu time spent up to now is 178.2 secs Computing kpt #: 277 total cpu time spent up to now is 178.8 secs Computing kpt #: 278 total cpu time spent up to now is 179.5 secs Computing kpt #: 279 total cpu time spent up to now is 180.2 secs Computing kpt #: 280 total cpu time spent up to now is 180.9 secs Computing kpt #: 281 total cpu time spent up to now is 181.5 secs Computing kpt #: 282 total cpu time spent up to now is 182.3 secs Computing kpt #: 283 total cpu time spent up to now is 183.0 secs Computing kpt #: 284 total cpu time spent up to now is 183.5 secs Computing kpt #: 285 total cpu time spent up to now is 184.1 secs Computing kpt #: 286 total cpu time spent up to now is 184.6 secs Computing kpt #: 287 total cpu time spent up to now is 185.2 secs Computing kpt #: 288 total cpu time spent up to now is 185.7 secs Computing kpt #: 289 total cpu time spent up to now is 186.4 secs Computing kpt #: 290 total cpu time spent up to now is 187.0 secs Computing kpt #: 291 total cpu time spent up to now is 187.7 secs Computing kpt #: 292 total cpu time spent up to now is 188.3 secs Computing kpt #: 293 total cpu time spent up to now is 189.0 secs Computing kpt #: 294 total cpu time spent up to now is 189.7 secs Computing kpt #: 295 total cpu time spent up to now is 190.3 secs Computing kpt #: 296 total cpu time spent up to now is 191.0 secs Computing kpt #: 297 total cpu time spent up to now is 191.7 secs Computing kpt #: 298 total cpu time spent up to now is 192.3 secs Computing kpt #: 299 total cpu time spent up to now is 193.0 secs Computing kpt #: 300 total cpu time spent up to now is 193.7 secs Computing kpt #: 301 total cpu time spent up to now is 194.4 secs Computing kpt #: 302 total cpu time spent up to now is 195.1 secs Computing kpt #: 303 total cpu time spent up to now is 195.8 secs Computing kpt #: 304 total cpu time spent up to now is 196.5 secs Computing kpt #: 305 total cpu time spent up to now is 197.2 secs Computing kpt #: 306 total cpu time spent up to now is 198.0 secs Computing kpt #: 307 total cpu time spent up to now is 198.6 secs Computing kpt #: 308 total cpu time spent up to now is 200.0 secs ethr = 1.92E-08, avg # of iterations = 20.9 total cpu time spent up to now is 200.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4553 PWs) bands (ev): -25.8523 -25.8523 -25.8452 -25.8452 -8.7104 -8.7104 -8.6377 -8.6377 -7.6637 -7.6637 -7.5072 -7.5072 -7.4818 -7.4818 -7.4640 -7.4640 -1.6508 -1.6508 -0.9393 -0.9393 5.0397 5.0397 5.1391 5.1391 5.2614 5.2614 5.3143 5.3143 5.4479 5.4479 5.9641 5.9641 6.2566 6.2566 6.2700 6.2700 6.3233 6.3233 6.4594 6.4594 6.5517 6.5517 7.7759 7.7759 9.0114 9.0114 9.0615 9.0615 9.6603 9.6603 9.6938 9.6938 10.2339 10.2339 10.7183 10.7183 10.9261 10.9261 11.6996 11.6996 11.7083 11.7083 k = 0.0114 0.0066-0.0000 ( 4535 PWs) bands (ev): -25.8523 -25.8523 -25.8452 -25.8452 -8.7104 -8.7104 -8.6378 -8.6378 -7.6637 -7.6637 -7.5072 -7.5072 -7.4821 -7.4821 -7.4642 -7.4642 -1.6496 -1.6496 -0.9391 -0.9391 5.0409 5.0409 5.1393 5.1393 5.2614 5.2614 5.3142 5.3142 5.4476 5.4476 5.9645 5.9645 6.2568 6.2568 6.2699 6.2699 6.3231 6.3231 6.4597 6.4597 6.5517 6.5517 7.7759 7.7759 9.0052 9.0052 9.0561 9.0561 9.6437 9.6437 9.6812 9.6812 10.2426 10.2426 10.7300 10.7300 10.9353 10.9353 11.7071 11.7071 11.7160 11.7160 k = 0.0227 0.0131-0.0000 ( 4523 PWs) bands (ev): -25.8522 -25.8522 -25.8451 -25.8451 -8.7105 -8.7105 -8.6382 -8.6382 -7.6636 -7.6636 -7.5074 -7.5074 -7.4829 -7.4829 -7.4648 -7.4648 -1.6459 -1.6459 -0.9383 -0.9383 5.0446 5.0446 5.1396 5.1396 5.2610 5.2610 5.3138 5.3138 5.4464 5.4464 5.9655 5.9655 6.2573 6.2573 6.2696 6.2696 6.3224 6.3224 6.4604 6.4604 6.5517 6.5517 7.7759 7.7759 8.9830 8.9830 9.0442 9.0442 9.5869 9.5869 9.6571 9.6571 10.2636 10.2636 10.7630 10.7630 10.9625 10.9625 11.7294 11.7294 11.7395 11.7395 k = 0.0341 0.0197-0.0000 ( 4529 PWs) bands (ev): -25.8521 -25.8521 -25.8450 -25.8450 -8.7107 -8.7107 -8.6387 -8.6387 -7.6636 -7.6636 -7.5077 -7.5077 -7.4841 -7.4841 -7.4659 -7.4659 -1.6399 -1.6399 -0.9369 -0.9369 5.0506 5.0506 5.1400 5.1400 5.2604 5.2604 5.3127 5.3127 5.4445 5.4445 5.9671 5.9671 6.2580 6.2580 6.2689 6.2689 6.3213 6.3213 6.4615 6.4615 6.5518 6.5518 7.7760 7.7760 8.9405 8.9405 9.0318 9.0318 9.4991 9.4991 9.6256 9.6256 10.2884 10.2884 10.8118 10.8118 11.0062 11.0062 11.7653 11.7653 11.7797 11.7797 k = 0.0455 0.0262-0.0000 ( 4521 PWs) bands (ev): -25.8520 -25.8520 -25.8449 -25.8449 -8.7110 -8.7110 -8.6396 -8.6396 -7.6636 -7.6636 -7.5081 -7.5081 -7.4859 -7.4859 -7.4674 -7.4674 -1.6314 -1.6314 -0.9350 -0.9350 5.0590 5.0590 5.1403 5.1403 5.2596 5.2596 5.3109 5.3109 5.4424 5.4424 5.9693 5.9693 6.2592 6.2592 6.2680 6.2680 6.3199 6.3199 6.4632 6.4632 6.5519 6.5519 7.7762 7.7762 8.8802 8.8802 9.0194 9.0194 9.3936 9.3936 9.5852 9.5852 10.3123 10.3123 10.8674 10.8674 11.0662 11.0662 11.8131 11.8131 11.8380 11.8380 k = 0.0568 0.0328-0.0000 ( 4521 PWs) bands (ev): -25.8518 -25.8518 -25.8447 -25.8447 -8.7113 -8.7113 -8.6406 -8.6406 -7.6636 -7.6636 -7.5088 -7.5088 -7.4880 -7.4880 -7.4693 -7.4693 -1.6205 -1.6205 -0.9326 -0.9326 5.0697 5.0697 5.1404 5.1404 5.2587 5.2587 5.3079 5.3079 5.4405 5.4405 5.9721 5.9721 6.2605 6.2605 6.2666 6.2666 6.3184 6.3184 6.4654 6.4654 6.5521 6.5521 7.7765 7.7765 8.8060 8.8060 9.0056 9.0056 9.2783 9.2783 9.5364 9.5364 10.3343 10.3343 10.9201 10.9201 11.1430 11.1430 11.8713 11.8713 11.9142 11.9142 k = 0.0682 0.0394-0.0000 ( 4525 PWs) bands (ev): -25.8515 -25.8515 -25.8445 -25.8445 -8.7117 -8.7117 -8.6419 -8.6419 -7.6635 -7.6635 -7.5097 -7.5097 -7.4903 -7.4903 -7.4716 -7.4716 -1.6073 -1.6073 -0.9297 -0.9297 5.0825 5.0825 5.1401 5.1401 5.2576 5.2576 5.3036 5.3036 5.4392 5.4392 5.9754 5.9754 6.2621 6.2621 6.2646 6.2646 6.3168 6.3168 6.4680 6.4680 6.5525 6.5525 7.7769 7.7769 8.7212 8.7212 8.9895 8.9895 9.1581 9.1581 9.4802 9.4802 10.3549 10.3549 10.9639 10.9639 11.2357 11.2357 11.9386 11.9386 12.0070 12.0070 k = 0.0795 0.0459-0.0000 ( 4529 PWs) bands (ev): -25.8513 -25.8513 -25.8442 -25.8442 -8.7122 -8.7122 -8.6434 -8.6434 -7.6635 -7.6635 -7.5111 -7.5111 -7.4928 -7.4928 -7.4742 -7.4742 -1.5919 -1.5919 -0.9262 -0.9262 5.0973 5.0973 5.1390 5.1390 5.2558 5.2558 5.2982 5.2982 5.4391 5.4391 5.9791 5.9791 6.2619 6.2619 6.2639 6.2639 6.3154 6.3154 6.4711 6.4711 6.5531 6.5531 7.7776 7.7776 8.6284 8.6284 8.9695 8.9695 9.0372 9.0372 9.4181 9.4181 10.3749 10.3749 10.9977 10.9977 11.3411 11.3411 12.0137 12.0137 12.1116 12.1116 k = 0.0909 0.0525-0.0000 ( 4525 PWs) bands (ev): -25.8510 -25.8510 -25.8439 -25.8439 -8.7127 -8.7127 -8.6451 -8.6451 -7.6635 -7.6635 -7.5130 -7.5130 -7.4952 -7.4952 -7.4773 -7.4773 -1.5741 -1.5741 -0.9222 -0.9222 5.1139 5.1139 5.1371 5.1371 5.2521 5.2521 5.2929 5.2929 5.4405 5.4405 5.9833 5.9833 6.2586 6.2586 6.2658 6.2658 6.3143 6.3143 6.4747 6.4747 6.5542 6.5542 7.7786 7.7786 8.5295 8.5295 8.9050 8.9050 8.9580 8.9580 9.3511 9.3511 10.3946 10.3946 11.0228 11.0228 11.4553 11.4553 12.0501 12.0501 12.0957 12.0957 k = 0.1023 0.0590-0.0000 ( 4517 PWs) bands (ev): -25.8506 -25.8506 -25.8436 -25.8436 -8.7134 -8.7134 -8.6470 -8.6470 -7.6635 -7.6635 -7.5157 -7.5157 -7.4974 -7.4974 -7.4806 -7.4806 -1.5543 -1.5543 -0.9177 -0.9177 5.1306 5.1306 5.1355 5.1355 5.2445 5.2445 5.2898 5.2898 5.4438 5.4438 5.9877 5.9877 6.2543 6.2543 6.2678 6.2678 6.3137 6.3137 6.4787 6.4787 6.5560 6.5560 7.7800 7.7800 8.4260 8.4260 8.7856 8.7856 8.9323 8.9323 9.2802 9.2802 10.4143 10.4143 11.0412 11.0412 11.5749 11.5749 11.9727 11.9727 12.1825 12.1825 k = 0.1136 0.0656-0.0000 ( 4521 PWs) bands (ev): -25.8503 -25.8503 -25.8432 -25.8432 -8.7141 -8.7141 -8.6491 -8.6491 -7.6635 -7.6635 -7.5193 -7.5193 -7.4991 -7.4991 -7.4842 -7.4842 -1.5323 -1.5323 -0.9127 -0.9127 5.1287 5.1287 5.1524 5.1524 5.2315 5.2315 5.2906 5.2906 5.4487 5.4487 5.9923 5.9923 6.2492 6.2492 6.2698 6.2698 6.3135 6.3135 6.4829 6.4829 6.5587 6.5587 7.7818 7.7818 8.3194 8.3194 8.6654 8.6654 8.9070 8.9070 9.2064 9.2064 10.4339 10.4339 11.0544 11.0544 11.6974 11.6974 11.8916 11.8916 12.2738 12.2738 k = 0.1250 0.0722-0.0000 ( 4527 PWs) bands (ev): -25.8499 -25.8499 -25.8428 -25.8428 -8.7149 -8.7149 -8.6514 -8.6514 -7.6635 -7.6635 -7.5237 -7.5237 -7.5004 -7.5004 -7.4881 -7.4881 -1.5082 -1.5082 -0.9072 -0.9072 5.1228 5.1228 5.1724 5.1724 5.2144 5.2144 5.2947 5.2947 5.4553 5.4553 5.9969 5.9969 6.2433 6.2433 6.2717 6.2717 6.3139 6.3139 6.4871 6.4871 6.5628 6.5628 7.7841 7.7841 8.2108 8.2108 8.5472 8.5472 8.8798 8.8798 9.1304 9.1304 10.4531 10.4531 11.0643 11.0643 11.8043 11.8043 11.8235 11.8235 12.3685 12.3685 k = 0.1364 0.0787-0.0000 ( 4519 PWs) bands (ev): -25.8494 -25.8494 -25.8424 -25.8424 -8.7158 -8.7158 -8.6539 -8.6539 -7.6635 -7.6635 -7.5288 -7.5288 -7.5014 -7.5014 -7.4922 -7.4922 -1.4823 -1.4823 -0.9011 -0.9011 5.1152 5.1152 5.1821 5.1821 5.2046 5.2046 5.3016 5.3016 5.4634 5.4634 6.0015 6.0015 6.2368 6.2368 6.2736 6.2736 6.3150 6.3150 6.4911 6.4911 6.5689 6.5689 7.7869 7.7869 8.1012 8.1012 8.4317 8.4317 8.8507 8.8507 9.0529 9.0529 10.4713 10.4713 11.0721 11.0721 11.7210 11.7210 11.9418 11.9418 12.4657 12.4657 k = 0.1477 0.0853-0.0000 ( 4511 PWs) bands (ev): -25.8489 -25.8489 -25.8420 -25.8420 -8.7168 -8.7168 -8.6566 -8.6566 -7.6635 -7.6635 -7.5345 -7.5345 -7.5021 -7.5021 -7.4965 -7.4965 -1.4545 -1.4545 -0.8945 -0.8945 5.1060 5.1060 5.1613 5.1613 5.2229 5.2229 5.3106 5.3106 5.4730 5.4730 6.0057 6.0057 6.2300 6.2300 6.2752 6.2752 6.3164 6.3164 6.4944 6.4944 6.5776 6.5776 7.7903 7.7903 7.9917 7.9917 8.3189 8.3189 8.8197 8.8197 8.9743 8.9743 10.4877 10.4877 11.0793 11.0793 11.6337 11.6337 12.0582 12.0582 12.5647 12.5647 k = 0.1591 0.0919-0.0000 ( 4507 PWs) bands (ev): -25.8485 -25.8485 -25.8415 -25.8415 -8.7179 -8.7179 -8.6594 -8.6594 -7.6636 -7.6636 -7.5406 -7.5406 -7.5028 -7.5028 -7.5009 -7.5009 -1.4250 -1.4250 -0.8875 -0.8875 5.0952 5.0952 5.1332 5.1332 5.2460 5.2460 5.3214 5.3214 5.4839 5.4839 6.0095 6.0095 6.2230 6.2230 6.2766 6.2766 6.3182 6.3182 6.4968 6.4968 6.5892 6.5892 7.7942 7.7942 7.8831 7.8831 8.2090 8.2090 8.7867 8.7867 8.8953 8.8953 10.5015 10.5015 11.0873 11.0873 11.5457 11.5457 12.1672 12.1672 12.6647 12.6647 k = 0.1705 0.0984-0.0000 ( 4505 PWs) bands (ev): -25.8479 -25.8479 -25.8410 -25.8410 -8.7190 -8.7190 -8.6624 -8.6624 -7.6637 -7.6637 -7.5471 -7.5471 -7.5057 -7.5057 -7.5030 -7.5030 -1.3938 -1.3938 -0.8799 -0.8799 5.0821 5.0821 5.1027 5.1027 5.2701 5.2701 5.3337 5.3337 5.4959 5.4959 6.0125 6.0125 6.2161 6.2161 6.2778 6.2778 6.3203 6.3203 6.4982 6.4982 6.6041 6.6041 7.7760 7.7760 7.7990 7.7990 8.1020 8.1020 8.7519 8.7519 8.8162 8.8162 10.5117 10.5117 11.0975 11.0975 11.4574 11.4574 12.2662 12.2662 12.7645 12.7645 k = 0.1818 0.1050-0.0000 ( 4511 PWs) bands (ev): -25.8474 -25.8474 -25.8405 -25.8405 -8.7203 -8.7203 -8.6655 -8.6655 -7.6639 -7.6639 -7.5538 -7.5538 -7.5103 -7.5103 -7.5035 -7.5035 -1.3612 -1.3612 -0.8719 -0.8719 5.0605 5.0605 5.0765 5.0765 5.2943 5.2943 5.3474 5.3474 5.5090 5.5090 6.0145 6.0145 6.2096 6.2096 6.2786 6.2786 6.3226 6.3226 6.4986 6.4986 6.6224 6.6224 7.6719 7.6719 7.8038 7.8038 7.9980 7.9980 8.7140 8.7140 8.7387 8.7387 10.5173 10.5173 11.1112 11.1112 11.3692 11.3692 12.3528 12.3528 12.8367 12.8367 k = 0.1932 0.1115-0.0000 ( 4507 PWs) bands (ev): -25.8468 -25.8468 -25.8400 -25.8400 -8.7216 -8.7216 -8.6688 -8.6688 -7.6641 -7.6641 -7.5608 -7.5608 -7.5150 -7.5150 -7.5039 -7.5039 -1.3272 -1.3272 -0.8633 -0.8633 5.0256 5.0256 5.0598 5.0598 5.3183 5.3183 5.3625 5.3625 5.5230 5.5230 6.0153 6.0153 6.2039 6.2039 6.2792 6.2792 6.3251 6.3251 6.4982 6.4982 6.6443 6.6443 7.5708 7.5708 7.8089 7.8089 7.8972 7.8972 8.6543 8.6543 8.6819 8.6819 10.5175 10.5175 11.1293 11.1293 11.2814 11.2814 12.4262 12.4262 12.8913 12.8913 k = 0.2045 0.1181-0.0000 ( 4503 PWs) bands (ev): -25.8463 -25.8463 -25.8394 -25.8394 -8.7230 -8.7230 -8.6722 -8.6722 -7.6644 -7.6644 -7.5679 -7.5679 -7.5197 -7.5197 -7.5042 -7.5042 -1.2920 -1.2920 -0.8543 -0.8543 4.9860 4.9860 5.0442 5.0442 5.3419 5.3419 5.3788 5.3788 5.5378 5.5378 6.0146 6.0146 6.1993 6.1993 6.2795 6.2795 6.3277 6.3277 6.4973 6.4973 6.6696 6.6696 7.4736 7.4736 7.7917 7.7917 7.8218 7.8218 8.5774 8.5774 8.6418 8.6418 10.5121 10.5121 11.1524 11.1524 11.1942 11.1942 12.4870 12.4870 12.9476 12.9476 k = 0.2159 0.1247-0.0000 ( 4501 PWs) bands (ev): -25.8457 -25.8457 -25.8389 -25.8389 -8.7244 -8.7244 -8.6757 -8.6757 -7.6648 -7.6648 -7.5751 -7.5751 -7.5243 -7.5243 -7.5044 -7.5044 -1.2558 -1.2558 -0.8447 -0.8447 4.9434 4.9434 5.0281 5.0281 5.3647 5.3647 5.3962 5.3962 5.5535 5.5535 6.0123 6.0123 6.1958 6.1958 6.2796 6.2796 6.3304 6.3304 6.4958 6.4958 6.6983 6.6983 7.3807 7.3807 7.6994 7.6994 7.8246 7.8246 8.5001 8.5001 8.6017 8.6017 10.5009 10.5009 11.1073 11.1073 11.1814 11.1814 12.5375 12.5375 13.0059 13.0059 k = 0.2273 0.1312-0.0000 ( 4489 PWs) bands (ev): -25.8451 -25.8451 -25.8383 -25.8383 -8.7259 -8.7259 -8.6792 -8.6792 -7.6653 -7.6653 -7.5824 -7.5824 -7.5289 -7.5289 -7.5046 -7.5046 -1.2188 -1.2188 -0.8347 -0.8347 4.8983 4.8983 5.0115 5.0115 5.3864 5.3864 5.4148 5.4148 5.5699 5.5699 6.0085 6.0085 6.1936 6.1936 6.2795 6.2795 6.3332 6.3332 6.4939 6.4939 6.7303 6.7303 7.2926 7.2926 7.6062 7.6062 7.8315 7.8315 8.4236 8.4236 8.5610 8.5610 10.4845 10.4845 11.0217 11.0217 11.2153 11.2153 12.5805 12.5805 13.0653 13.0653 k = 0.2386 0.1378-0.0000 ( 4485 PWs) bands (ev): -25.8445 -25.8445 -25.8377 -25.8377 -8.7275 -8.7275 -8.6829 -8.6829 -7.6659 -7.6659 -7.5897 -7.5897 -7.5333 -7.5333 -7.5048 -7.5048 -1.1811 -1.1811 -0.8240 -0.8240 4.8508 4.8508 4.9943 4.9943 5.4070 5.4070 5.4342 5.4342 5.5869 5.5869 6.0032 6.0032 6.1928 6.1928 6.2791 6.2791 6.3360 6.3360 6.4917 6.4917 6.7655 6.7655 7.2097 7.2097 7.5154 7.5154 7.8390 7.8390 8.3482 8.3482 8.5197 8.5197 10.4635 10.4635 10.9369 10.9369 11.2540 11.2540 12.6190 12.6190 13.0518 13.0518 k = 0.2500 0.1443-0.0000 ( 4485 PWs) bands (ev): -25.8439 -25.8439 -25.8372 -25.8372 -8.7292 -8.7292 -8.6866 -8.6866 -7.6666 -7.6666 -7.5970 -7.5970 -7.5376 -7.5376 -7.5050 -7.5050 -1.1431 -1.1431 -0.8128 -0.8128 4.8011 4.8011 4.9767 4.9767 5.4263 5.4263 5.4544 5.4544 5.6043 5.6043 5.9965 5.9965 6.1930 6.1930 6.2785 6.2785 6.3388 6.3388 6.4892 6.4892 6.8034 6.8034 7.1325 7.1325 7.4272 7.4272 7.8469 7.8469 8.2740 8.2740 8.4778 8.4778 10.4386 10.4386 10.8532 10.8532 11.2969 11.2969 12.6556 12.6556 13.0015 13.0015 k = 0.2614 0.1509-0.0000 ( 4475 PWs) bands (ev): -25.8433 -25.8433 -25.8366 -25.8366 -8.7309 -8.7309 -8.6903 -8.6903 -7.6675 -7.6675 -7.6042 -7.6042 -7.5416 -7.5416 -7.5052 -7.5052 -1.1050 -1.1050 -0.8010 -0.8010 4.7494 4.7494 4.9587 4.9587 5.4443 5.4443 5.4751 5.4751 5.6222 5.6222 5.9889 5.9889 6.1943 6.1943 6.2778 6.2778 6.3415 6.3415 6.4866 6.4866 6.8432 6.8432 7.0619 7.0619 7.3418 7.3418 7.8551 7.8551 8.2011 8.2011 8.4357 8.4357 10.4107 10.4107 10.7704 10.7704 11.3432 11.3432 12.6922 12.6922 12.9515 12.9515 k = 0.2727 0.1575-0.0000 ( 4479 PWs) bands (ev): -25.8427 -25.8427 -25.8360 -25.8360 -8.7326 -8.7326 -8.6940 -8.6940 -7.6685 -7.6685 -7.6113 -7.6113 -7.5454 -7.5454 -7.5053 -7.5053 -1.0670 -1.0670 -0.7883 -0.7883 4.6960 4.6960 4.9405 4.9405 5.4608 5.4608 5.4963 5.4963 5.6404 5.6404 5.9806 5.9806 6.1962 6.1962 6.2769 6.2769 6.3442 6.3442 6.4839 6.4839 6.8809 6.8809 7.0015 7.0015 7.2594 7.2594 7.8634 7.8634 8.1298 8.1298 8.3934 8.3934 10.3807 10.3807 10.6886 10.6886 11.3924 11.3924 12.7303 12.7303 12.9027 12.9027 k = 0.2841 0.1640-0.0000 ( 4483 PWs) bands (ev): -25.8421 -25.8421 -25.8355 -25.8355 -8.7343 -8.7343 -8.6977 -8.6977 -7.6696 -7.6696 -7.6183 -7.6183 -7.5490 -7.5490 -7.5054 -7.5054 -1.0297 -1.0297 -0.7748 -0.7748 4.6411 4.6411 4.9223 4.9223 5.4758 5.4758 5.5180 5.5180 5.6588 5.6588 5.9719 5.9719 6.1986 6.1986 6.2760 6.2760 6.3469 6.3469 6.4811 6.4811 6.8928 6.8928 6.9746 6.9746 7.1805 7.1805 7.8717 7.8717 8.0602 8.0602 8.3513 8.3513 10.3491 10.3491 10.6078 10.6078 11.4437 11.4437 12.7709 12.7709 12.8557 12.8557 k = 0.2955 0.1706-0.0000 ( 4487 PWs) bands (ev): -25.8415 -25.8415 -25.8349 -25.8349 -8.7361 -8.7361 -8.7014 -8.7014 -7.6709 -7.6709 -7.6251 -7.6251 -7.5523 -7.5523 -7.5055 -7.5055 -0.9934 -0.9934 -0.7602 -0.7602 4.5851 4.5851 4.9042 4.9042 5.4891 5.4891 5.5400 5.5400 5.6773 5.6773 5.9631 5.9631 6.2012 6.2012 6.2752 6.2752 6.3495 6.3495 6.4784 6.4784 6.8550 6.8550 7.0027 7.0027 7.1071 7.1071 7.8800 7.8800 7.9923 7.9923 8.3093 8.3093 10.3168 10.3168 10.5281 10.5281 11.4963 11.4963 12.8098 12.8098 12.8162 12.8162 k = 0.3068 0.1771-0.0000 ( 4495 PWs) bands (ev): -25.8410 -25.8410 -25.8344 -25.8344 -8.7379 -8.7379 -8.7050 -8.7050 -7.6723 -7.6723 -7.6317 -7.6317 -7.5553 -7.5553 -7.5056 -7.5056 -0.9586 -0.9586 -0.7442 -0.7442 4.5284 4.5284 4.8864 4.8864 5.5007 5.5007 5.5624 5.5624 5.6959 5.6959 5.9546 5.9546 6.2039 6.2039 6.2743 6.2743 6.3519 6.3519 6.4756 6.4756 6.8073 6.8073 7.0131 7.0131 7.0718 7.0718 7.8882 7.8882 7.9264 7.9264 8.2679 8.2679 10.2841 10.2841 10.4495 10.4495 11.5498 11.5498 12.7697 12.7697 12.8624 12.8624 k = 0.3182 0.1837-0.0000 ( 4489 PWs) bands (ev): -25.8404 -25.8404 -25.8338 -25.8338 -8.7397 -8.7397 -8.7086 -8.7086 -7.6738 -7.6738 -7.6380 -7.6380 -7.5580 -7.5580 -7.5056 -7.5056 -0.9259 -0.9259 -0.7266 -0.7266 4.4714 4.4714 4.8689 4.8689 5.5105 5.5105 5.5852 5.5852 5.7143 5.7143 5.9466 5.9466 6.2064 6.2064 6.2736 6.2736 6.3543 6.3543 6.4730 6.4730 6.7617 6.7617 6.9528 6.9528 7.1155 7.1155 7.8626 7.8626 7.8961 7.8961 8.2271 8.2271 10.2516 10.2516 10.3721 10.3721 11.6035 11.6035 12.7317 12.7317 12.9135 12.9135 k = 0.3295 0.1903-0.0000 ( 4488 PWs) bands (ev): -25.8399 -25.8399 -25.8333 -25.8333 -8.7414 -8.7414 -8.7120 -8.7120 -7.6755 -7.6755 -7.6440 -7.6440 -7.5604 -7.5604 -7.5057 -7.5057 -0.8958 -0.8958 -0.7072 -0.7072 4.4145 4.4145 4.8518 4.8518 5.5186 5.5186 5.6081 5.6081 5.7324 5.7324 5.9393 5.9393 6.2087 6.2087 6.2731 6.2731 6.3565 6.3565 6.4704 6.4704 6.7195 6.7195 6.8880 6.8880 7.1702 7.1702 7.8010 7.8010 7.9037 7.9037 8.1873 8.1873 10.2193 10.2193 10.2962 10.2962 11.6568 11.6568 12.6974 12.6974 12.9682 12.9682 k = 0.3409 0.1968-0.0000 ( 4482 PWs) bands (ev): -25.8393 -25.8393 -25.8328 -25.8328 -8.7432 -8.7432 -8.7154 -8.7154 -7.6773 -7.6773 -7.6498 -7.6498 -7.5625 -7.5625 -7.5057 -7.5057 -0.8688 -0.8688 -0.6858 -0.6858 4.3581 4.3581 4.8354 4.8354 5.5250 5.5250 5.6311 5.6311 5.7501 5.7501 5.9328 5.9328 6.2107 6.2107 6.2728 6.2728 6.3585 6.3585 6.4679 6.4679 6.6810 6.6810 6.8259 6.8259 7.2276 7.2276 7.7417 7.7417 7.9109 7.9109 8.1485 8.1485 10.1865 10.1865 10.2231 10.2231 11.7093 11.7093 12.6671 12.6671 13.0260 13.0260 k = 0.3523 0.2034-0.0000 ( 4474 PWs) bands (ev): -25.8388 -25.8388 -25.8324 -25.8324 -8.7448 -8.7448 -8.7186 -8.7186 -7.6791 -7.6791 -7.6552 -7.6552 -7.5643 -7.5643 -7.5058 -7.5058 -0.8451 -0.8451 -0.6624 -0.6624 4.3029 4.3029 4.8198 4.8198 5.5298 5.5298 5.6540 5.6540 5.7673 5.7673 5.9272 5.9272 6.2123 6.2123 6.2727 6.2727 6.3604 6.3604 6.4654 6.4654 6.6462 6.6462 6.7678 6.7678 7.2864 7.2864 7.6851 7.6851 7.9176 7.9176 8.1111 8.1111 10.1394 10.1394 10.1669 10.1669 11.7605 11.7605 12.6409 12.6409 13.0857 13.0857 k = 0.3636 0.2099-0.0000 ( 4484 PWs) bands (ev): -25.8384 -25.8384 -25.8319 -25.8319 -8.7465 -8.7465 -8.7217 -8.7217 -7.6810 -7.6810 -7.6603 -7.6603 -7.5659 -7.5659 -7.5058 -7.5058 -0.8245 -0.8245 -0.6376 -0.6376 4.2493 4.2493 4.8049 4.8049 5.5333 5.5333 5.6766 5.6766 5.7835 5.7835 5.9226 5.9226 6.2132 6.2132 6.2730 6.2730 6.3620 6.3620 6.4628 6.4628 6.6143 6.6143 6.7144 6.7144 7.3458 7.3458 7.6312 7.6312 7.9239 7.9239 8.0753 8.0753 10.0710 10.0710 10.1352 10.1352 11.8099 11.8099 12.6188 12.6188 13.1457 13.1457 k = 0.3750 0.2165-0.0000 ( 4480 PWs) bands (ev): -25.8379 -25.8379 -25.8315 -25.8315 -8.7480 -8.7480 -8.7246 -8.7246 -7.6829 -7.6829 -7.6650 -7.6650 -7.5672 -7.5672 -7.5058 -7.5058 -0.8069 -0.8069 -0.6118 -0.6118 4.1977 4.1977 4.7909 4.7909 5.5356 5.5356 5.6989 5.6989 5.7988 5.7988 5.9191 5.9191 6.2138 6.2138 6.2735 6.2735 6.3634 6.3634 6.4600 6.4600 6.5849 6.5849 6.6664 6.6664 7.4050 7.4050 7.5805 7.5805 7.9295 7.9295 8.0413 8.0413 10.0015 10.0015 10.1082 10.1082 11.8571 11.8571 12.6006 12.6006 13.2033 13.2033 k = 0.3864 0.2231-0.0000 ( 4478 PWs) bands (ev): -25.8375 -25.8375 -25.8311 -25.8311 -8.7495 -8.7495 -8.7273 -8.7273 -7.6848 -7.6848 -7.6693 -7.6693 -7.5684 -7.5684 -7.5058 -7.5058 -0.7919 -0.7919 -0.5858 -0.5858 4.1487 4.1487 4.7780 4.7780 5.5368 5.5368 5.7205 5.7205 5.8128 5.8128 5.9166 5.9166 6.2139 6.2139 6.2744 6.2744 6.3645 6.3645 6.4564 6.4564 6.5573 6.5573 6.6248 6.6248 7.4623 7.4623 7.5344 7.5344 7.9343 7.9343 8.0094 8.0094 9.9338 9.9338 10.0836 10.0836 11.9019 11.9019 12.5863 12.5863 13.2549 13.2549 k = 0.3977 0.2296-0.0000 ( 4476 PWs) bands (ev): -25.8371 -25.8371 -25.8308 -25.8308 -8.7508 -8.7508 -8.7298 -8.7298 -7.6867 -7.6867 -7.6732 -7.6732 -7.5693 -7.5693 -7.5058 -7.5058 -0.7791 -0.7791 -0.5602 -0.5602 4.1027 4.1027 4.7661 4.7661 5.5372 5.5372 5.7414 5.7414 5.8253 5.8253 5.9152 5.9152 6.2136 6.2136 6.2755 6.2755 6.3653 6.3653 6.4517 6.4517 6.5311 6.5311 6.5908 6.5908 7.4813 7.4813 7.5287 7.5287 7.9380 7.9380 7.9803 7.9803 9.8687 9.8687 10.0611 10.0611 11.9438 11.9438 12.5754 12.5754 13.2964 13.2964 k = 0.4091 0.2362-0.0000 ( 4470 PWs) bands (ev): -25.8368 -25.8368 -25.8304 -25.8304 -8.7521 -8.7521 -8.7321 -8.7321 -7.6885 -7.6885 -7.6766 -7.6766 -7.5701 -7.5701 -7.5058 -7.5058 -0.7682 -0.7682 -0.5357 -0.5357 4.0602 4.0602 4.7553 4.7553 5.5369 5.5369 5.7611 5.7611 5.8362 5.8362 5.9149 5.9149 6.2130 6.2130 6.2769 6.2769 6.3656 6.3656 6.4444 6.4444 6.5072 6.5072 6.5645 6.5645 7.4438 7.4438 7.5811 7.5811 7.9377 7.9377 7.9570 7.9570 9.8069 9.8069 10.0409 10.0409 11.9826 11.9826 12.5676 12.5676 13.3250 13.3250 k = 0.4205 0.2427-0.0000 ( 4470 PWs) bands (ev): -25.8365 -25.8365 -25.8301 -25.8301 -8.7532 -8.7532 -8.7341 -8.7341 -7.6903 -7.6903 -7.6796 -7.6796 -7.5707 -7.5707 -7.5058 -7.5058 -0.7589 -0.7589 -0.5129 -0.5129 4.0215 4.0215 4.7457 4.7457 5.5362 5.5362 5.7795 5.7795 5.8452 5.8452 5.9157 5.9157 6.2121 6.2121 6.2786 6.2786 6.3651 6.3651 6.4335 6.4335 6.4881 6.4881 6.5449 6.5449 7.4072 7.4072 7.6337 7.6337 7.9224 7.9224 7.9506 7.9506 9.7490 9.7490 10.0228 10.0228 12.0179 12.0179 12.5626 12.5626 13.3408 13.3408 k = 0.4318 0.2493-0.0000 ( 4478 PWs) bands (ev): -25.8362 -25.8362 -25.8299 -25.8299 -8.7542 -8.7542 -8.7359 -8.7359 -7.6920 -7.6920 -7.6821 -7.6821 -7.5712 -7.5712 -7.5058 -7.5058 -0.7511 -0.7511 -0.4922 -0.4922 3.9872 3.9872 4.7373 4.7373 5.5351 5.5351 5.7964 5.7964 5.8521 5.8521 5.9174 5.9174 6.2109 6.2109 6.2805 6.2805 6.3629 6.3629 6.4196 6.4196 6.4751 6.4751 6.5304 6.5304 7.3744 7.3744 7.6830 7.6830 7.9019 7.9019 7.9515 7.9515 9.6959 9.6959 10.0071 10.0071 12.0494 12.0494 12.5598 12.5598 13.3465 13.3465 k = 0.4432 0.2559-0.0000 ( 4474 PWs) bands (ev): -25.8360 -25.8360 -25.8297 -25.8297 -8.7551 -8.7551 -8.7375 -8.7375 -7.6935 -7.6935 -7.6842 -7.6842 -7.5716 -7.5716 -7.5058 -7.5058 -0.7446 -0.7446 -0.4740 -0.4740 3.9575 3.9575 4.7302 4.7302 5.5339 5.5339 5.8116 5.8116 5.8571 5.8571 5.9197 5.9197 6.2097 6.2097 6.2828 6.2828 6.3580 6.3580 6.4069 6.4069 6.4664 6.4664 6.5201 6.5201 7.3460 7.3460 7.7278 7.7278 7.8833 7.8833 7.9528 7.9528 9.6485 9.6485 9.9937 9.9937 12.0768 12.0768 12.5586 12.5586 13.3458 13.3458 k = 0.4545 0.2624-0.0000 ( 4468 PWs) bands (ev): -25.8358 -25.8358 -25.8295 -25.8295 -8.7558 -8.7558 -8.7388 -8.7388 -7.6948 -7.6948 -7.6859 -7.6859 -7.5718 -7.5718 -7.5058 -7.5058 -0.7394 -0.7394 -0.4587 -0.4587 3.9327 3.9327 4.7243 4.7243 5.5328 5.5328 5.8248 5.8248 5.8604 5.8604 5.9223 5.9223 6.2084 6.2084 6.2854 6.2854 6.3497 6.3497 6.3985 6.3985 6.4599 6.4599 6.5129 6.5129 7.3222 7.3222 7.7670 7.7670 7.8677 7.8677 7.9535 7.9535 9.6077 9.6077 9.9827 9.9827 12.0998 12.0998 12.5585 12.5585 13.3417 13.3417 k = 0.4659 0.2690-0.0000 ( 4464 PWs) bands (ev): -25.8357 -25.8357 -25.8293 -25.8293 -8.7564 -8.7564 -8.7398 -8.7398 -7.6958 -7.6958 -7.6871 -7.6871 -7.5721 -7.5721 -7.5058 -7.5058 -0.7354 -0.7354 -0.4465 -0.4465 3.9132 3.9132 4.7197 4.7197 5.5318 5.5318 5.8358 5.8358 5.8620 5.8620 5.9249 5.9249 6.2071 6.2071 6.2884 6.2884 6.3395 6.3395 6.3943 6.3943 6.4549 6.4549 6.5081 6.5081 7.3033 7.3033 7.7995 7.7995 7.8553 7.8553 7.9536 7.9536 9.5746 9.5746 9.9741 9.9741 12.1181 12.1181 12.5591 12.5591 13.3365 13.3365 k = 0.4773 0.2756-0.0000 ( 4456 PWs) bands (ev): -25.8355 -25.8355 -25.8292 -25.8292 -8.7568 -8.7568 -8.7405 -8.7405 -7.6966 -7.6966 -7.6880 -7.6880 -7.5722 -7.5722 -7.5058 -7.5058 -0.7325 -0.7325 -0.4376 -0.4376 3.8991 3.8991 4.7164 4.7164 5.5310 5.5310 5.8447 5.8447 5.8622 5.8622 5.9270 5.9270 6.2061 6.2061 6.2917 6.2917 6.3298 6.3298 6.3925 6.3925 6.4512 6.4512 6.5051 6.5051 7.2897 7.2897 7.8240 7.8240 7.8465 7.8465 7.9532 7.9532 9.5502 9.5502 9.9679 9.9679 12.1313 12.1313 12.5599 12.5599 13.3318 13.3318 k = 0.4886 0.2821-0.0000 ( 4464 PWs) bands (ev): -25.8355 -25.8355 -25.8292 -25.8292 -8.7571 -8.7571 -8.7409 -8.7409 -7.6971 -7.6971 -7.6885 -7.6885 -7.5723 -7.5723 -7.5058 -7.5058 -0.7308 -0.7308 -0.4323 -0.4323 3.8905 3.8905 4.7145 4.7145 5.5305 5.5305 5.8513 5.8513 5.8609 5.8609 5.9283 5.9283 6.2054 6.2054 6.2948 6.2948 6.3224 6.3224 6.3918 6.3918 6.4489 6.4489 6.5034 6.5034 7.2815 7.2815 7.8380 7.8380 7.8426 7.8426 7.9526 7.9526 9.5351 9.5351 9.9642 9.9642 12.1394 12.1394 12.5605 12.5605 13.3286 13.3286 k = 0.5000 0.2887-0.0000 ( 4462 PWs) bands (ev): -25.8355 -25.8355 -25.8292 -25.8292 -8.7571 -8.7571 -8.7411 -8.7411 -7.6973 -7.6973 -7.6887 -7.6887 -7.5723 -7.5723 -7.5058 -7.5058 -0.7302 -0.7302 -0.4305 -0.4305 3.8877 3.8877 4.7138 4.7138 5.5303 5.5303 5.8544 5.8544 5.8596 5.8596 5.9288 5.9288 6.2052 6.2052 6.2963 6.2963 6.3194 6.3194 6.3917 6.3917 6.4481 6.4481 6.5029 6.5029 7.2787 7.2787 7.8383 7.8383 7.8458 7.8458 7.9523 7.9523 9.5300 9.5300 9.9630 9.9630 12.1421 12.1421 12.5607 12.5607 13.3275 13.3275 k = 0.5000 0.2887-0.0000 ( 4462 PWs) bands (ev): -25.8355 -25.8355 -25.8292 -25.8292 -8.7571 -8.7571 -8.7411 -8.7411 -7.6973 -7.6973 -7.6887 -7.6887 -7.5723 -7.5723 -7.5058 -7.5058 -0.7302 -0.7302 -0.4305 -0.4305 3.8877 3.8877 4.7138 4.7138 5.5303 5.5303 5.8544 5.8544 5.8596 5.8596 5.9288 5.9288 6.2052 6.2052 6.2963 6.2963 6.3194 6.3194 6.3917 6.3917 6.4481 6.4481 6.5029 6.5029 7.2787 7.2787 7.8383 7.8383 7.8458 7.8458 7.9523 7.9523 9.5300 9.5300 9.9630 9.9630 12.1421 12.1421 12.5607 12.5607 13.3275 13.3275 k = 0.4936 0.2998-0.0000 ( 4466 PWs) bands (ev): -25.8355 -25.8355 -25.8292 -25.8292 -8.7572 -8.7572 -8.7411 -8.7411 -7.6972 -7.6972 -7.6887 -7.6887 -7.5725 -7.5725 -7.5059 -7.5059 -0.7296 -0.7296 -0.4305 -0.4305 3.8891 3.8891 4.7130 4.7130 5.5310 5.5310 5.8541 5.8541 5.8602 5.8602 5.9283 5.9283 6.2053 6.2053 6.2961 6.2961 6.3188 6.3188 6.3917 6.3917 6.4481 6.4481 6.5024 6.5024 7.2769 7.2769 7.8302 7.8302 7.8464 7.8464 7.9522 7.9522 9.5321 9.5321 9.9724 9.9724 12.1456 12.1456 12.5467 12.5467 13.3317 13.3317 k = 0.4872 0.3109-0.0000 ( 4462 PWs) bands (ev): -25.8354 -25.8354 -25.8291 -25.8291 -8.7572 -8.7572 -8.7411 -8.7411 -7.6971 -7.6971 -7.6886 -7.6886 -7.5730 -7.5730 -7.5063 -7.5063 -0.7278 -0.7278 -0.4305 -0.4305 3.8932 3.8932 4.7105 4.7105 5.5329 5.5329 5.8533 5.8533 5.8619 5.8619 5.9271 5.9271 6.2056 6.2056 6.2956 6.2956 6.3168 6.3168 6.3919 6.3919 6.4480 6.4480 6.5012 6.5012 7.2714 7.2714 7.8063 7.8063 7.8481 7.8481 7.9522 7.9522 9.5383 9.5383 10.0001 10.0001 12.1563 12.1563 12.5068 12.5068 13.3442 13.3442 k = 0.4808 0.3220-0.0000 ( 4460 PWs) bands (ev): -25.8354 -25.8354 -25.8291 -25.8291 -8.7572 -8.7572 -8.7412 -8.7412 -7.6968 -7.6968 -7.6884 -7.6884 -7.5739 -7.5739 -7.5069 -7.5069 -0.7248 -0.7248 -0.4304 -0.4304 3.9001 3.9001 4.7065 4.7065 5.5360 5.5360 5.8516 5.8516 5.8649 5.8649 5.9251 5.9251 6.2060 6.2060 6.2948 6.2948 6.3135 6.3135 6.3921 6.3921 6.4479 6.4479 6.4992 6.4992 7.2625 7.2625 7.7681 7.7681 7.8509 7.8509 7.9524 7.9524 9.5486 9.5486 10.0446 10.0446 12.1735 12.1735 12.4466 12.4466 13.3649 13.3649 k = 0.4744 0.3331-0.0000 ( 4454 PWs) bands (ev): -25.8354 -25.8354 -25.8291 -25.8291 -8.7572 -8.7572 -8.7412 -8.7412 -7.6965 -7.6965 -7.6881 -7.6881 -7.5751 -7.5751 -7.5077 -7.5077 -0.7206 -0.7206 -0.4304 -0.4304 3.9098 3.9098 4.7009 4.7009 5.5404 5.5404 5.8491 5.8491 5.8690 5.8690 5.9225 5.9225 6.2065 6.2065 6.2937 6.2937 6.3088 6.3088 6.3925 6.3925 6.4479 6.4479 6.4965 6.4965 7.2501 7.2501 7.7177 7.7177 7.8548 7.8548 7.9529 7.9529 9.5630 9.5630 10.1040 10.1040 12.1964 12.1964 12.3722 12.3722 13.3937 13.3937 k = 0.4679 0.3442-0.0000 ( 4454 PWs) bands (ev): -25.8353 -25.8353 -25.8290 -25.8290 -8.7573 -8.7573 -8.7413 -8.7413 -7.6961 -7.6961 -7.6878 -7.6878 -7.5766 -7.5766 -7.5088 -7.5088 -0.7153 -0.7153 -0.4304 -0.4304 3.9221 3.9221 4.6939 4.6939 5.5458 5.5458 5.8457 5.8457 5.8736 5.8736 5.9196 5.9196 6.2068 6.2068 6.2924 6.2924 6.3029 6.3029 6.3929 6.3929 6.4479 6.4479 6.4930 6.4930 7.2344 7.2344 7.6576 7.6576 7.8597 7.8597 7.9536 7.9536 9.5813 9.5813 10.1760 10.1760 12.2211 12.2211 12.2916 12.2916 13.4304 13.4304 k = 0.4615 0.3553-0.0000 ( 4450 PWs) bands (ev): -25.8352 -25.8352 -25.8289 -25.8289 -8.7573 -8.7573 -8.7415 -8.7415 -7.6957 -7.6957 -7.6873 -7.6873 -7.5784 -7.5784 -7.5100 -7.5100 -0.7089 -0.7089 -0.4304 -0.4304 3.9371 3.9371 4.6855 4.6855 5.5524 5.5524 5.8416 5.8416 5.8778 5.8778 5.9173 5.9173 6.2068 6.2068 6.2905 6.2905 6.2963 6.2963 6.3934 6.3934 6.4480 6.4480 6.4890 6.4890 7.2156 7.2156 7.5905 7.5905 7.8657 7.8657 7.9545 7.9545 9.6036 9.6036 10.2583 10.2583 12.1874 12.1874 12.2677 12.2677 13.4745 13.4745 k = 0.4551 0.3664-0.0000 ( 4456 PWs) bands (ev): -25.8351 -25.8351 -25.8289 -25.8289 -8.7574 -8.7574 -8.7416 -8.7416 -7.6953 -7.6953 -7.6866 -7.6866 -7.5805 -7.5805 -7.5115 -7.5115 -0.7014 -0.7014 -0.4305 -0.4305 3.9547 3.9547 4.6758 4.6758 5.5599 5.5599 5.8366 5.8366 5.8797 5.8797 5.9172 5.9172 6.2063 6.2063 6.2847 6.2847 6.2924 6.2924 6.3938 6.3938 6.4482 6.4482 6.4843 6.4843 7.1938 7.1938 7.5188 7.5188 7.8726 7.8726 7.9558 7.9558 9.6296 9.6296 10.3488 10.3488 12.0964 12.0964 12.3004 12.3004 13.5256 13.5256 k = 0.4487 0.3775-0.0000 ( 4464 PWs) bands (ev): -25.8351 -25.8351 -25.8288 -25.8288 -8.7575 -8.7575 -8.7418 -8.7418 -7.6949 -7.6949 -7.6857 -7.6857 -7.5829 -7.5829 -7.5130 -7.5130 -0.6929 -0.6929 -0.4307 -0.4307 3.9747 3.9747 4.6650 4.6650 5.5684 5.5684 5.8308 5.8308 5.8772 5.8772 5.9211 5.9211 6.2050 6.2050 6.2753 6.2753 6.2912 6.2912 6.3941 6.3941 6.4485 6.4485 6.4791 6.4791 7.1691 7.1691 7.4450 7.4450 7.8804 7.8804 7.9573 7.9573 9.6592 9.6592 10.4458 10.4458 12.0005 12.0005 12.3373 12.3373 13.5830 13.5830 k = 0.4423 0.3886-0.0000 ( 4468 PWs) bands (ev): -25.8350 -25.8350 -25.8287 -25.8287 -8.7576 -8.7576 -8.7420 -8.7420 -7.6946 -7.6946 -7.6847 -7.6847 -7.5855 -7.5855 -7.5148 -7.5148 -0.6835 -0.6835 -0.4310 -0.4310 3.9972 3.9972 4.6532 4.6532 5.5777 5.5777 5.8240 5.8240 5.8703 5.8703 5.9286 5.9286 6.2028 6.2028 6.2644 6.2644 6.2910 6.2910 6.3943 6.3943 6.4492 6.4492 6.4737 6.4737 7.1414 7.1414 7.3714 7.3714 7.8890 7.8890 7.9591 7.9591 9.6923 9.6923 10.5477 10.5477 11.9035 11.9035 12.3743 12.3743 13.6456 13.6456 k = 0.4359 0.3997-0.0000 ( 4456 PWs) bands (ev): -25.8348 -25.8348 -25.8286 -25.8286 -8.7577 -8.7577 -8.7422 -8.7422 -7.6945 -7.6945 -7.6834 -7.6834 -7.5884 -7.5884 -7.5165 -7.5165 -0.6731 -0.6731 -0.4314 -0.4314 4.0220 4.0220 4.6406 4.6406 5.5877 5.5877 5.8161 5.8161 5.8599 5.8599 5.9387 5.9387 6.1996 6.1996 6.2529 6.2529 6.2915 6.2915 6.3945 6.3945 6.4500 6.4500 6.4681 6.4681 7.1107 7.1107 7.3001 7.3001 7.8984 7.8984 7.9612 7.9612 9.7288 9.7288 10.6534 10.6534 11.8064 11.8064 12.4089 12.4089 13.7121 13.7121 k = 0.4295 0.4108-0.0000 ( 4460 PWs) bands (ev): -25.8347 -25.8347 -25.8285 -25.8285 -8.7579 -8.7579 -8.7424 -8.7424 -7.6944 -7.6944 -7.6819 -7.6819 -7.5914 -7.5914 -7.5184 -7.5184 -0.6620 -0.6620 -0.4319 -0.4319 4.0489 4.0489 4.6273 4.6273 5.5981 5.5981 5.8063 5.8063 5.8470 5.8470 5.9501 5.9501 6.1952 6.1952 6.2412 6.2412 6.2925 6.2925 6.3944 6.3944 6.4510 6.4510 6.4626 6.4626 7.0765 7.0765 7.2333 7.2333 7.9083 7.9083 7.9635 7.9635 9.7683 9.7683 10.7617 10.7617 11.7101 11.7101 12.4390 12.4390 13.7801 13.7801 k = 0.4231 0.4219-0.0000 ( 4458 PWs) bands (ev): -25.8346 -25.8346 -25.8283 -25.8283 -8.7580 -8.7580 -8.7427 -8.7427 -7.6943 -7.6943 -7.6803 -7.6803 -7.5947 -7.5947 -7.5203 -7.5203 -0.6502 -0.6502 -0.4326 -0.4326 4.0779 4.0779 4.6134 4.6134 5.6090 5.6090 5.7934 5.7934 5.8329 5.8329 5.9623 5.9623 6.1898 6.1898 6.2300 6.2300 6.2940 6.2940 6.3941 6.3941 6.4518 6.4518 6.4577 6.4577 7.0384 7.0384 7.1729 7.1729 7.9187 7.9187 7.9663 7.9663 9.8108 9.8108 10.8720 10.8720 11.6151 11.6151 12.4627 12.4627 13.8458 13.8458 k = 0.4167 0.4330-0.0000 ( 4466 PWs) bands (ev): -25.8345 -25.8345 -25.8282 -25.8282 -8.7581 -8.7581 -8.7430 -8.7430 -7.6944 -7.6944 -7.6785 -7.6785 -7.5981 -7.5981 -7.5222 -7.5222 -0.6378 -0.6378 -0.4336 -0.4336 4.1086 4.1086 4.5992 4.5992 5.6201 5.6201 5.7751 5.7751 5.8195 5.8195 5.9749 5.9749 6.1834 6.1834 6.2198 6.2198 6.2958 6.2958 6.3936 6.3936 6.4497 6.4497 6.4560 6.4560 6.9965 6.9965 7.1200 7.1200 7.9295 7.9295 7.9694 7.9694 9.8559 9.8559 10.9834 10.9834 11.5217 11.5217 12.4787 12.4787 13.9025 13.9025 k = 0.4103 0.4441-0.0000 ( 4478 PWs) bands (ev): -25.8344 -25.8344 -25.8281 -25.8281 -8.7583 -8.7583 -8.7432 -8.7432 -7.6946 -7.6946 -7.6765 -7.6765 -7.6016 -7.6016 -7.5240 -7.5240 -0.6249 -0.6249 -0.4348 -0.4348 4.1410 4.1410 4.5849 4.5849 5.6311 5.6311 5.7502 5.7502 5.8082 5.8082 5.9875 5.9875 6.1767 6.1767 6.2108 6.2108 6.2978 6.2978 6.3929 6.3929 6.4451 6.4451 6.4572 6.4572 6.9522 6.9522 7.0743 7.0743 7.9403 7.9403 7.9729 7.9729 9.9034 9.9034 11.0954 11.0954 11.4304 11.4304 12.4862 12.4862 13.9401 13.9401 k = 0.4038 0.4552-0.0000 ( 4486 PWs) bands (ev): -25.8342 -25.8342 -25.8280 -25.8280 -8.7585 -8.7585 -8.7436 -8.7436 -7.6948 -7.6948 -7.6744 -7.6744 -7.6052 -7.6052 -7.5259 -7.5259 -0.6116 -0.6116 -0.4363 -0.4363 4.1746 4.1746 4.5706 4.5706 5.6417 5.6417 5.7192 5.7192 5.7986 5.7986 5.9996 5.9996 6.1704 6.1704 6.2033 6.2033 6.3000 6.3000 6.3920 6.3920 6.4408 6.4408 6.4593 6.4593 6.9076 6.9076 7.0343 7.0343 7.9510 7.9510 7.9770 7.9770 9.9530 9.9530 11.2072 11.2072 11.3414 11.3414 12.4851 12.4851 13.9483 13.9483 k = 0.3974 0.4663-0.0000 ( 4490 PWs) bands (ev): -25.8341 -25.8341 -25.8279 -25.8279 -8.7587 -8.7587 -8.7439 -8.7439 -7.6951 -7.6951 -7.6721 -7.6721 -7.6089 -7.6089 -7.5276 -7.5276 -0.5981 -0.5981 -0.4381 -0.4381 4.2093 4.2093 4.5565 4.5565 5.6497 5.6497 5.6851 5.6851 5.7903 5.7903 6.0109 6.0109 6.1650 6.1650 6.1973 6.1973 6.3022 6.3022 6.3909 6.3909 6.4373 6.4373 6.4617 6.4617 6.8648 6.8648 6.9984 6.9984 7.9612 7.9612 7.9818 7.9818 10.0044 10.0044 11.2529 11.2529 11.3206 11.3206 12.4761 12.4761 13.9259 13.9259 k = 0.3910 0.4774-0.0000 ( 4484 PWs) bands (ev): -25.8340 -25.8340 -25.8278 -25.8278 -8.7588 -8.7588 -8.7442 -8.7442 -7.6954 -7.6954 -7.6698 -7.6698 -7.6126 -7.6126 -7.5292 -7.5292 -0.5844 -0.5844 -0.4403 -0.4403 4.2445 4.2445 4.5428 4.5428 5.6340 5.6340 5.6702 5.6702 5.7829 5.7829 6.0210 6.0210 6.1607 6.1607 6.1930 6.1930 6.3044 6.3044 6.3895 6.3895 6.4348 6.4348 6.4644 6.4644 6.8249 6.8249 6.9655 6.9655 7.9703 7.9703 7.9877 7.9877 10.0573 10.0573 11.1694 11.1694 11.4304 11.4304 12.4602 12.4602 13.8819 13.8819 k = 0.3846 0.4885-0.0000 ( 4482 PWs) bands (ev): -25.8339 -25.8339 -25.8277 -25.8277 -8.7590 -8.7590 -8.7445 -8.7445 -7.6958 -7.6958 -7.6674 -7.6674 -7.6163 -7.6163 -7.5306 -7.5306 -0.5708 -0.5708 -0.4428 -0.4428 4.2798 4.2798 4.5297 4.5297 5.5930 5.5930 5.6772 5.6772 5.7762 5.7762 6.0296 6.0296 6.1573 6.1573 6.1907 6.1907 6.3064 6.3064 6.3878 6.3878 6.4335 6.4335 6.4675 6.4675 6.7886 6.7886 6.9351 6.9351 7.9781 7.9781 7.9947 7.9947 10.1114 10.1114 11.0880 11.0880 11.5393 11.5393 12.4386 12.4386 13.8259 13.8259 k = 0.3782 0.4996-0.0000 ( 4482 PWs) bands (ev): -25.8338 -25.8338 -25.8275 -25.8275 -8.7592 -8.7592 -8.7448 -8.7448 -7.6962 -7.6962 -7.6649 -7.6649 -7.6200 -7.6200 -7.5320 -7.5320 -0.5573 -0.5573 -0.4458 -0.4458 4.3146 4.3146 4.5174 4.5174 5.5486 5.5486 5.6855 5.6855 5.7704 5.7704 6.0367 6.0367 6.1542 6.1542 6.1909 6.1909 6.3080 6.3080 6.3859 6.3859 6.4334 6.4334 6.4711 6.4711 6.7558 6.7558 6.9071 6.9071 7.9845 7.9845 8.0026 8.0026 10.1663 10.1663 11.0094 11.0094 11.6458 11.6458 12.4127 12.4127 13.7648 13.7648 k = 0.3718 0.5107-0.0000 ( 4486 PWs) bands (ev): -25.8337 -25.8337 -25.8275 -25.8275 -8.7594 -8.7594 -8.7451 -8.7451 -7.6966 -7.6966 -7.6624 -7.6624 -7.6236 -7.6236 -7.5331 -7.5331 -0.5442 -0.5442 -0.4492 -0.4492 4.3480 4.3480 4.5060 4.5060 5.5042 5.5042 5.6932 5.6932 5.7655 5.7655 6.0423 6.0423 6.1509 6.1509 6.1934 6.1934 6.3094 6.3094 6.3839 6.3839 6.4343 6.4343 6.4754 6.4754 6.7263 6.7263 6.8817 6.8817 7.9902 7.9902 8.0104 8.0104 10.2217 10.2217 10.9338 10.9338 11.7487 11.7487 12.3836 12.3836 13.7030 13.7030 k = 0.3654 0.5218-0.0000 ( 4482 PWs) bands (ev): -25.8336 -25.8336 -25.8274 -25.8274 -8.7595 -8.7595 -8.7454 -8.7454 -7.6970 -7.6970 -7.6598 -7.6598 -7.6271 -7.6271 -7.5341 -7.5341 -0.5316 -0.5316 -0.4530 -0.4530 4.3792 4.3792 4.4958 4.4958 5.4621 5.4621 5.6997 5.6997 5.7615 5.7615 6.0467 6.0467 6.1477 6.1477 6.1976 6.1976 6.3103 6.3103 6.3820 6.3820 6.4360 6.4360 6.4806 6.4806 6.7001 6.7001 6.8591 6.8591 7.9955 7.9955 8.0175 8.0175 10.2773 10.2773 10.8614 10.8614 11.8468 11.8468 12.3524 12.3524 13.6435 13.6435 k = 0.3590 0.5329-0.0000 ( 4484 PWs) bands (ev): -25.8335 -25.8335 -25.8273 -25.8273 -8.7597 -8.7597 -8.7457 -8.7457 -7.6973 -7.6973 -7.6572 -7.6572 -7.6304 -7.6304 -7.5349 -7.5349 -0.5197 -0.5197 -0.4573 -0.4573 4.4071 4.4071 4.4868 4.4868 5.4242 5.4242 5.7046 5.7046 5.7587 5.7587 6.0500 6.0500 6.1446 6.1446 6.2025 6.2025 6.3109 6.3109 6.3804 6.3804 6.4379 6.4379 6.4866 6.4866 6.6769 6.6769 6.8398 6.8398 8.0005 8.0005 8.0235 8.0235 10.3327 10.3327 10.7923 10.7923 11.9382 11.9382 12.3199 12.3199 13.5893 13.5893 k = 0.3526 0.5440-0.0000 ( 4484 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7598 -8.7598 -8.7459 -8.7459 -7.6976 -7.6976 -7.6548 -7.6548 -7.6335 -7.6335 -7.5355 -7.5355 -0.5088 -0.5088 -0.4621 -0.4621 4.4307 4.4307 4.4793 4.4793 5.3923 5.3923 5.7081 5.7081 5.7570 5.7570 6.0525 6.0525 6.1419 6.1419 6.2074 6.2074 6.3111 6.3111 6.3791 6.3791 6.4397 6.4397 6.4933 6.4933 6.6570 6.6570 6.8241 6.8241 8.0053 8.0053 8.0279 8.0279 10.3877 10.3877 10.7267 10.7267 12.0207 12.0207 12.2869 12.2869 13.5429 13.5429 k = 0.3462 0.5551-0.0000 ( 4488 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7599 -8.7599 -8.7460 -8.7460 -7.6979 -7.6979 -7.6525 -7.6525 -7.6362 -7.6362 -7.5360 -7.5360 -0.4990 -0.4990 -0.4671 -0.4671 4.4485 4.4485 4.4735 4.4735 5.3683 5.3683 5.7101 5.7101 5.7562 5.7562 6.0541 6.0541 6.1399 6.1399 6.2115 6.2115 6.3110 6.3110 6.3782 6.3782 6.4412 6.4412 6.4999 6.4999 6.6411 6.6411 6.8124 6.8124 8.0096 8.0096 8.0306 8.0306 10.4420 10.4420 10.6647 10.6647 12.0916 12.0916 12.2541 12.2541 13.5070 13.5070 k = 0.3397 0.5662-0.0000 ( 4476 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7599 -8.7599 -8.7461 -8.7461 -7.6981 -7.6981 -7.6507 -7.6507 -7.6383 -7.6383 -7.5362 -7.5362 -0.4911 -0.4911 -0.4721 -0.4721 4.4594 4.4594 4.4701 4.4701 5.3533 5.3533 5.7110 5.7110 5.7560 5.7560 6.0552 6.0552 6.1386 6.1386 6.2143 6.2143 6.3109 6.3109 6.3777 6.3777 6.4422 6.4422 6.5049 6.5049 6.6306 6.6306 6.8052 6.8052 8.0132 8.0132 8.0316 8.0316 10.4950 10.4950 10.6071 10.6071 12.1478 12.1478 12.2223 12.2223 13.4843 13.4843 k = 0.3333 0.5774-0.0000 ( 4476 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7600 -8.7600 -8.7462 -8.7462 -7.6981 -7.6981 -7.6500 -7.6500 -7.6391 -7.6391 -7.5363 -7.5363 -0.4874 -0.4874 -0.4748 -0.4748 4.4623 4.4623 4.4697 4.4697 5.3483 5.3483 5.7112 5.7112 5.7560 5.7560 6.0555 6.0555 6.1382 6.1382 6.2153 6.2153 6.3108 6.3108 6.3775 6.3775 6.4425 6.4425 6.5068 6.5068 6.6269 6.6269 6.8027 6.8027 8.0148 8.0148 8.0315 8.0315 10.5354 10.5354 10.5651 10.5651 12.1792 12.1792 12.1993 12.1993 13.4766 13.4766 k = 0.3333 0.5774-0.0000 ( 4476 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7600 -8.7600 -8.7462 -8.7462 -7.6981 -7.6981 -7.6500 -7.6500 -7.6391 -7.6391 -7.5363 -7.5363 -0.4874 -0.4874 -0.4748 -0.4748 4.4623 4.4623 4.4697 4.4697 5.3483 5.3483 5.7112 5.7112 5.7560 5.7560 6.0555 6.0555 6.1382 6.1382 6.2153 6.2153 6.3108 6.3108 6.3775 6.3775 6.4425 6.4425 6.5068 6.5068 6.6269 6.6269 6.8027 6.8027 8.0148 8.0148 8.0315 8.0315 10.5354 10.5354 10.5651 10.5651 12.1792 12.1792 12.1993 12.1993 13.4766 13.4766 k = 0.3268 0.5660-0.0000 ( 4476 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7599 -8.7599 -8.7461 -8.7461 -7.6981 -7.6981 -7.6507 -7.6507 -7.6383 -7.6383 -7.5362 -7.5362 -0.4909 -0.4909 -0.4724 -0.4724 4.4611 4.4611 4.4685 4.4685 5.3534 5.3534 5.7111 5.7111 5.7559 5.7559 6.0552 6.0552 6.1386 6.1386 6.2142 6.2142 6.3109 6.3109 6.3777 6.3777 6.4421 6.4421 6.5049 6.5049 6.6307 6.6307 6.8054 6.8054 8.0124 8.0124 8.0322 8.0322 10.4963 10.4963 10.6060 10.6060 12.1563 12.1563 12.2132 12.2132 13.4844 13.4844 k = 0.3203 0.5547-0.0000 ( 4484 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7599 -8.7599 -8.7460 -8.7460 -7.6978 -7.6978 -7.6523 -7.6523 -7.6364 -7.6364 -7.5360 -7.5360 -0.4977 -0.4977 -0.4691 -0.4691 4.4557 4.4557 4.4676 4.4676 5.3680 5.3680 5.7109 5.7109 5.7555 5.7555 6.0541 6.0541 6.1398 6.1398 6.2111 6.2111 6.3114 6.3114 6.3780 6.3780 6.4411 6.4411 6.5003 6.5003 6.6410 6.6410 6.8135 6.8135 8.0048 8.0048 8.0342 8.0342 10.4495 10.4495 10.6581 10.6581 12.1274 12.1274 12.2158 12.2158 13.5062 13.5062 k = 0.3137 0.5434-0.0000 ( 4484 PWs) bands (ev): -25.8335 -25.8335 -25.8273 -25.8273 -8.7597 -8.7597 -8.7458 -8.7458 -7.6974 -7.6974 -7.6542 -7.6542 -7.6339 -7.6339 -7.5356 -7.5356 -0.5058 -0.5058 -0.4670 -0.4670 4.4444 4.4444 4.4701 4.4701 5.3908 5.3908 5.7107 5.7107 5.7547 5.7547 6.0524 6.0524 6.1417 6.1417 6.2062 6.2062 6.3122 6.3122 6.3784 6.3784 6.4393 6.4393 6.4949 6.4949 6.6559 6.6559 6.8272 6.8272 7.9926 7.9926 8.0368 8.0368 10.4064 10.4064 10.7106 10.7106 12.0997 12.0997 12.2018 12.2018 13.5374 13.5374 k = 0.3072 0.5321-0.0000 ( 4476 PWs) bands (ev): -25.8335 -25.8335 -25.8273 -25.8273 -8.7595 -8.7595 -8.7454 -8.7454 -7.6968 -7.6968 -7.6562 -7.6562 -7.6312 -7.6312 -7.5351 -7.5351 -0.5146 -0.5146 -0.4669 -0.4669 4.4296 4.4296 4.4752 4.4752 5.4199 5.4199 5.7106 5.7106 5.7537 5.7537 6.0499 6.0499 6.1441 6.1441 6.2003 6.2003 6.3132 6.3132 6.3790 6.3790 6.4372 6.4372 6.4903 6.4903 6.6741 6.6741 6.8465 6.8465 7.9761 7.9761 8.0392 8.0392 10.3676 10.3676 10.7634 10.7634 12.0736 12.0736 12.1736 12.1736 13.5714 13.5714 k = 0.3007 0.5207-0.0000 ( 4484 PWs) bands (ev): -25.8337 -25.8337 -25.8274 -25.8274 -8.7592 -8.7592 -8.7449 -8.7449 -7.6960 -7.6960 -7.6581 -7.6581 -7.6284 -7.6284 -7.5344 -7.5344 -0.5240 -0.5240 -0.4690 -0.4690 4.4132 4.4132 4.4825 4.4825 5.4533 5.4533 5.7103 5.7103 5.7526 5.7526 6.0463 6.0463 6.1468 6.1468 6.1941 6.1941 6.3143 6.3143 6.3798 6.3798 6.4350 6.4350 6.4872 6.4872 6.6948 6.6948 6.8709 6.8709 7.9555 7.9555 8.0412 8.0412 10.3333 10.3333 10.8166 10.8166 12.0494 12.0494 12.1343 12.1343 13.6003 13.6003 k = 0.2941 0.5094-0.0000 ( 4484 PWs) bands (ev): -25.8338 -25.8338 -25.8276 -25.8276 -8.7589 -8.7589 -8.7442 -8.7442 -7.6949 -7.6949 -7.6598 -7.6598 -7.6255 -7.6255 -7.5336 -7.5336 -0.5339 -0.5339 -0.4733 -0.4733 4.3967 4.3967 4.4919 4.4919 5.4890 5.4890 5.7096 5.7096 5.7520 5.7520 6.0411 6.0411 6.1498 6.1498 6.1892 6.1892 6.3153 6.3153 6.3809 6.3809 6.4330 6.4330 6.4860 6.4860 6.7178 6.7178 6.9000 6.9000 7.9308 7.9308 8.0426 8.0426 10.3036 10.3036 10.8707 10.8707 12.0269 12.0269 12.0869 12.0869 13.6163 13.6163 k = 0.2876 0.4981-0.0000 ( 4478 PWs) bands (ev): -25.8340 -25.8340 -25.8277 -25.8277 -8.7584 -8.7584 -8.7435 -8.7435 -7.6936 -7.6936 -7.6613 -7.6613 -7.6226 -7.6226 -7.5328 -7.5328 -0.5444 -0.5444 -0.4801 -0.4801 4.3812 4.3812 4.5034 4.5034 5.5250 5.5250 5.7082 5.7082 5.7522 5.7522 6.0336 6.0336 6.1533 6.1533 6.1869 6.1869 6.3161 6.3161 6.3825 6.3825 6.4316 6.4316 6.4867 6.4867 6.7433 6.7433 6.9334 6.9334 7.9021 7.9021 8.0431 8.0431 10.2786 10.2786 10.9261 10.9261 12.0054 12.0054 12.0346 12.0346 13.6139 13.6139 k = 0.2810 0.4868-0.0000 ( 4480 PWs) bands (ev): -25.8342 -25.8342 -25.8279 -25.8279 -8.7578 -8.7578 -8.7425 -8.7425 -7.6921 -7.6921 -7.6626 -7.6626 -7.6196 -7.6196 -7.5318 -7.5318 -0.5554 -0.5554 -0.4895 -0.4895 4.3678 4.3678 4.5168 4.5168 5.5593 5.5593 5.7056 5.7056 5.7537 5.7537 6.0233 6.0233 6.1574 6.1574 6.1887 6.1887 6.3165 6.3165 6.3848 6.3848 6.4309 6.4309 6.4893 6.4893 6.7718 6.7718 6.9704 6.9704 7.8694 7.8694 8.0428 8.0428 10.2585 10.2585 10.9832 10.9832 11.9699 11.9699 11.9941 11.9941 13.5912 13.5912 k = 0.2745 0.4755-0.0000 ( 4476 PWs) bands (ev): -25.8344 -25.8344 -25.8281 -25.8281 -8.7572 -8.7572 -8.7414 -8.7414 -7.6902 -7.6902 -7.6638 -7.6638 -7.6166 -7.6166 -7.5308 -7.5308 -0.5667 -0.5667 -0.5014 -0.5014 4.3572 4.3572 4.5321 4.5321 5.5903 5.5903 5.7017 5.7017 5.7567 5.7567 6.0098 6.0098 6.1618 6.1618 6.1961 6.1961 6.3166 6.3166 6.3880 6.3880 6.4308 6.4308 6.4942 6.4942 6.8034 6.8034 7.0106 7.0106 7.8331 7.8331 8.0414 8.0414 10.2433 10.2433 11.0423 11.0423 11.9114 11.9114 11.9759 11.9759 13.5501 13.5501 k = 0.2680 0.4641-0.0000 ( 4476 PWs) bands (ev): -25.8346 -25.8346 -25.8284 -25.8284 -8.7565 -8.7565 -8.7401 -8.7401 -7.6881 -7.6881 -7.6647 -7.6647 -7.6135 -7.6135 -7.5297 -7.5297 -0.5785 -0.5785 -0.5160 -0.5160 4.3498 4.3498 4.5492 4.5492 5.6164 5.6164 5.6966 5.6966 5.7613 5.7613 5.9934 5.9934 6.1659 6.1659 6.2100 6.2100 6.3164 6.3164 6.3922 6.3922 6.4313 6.4313 6.5014 6.5014 6.8386 6.8386 7.0537 7.0537 7.7931 7.7931 8.0391 8.0391 10.2331 10.2331 11.1037 11.1037 11.8491 11.8491 11.9618 11.9618 13.4943 13.4943 k = 0.2614 0.4528-0.0000 ( 4478 PWs) bands (ev): -25.8349 -25.8349 -25.8286 -25.8286 -8.7556 -8.7556 -8.7386 -8.7386 -7.6857 -7.6857 -7.6655 -7.6655 -7.6104 -7.6104 -7.5285 -7.5285 -0.5906 -0.5906 -0.5331 -0.5331 4.3460 4.3460 4.5680 4.5680 5.6367 5.6367 5.6904 5.6904 5.7674 5.7674 5.9747 5.9747 6.1692 6.1692 6.2302 6.2302 6.3158 6.3158 6.3978 6.3978 6.4325 6.4325 6.5114 6.5114 6.8777 6.8777 7.0994 7.0994 7.7500 7.7500 8.0356 8.0356 10.2279 10.2279 11.1676 11.1676 11.7855 11.7855 11.9502 11.9502 13.4277 13.4277 k = 0.2549 0.4415-0.0000 ( 4478 PWs) bands (ev): -25.8352 -25.8352 -25.8289 -25.8289 -8.7547 -8.7547 -8.7370 -8.7370 -7.6830 -7.6830 -7.6660 -7.6660 -7.6073 -7.6073 -7.5274 -7.5274 -0.6030 -0.6030 -0.5527 -0.5527 4.3461 4.3461 4.5883 4.5883 5.6506 5.6506 5.6836 5.6836 5.7748 5.7748 5.9543 5.9543 6.1720 6.1720 6.2549 6.2549 6.3150 6.3150 6.4054 6.4054 6.4344 6.4344 6.5244 6.5244 6.9209 6.9209 7.1474 7.1474 7.7039 7.7039 8.0311 8.0311 10.2277 10.2277 11.2343 11.2343 11.7215 11.7215 11.9407 11.9407 13.3535 13.3535 k = 0.2484 0.4302-0.0000 ( 4480 PWs) bands (ev): -25.8356 -25.8356 -25.8292 -25.8292 -8.7537 -8.7537 -8.7351 -8.7351 -7.6801 -7.6801 -7.6664 -7.6664 -7.6042 -7.6042 -7.5262 -7.5262 -0.6157 -0.6157 -0.5748 -0.5748 4.3502 4.3502 4.6100 4.6100 5.6579 5.6579 5.6767 5.6767 5.7832 5.7832 5.9329 5.9329 6.1744 6.1744 6.2810 6.2810 6.3142 6.3142 6.4153 6.4153 6.4383 6.4383 6.5407 6.5407 6.9683 6.9683 7.1976 7.1976 7.6552 7.6552 8.0255 8.0255 10.2326 10.2326 11.3039 11.3039 11.6575 11.6575 11.9333 11.9333 13.2740 13.2740 k = 0.2418 0.4189-0.0000 ( 4478 PWs) bands (ev): -25.8359 -25.8359 -25.8296 -25.8296 -8.7525 -8.7525 -8.7331 -8.7331 -7.6770 -7.6770 -7.6665 -7.6665 -7.6009 -7.6009 -7.5250 -7.5250 -0.6287 -0.6287 -0.5993 -0.5993 4.3583 4.3583 4.6329 4.6329 5.6578 5.6578 5.6711 5.6711 5.7923 5.7923 5.9111 5.9111 6.1763 6.1763 6.3034 6.3034 6.3145 6.3145 6.4254 6.4254 6.4490 6.4490 6.5607 6.5607 7.0202 7.0202 7.2497 7.2497 7.6045 7.6045 8.0189 8.0189 10.2423 10.2423 11.3763 11.3763 11.5939 11.5939 11.9278 11.9278 13.1909 13.1909 k = 0.2353 0.4075-0.0000 ( 4478 PWs) bands (ev): -25.8363 -25.8363 -25.8300 -25.8300 -8.7513 -8.7513 -8.7309 -8.7309 -7.6737 -7.6737 -7.6662 -7.6662 -7.5976 -7.5976 -7.5238 -7.5238 -0.6422 -0.6422 -0.6256 -0.6256 4.3705 4.3705 4.6568 4.6568 5.6515 5.6515 5.6666 5.6666 5.8013 5.8013 5.8898 5.8898 6.1780 6.1780 6.3094 6.3094 6.3254 6.3254 6.4312 6.4312 6.4729 6.4729 6.5845 6.5845 7.0764 7.0764 7.3036 7.3036 7.5522 7.5522 8.0113 8.0113 10.2570 10.2570 11.4514 11.4514 11.5311 11.5311 11.9241 11.9241 13.1054 13.1054 k = 0.2288 0.3962-0.0000 ( 4472 PWs) bands (ev): -25.8367 -25.8367 -25.8304 -25.8304 -8.7500 -8.7500 -8.7285 -8.7285 -7.6709 -7.6709 -7.6652 -7.6652 -7.5943 -7.5943 -7.5225 -7.5225 -0.6591 -0.6591 -0.6508 -0.6508 4.3865 4.3865 4.6816 4.6816 5.6422 5.6422 5.6605 5.6605 5.8088 5.8088 5.8707 5.8707 6.1794 6.1794 6.3085 6.3085 6.3368 6.3368 6.4348 6.4348 6.5074 6.5074 6.6128 6.6128 7.1368 7.1368 7.3583 7.3583 7.4997 7.4997 8.0027 8.0027 10.2766 10.2766 11.4684 11.4684 11.5304 11.5304 11.9222 11.9222 13.0184 13.0184 k = 0.2222 0.3849-0.0000 ( 4465 PWs) bands (ev): -25.8372 -25.8372 -25.8308 -25.8308 -8.7486 -8.7486 -8.7259 -8.7259 -7.6691 -7.6691 -7.6626 -7.6626 -7.5908 -7.5908 -7.5213 -7.5213 -0.6875 -0.6875 -0.6665 -0.6665 4.4062 4.4062 4.7069 4.7069 5.6316 5.6316 5.6521 5.6521 5.8100 5.8100 5.8585 5.8585 6.1805 6.1805 6.3069 6.3069 6.3438 6.3438 6.4378 6.4378 6.5483 6.5483 6.6459 6.6459 7.2009 7.2009 7.4057 7.4057 7.4556 7.4556 7.9934 7.9934 10.3009 10.3009 11.4078 11.4078 11.6111 11.6111 11.9219 11.9219 12.9304 12.9304 k = 0.2157 0.3736-0.0000 ( 4475 PWs) bands (ev): -25.8377 -25.8377 -25.8312 -25.8312 -8.7472 -8.7472 -8.7232 -8.7232 -7.6683 -7.6683 -7.6588 -7.6588 -7.5872 -7.5872 -7.5201 -7.5201 -0.7199 -0.7199 -0.6801 -0.6801 4.4294 4.4294 4.7327 4.7327 5.6200 5.6200 5.6413 5.6413 5.7993 5.7993 5.8588 5.8588 6.1812 6.1812 6.3050 6.3050 6.3475 6.3475 6.4408 6.4408 6.5926 6.5926 6.6843 6.6843 7.2673 7.2673 7.3818 7.3818 7.4857 7.4857 7.9832 7.9832 10.3298 10.3298 11.3482 11.3482 11.6945 11.6945 11.9230 11.9230 12.8420 12.8420 k = 0.2092 0.3623-0.0000 ( 4479 PWs) bands (ev): -25.8382 -25.8382 -25.8317 -25.8317 -8.7456 -8.7456 -8.7203 -8.7203 -7.6678 -7.6678 -7.6542 -7.6542 -7.5836 -7.5836 -7.5190 -7.5190 -0.7541 -0.7541 -0.6934 -0.6934 4.4558 4.4558 4.7586 4.7586 5.6077 5.6077 5.6287 5.6287 5.7812 5.7812 5.8674 5.8674 6.1817 6.1817 6.3030 6.3030 6.3491 6.3491 6.4439 6.4439 6.6386 6.6386 6.7283 6.7283 7.3089 7.3089 7.3587 7.3587 7.5448 7.5448 7.9725 7.9725 10.3632 10.3632 11.2900 11.2900 11.7803 11.7803 11.9254 11.9254 12.7536 12.7536 k = 0.2026 0.3509-0.0000 ( 4475 PWs) bands (ev): -25.8387 -25.8387 -25.8322 -25.8322 -8.7441 -8.7441 -8.7173 -8.7173 -7.6674 -7.6674 -7.6493 -7.6493 -7.5798 -7.5798 -7.5178 -7.5178 -0.7899 -0.7899 -0.7065 -0.7065 4.4853 4.4853 4.7846 4.7846 5.5946 5.5946 5.6145 5.6145 5.7607 5.7607 5.8793 5.8793 6.1819 6.1819 6.3009 6.3009 6.3494 6.3494 6.4472 6.4472 6.6856 6.6856 6.7776 6.7776 7.2646 7.2646 7.4229 7.4229 7.6076 7.6076 7.9613 7.9613 10.4010 10.4010 11.2332 11.2332 11.8675 11.8675 11.9297 11.9297 12.6653 12.6653 k = 0.1961 0.3396-0.0000 ( 4485 PWs) bands (ev): -25.8392 -25.8392 -25.8327 -25.8327 -8.7424 -8.7424 -8.7141 -8.7141 -7.6670 -7.6670 -7.6440 -7.6440 -7.5759 -7.5759 -7.5167 -7.5167 -0.8269 -0.8269 -0.7196 -0.7196 4.5174 4.5174 4.8104 4.8104 5.5806 5.5806 5.5991 5.5991 5.7395 5.7395 5.8925 5.8925 6.1819 6.1819 6.2988 6.2988 6.3488 6.3488 6.4505 6.4505 6.7339 6.7339 6.8317 6.8317 7.2107 7.2107 7.4993 7.4993 7.6726 7.6726 7.9496 7.9496 10.4430 10.4430 11.1780 11.1780 11.9275 11.9275 11.9638 11.9638 12.5775 12.5775 k = 0.1895 0.3283-0.0000 ( 4493 PWs) bands (ev): -25.8398 -25.8398 -25.8332 -25.8332 -8.7408 -8.7408 -8.7109 -8.7109 -7.6667 -7.6667 -7.6384 -7.6384 -7.5718 -7.5718 -7.5156 -7.5156 -0.8649 -0.8649 -0.7324 -0.7324 4.5518 4.5518 4.8358 4.8358 5.5659 5.5659 5.5827 5.5827 5.7183 5.7183 5.9063 5.9063 6.1816 6.1816 6.2966 6.2966 6.3475 6.3475 6.4541 6.4541 6.7841 6.7841 6.8897 6.8897 7.1571 7.1571 7.5788 7.5788 7.7394 7.7394 7.9378 7.9378 10.4891 10.4891 11.1245 11.1245 11.9344 11.9344 12.0531 12.0531 12.4904 12.4904 k = 0.1830 0.3170-0.0000 ( 4499 PWs) bands (ev): -25.8403 -25.8403 -25.8338 -25.8338 -8.7391 -8.7391 -8.7075 -8.7075 -7.6663 -7.6663 -7.6326 -7.6326 -7.5677 -7.5677 -7.5146 -7.5146 -0.9037 -0.9037 -0.7451 -0.7451 4.5883 4.5883 4.8606 4.8606 5.5503 5.5503 5.5656 5.5656 5.6973 5.6973 5.9203 5.9203 6.1811 6.1811 6.2946 6.2946 6.3458 6.3458 6.4577 6.4577 6.8364 6.8364 6.9504 6.9504 7.1057 7.1057 7.6602 7.6602 7.8079 7.8079 7.9258 7.9258 10.5392 10.5392 11.0726 11.0726 11.9390 11.9390 12.1461 12.1461 12.4044 12.4044 k = 0.1765 0.3057-0.0000 ( 4507 PWs) bands (ev): -25.8409 -25.8409 -25.8343 -25.8343 -8.7373 -8.7373 -8.7040 -8.7040 -7.6659 -7.6659 -7.6265 -7.6265 -7.5633 -7.5633 -7.5136 -7.5136 -0.9432 -0.9432 -0.7575 -0.7575 4.6264 4.6264 4.8848 4.8848 5.5339 5.5339 5.5478 5.5478 5.6768 5.6768 5.9344 5.9344 6.1806 6.1806 6.2926 6.2926 6.3437 6.3437 6.4614 6.4614 6.8906 6.8906 7.0065 7.0065 7.0647 7.0647 7.7427 7.7427 7.8778 7.8778 7.9141 7.9141 10.5930 10.5930 11.0225 11.0225 11.9430 11.9430 12.2394 12.2394 12.3204 12.3204 k = 0.1699 0.2943-0.0000 ( 4495 PWs) bands (ev): -25.8415 -25.8415 -25.8349 -25.8349 -8.7356 -8.7356 -8.7005 -8.7005 -7.6656 -7.6656 -7.6202 -7.6202 -7.5589 -7.5589 -7.5126 -7.5126 -0.9830 -0.9830 -0.7697 -0.7697 4.6658 4.6658 4.9082 4.9082 5.5166 5.5166 5.5297 5.5297 5.6568 5.6568 5.9482 5.9482 6.1801 6.1801 6.2909 6.2909 6.3414 6.3414 6.4652 6.4652 6.9405 6.9405 7.0029 7.0029 7.0962 7.0962 7.8258 7.8258 7.9013 7.9013 7.9506 7.9506 10.6504 10.6504 10.9743 10.9743 11.9461 11.9461 12.2337 12.2337 12.3375 12.3375 k = 0.1634 0.2830-0.0000 ( 4503 PWs) bands (ev): -25.8421 -25.8421 -25.8355 -25.8355 -8.7339 -8.7339 -8.6969 -8.6969 -7.6652 -7.6652 -7.6137 -7.6137 -7.5544 -7.5544 -7.5117 -7.5117 -1.0230 -1.0230 -0.7816 -0.7816 4.7062 4.7062 4.9307 4.9307 5.4984 5.4984 5.5113 5.5113 5.6374 5.6374 5.9614 5.9614 6.1796 6.1796 6.2892 6.2892 6.3389 6.3389 6.4690 6.4690 6.9343 6.9343 7.0268 7.0268 7.1650 7.1650 7.8891 7.8891 7.9098 7.9098 8.0236 8.0236 10.7112 10.7112 10.9280 10.9280 11.9479 11.9479 12.1524 12.1524 12.4321 12.4321 k = 0.1569 0.2717-0.0000 ( 4499 PWs) bands (ev): -25.8427 -25.8427 -25.8360 -25.8360 -8.7322 -8.7322 -8.6933 -8.6933 -7.6649 -7.6649 -7.6071 -7.6071 -7.5497 -7.5497 -7.5108 -7.5108 -1.0631 -1.0631 -0.7932 -0.7932 4.7473 4.7473 4.9522 4.9522 5.4792 5.4792 5.4929 5.4929 5.6186 5.6186 5.9738 5.9738 6.1796 6.1796 6.2878 6.2878 6.3363 6.3363 6.4727 6.4727 6.8935 6.8935 7.0889 7.0889 7.2396 7.2396 7.8781 7.8781 7.9924 7.9924 8.0980 8.0980 10.7748 10.7748 10.8839 10.8839 11.9479 11.9479 12.0722 12.0722 12.5268 12.5268 k = 0.1503 0.2604-0.0000 ( 4491 PWs) bands (ev): -25.8433 -25.8433 -25.8366 -25.8366 -8.7305 -8.7305 -8.6896 -8.6896 -7.6647 -7.6647 -7.6003 -7.6003 -7.5449 -7.5449 -7.5100 -7.5100 -1.1029 -1.1029 -0.8045 -0.8045 4.7886 4.7886 4.9725 4.9725 5.4589 5.4589 5.4747 5.4747 5.6005 5.6005 5.9850 5.9850 6.1800 6.1800 6.2866 6.2866 6.3337 6.3337 6.4763 6.4763 6.8511 6.8511 7.1580 7.1580 7.3182 7.3182 7.8671 7.8671 8.0747 8.0747 8.1735 8.1735 10.8293 10.8293 10.8540 10.8540 11.9455 11.9455 11.9941 11.9941 12.6202 12.6202 k = 0.1438 0.2491-0.0000 ( 4499 PWs) bands (ev): -25.8439 -25.8439 -25.8372 -25.8372 -8.7289 -8.7289 -8.6860 -8.6860 -7.6644 -7.6644 -7.5935 -7.5935 -7.5401 -7.5401 -7.5092 -7.5092 -1.1424 -1.1424 -0.8154 -0.8154 4.8299 4.8299 4.9918 4.9918 5.4377 5.4377 5.4565 5.4565 5.5832 5.5832 5.9947 5.9947 6.1811 6.1811 6.2855 6.2855 6.3310 6.3310 6.4798 6.4798 6.8105 6.8105 7.2315 7.2315 7.4005 7.4005 7.8566 7.8566 8.1561 8.1561 8.2499 8.2499 10.7974 10.7974 10.9153 10.9153 11.9178 11.9178 11.9406 11.9406 12.7112 12.7112 k = 0.1373 0.2377-0.0000 ( 4501 PWs) bands (ev): -25.8445 -25.8445 -25.8378 -25.8378 -8.7273 -8.7273 -8.6824 -8.6824 -7.6642 -7.6642 -7.5865 -7.5865 -7.5352 -7.5352 -7.5084 -7.5084 -1.1814 -1.1814 -0.8260 -0.8260 4.8709 4.8709 5.0099 5.0099 5.4155 5.4155 5.4388 5.4388 5.5666 5.5666 6.0028 6.0028 6.1832 6.1832 6.2846 6.2846 6.3283 6.3283 6.4831 6.4831 6.7725 6.7725 7.3088 7.3088 7.4863 7.4863 7.8466 7.8466 8.2362 8.2362 8.3268 8.3268 10.7588 10.7588 10.9879 10.9879 11.8445 11.8445 11.9317 11.9317 12.7977 12.7977 k = 0.1307 0.2264-0.0000 ( 4499 PWs) bands (ev): -25.8451 -25.8451 -25.8383 -25.8383 -8.7257 -8.7257 -8.6788 -8.6788 -7.6640 -7.6640 -7.5795 -7.5795 -7.5302 -7.5302 -7.5077 -7.5077 -1.2197 -1.2197 -0.8361 -0.8361 4.9112 4.9112 5.0268 5.0268 5.3924 5.3924 5.4215 5.4215 5.5510 5.5510 6.0090 6.0090 6.1863 6.1863 6.2838 6.2838 6.3257 6.3257 6.4861 6.4861 6.7373 6.7373 7.3898 7.3898 7.5758 7.5758 7.8372 7.8372 8.3144 8.3144 8.4042 8.4042 10.7217 10.7217 11.0634 11.0634 11.7738 11.7738 11.9189 11.9189 12.8741 12.8741 k = 0.1242 0.2151-0.0000 ( 4499 PWs) bands (ev): -25.8457 -25.8457 -25.8389 -25.8389 -8.7242 -8.7242 -8.6753 -8.6753 -7.6638 -7.6638 -7.5726 -7.5726 -7.5253 -7.5253 -7.5070 -7.5070 -1.2571 -1.2571 -0.8458 -0.8458 4.9506 4.9506 5.0426 5.0426 5.3687 5.3687 5.4047 5.4047 5.5361 5.5361 6.0132 6.0132 6.1906 6.1906 6.2831 6.2831 6.3232 6.3232 6.4888 6.4888 6.7051 6.7051 7.4743 7.4743 7.6688 7.6688 7.8287 7.8287 8.3903 8.3903 8.4820 8.4820 10.6862 10.6862 11.1414 11.1414 11.7058 11.7058 11.9015 11.9015 12.9207 12.9207 k = 0.1176 0.2038-0.0000 ( 4495 PWs) bands (ev): -25.8463 -25.8463 -25.8395 -25.8395 -8.7228 -8.7228 -8.6719 -8.6719 -7.6637 -7.6637 -7.5657 -7.5657 -7.5203 -7.5203 -7.5063 -7.5063 -1.2935 -1.2935 -0.8552 -0.8552 4.9889 4.9889 5.0572 5.0572 5.3444 5.3444 5.3886 5.3886 5.5221 5.5221 6.0155 6.0155 6.1959 6.1959 6.2823 6.2823 6.3208 6.3208 6.4911 6.4911 6.6761 6.6761 7.5620 7.5620 7.7646 7.7646 7.8217 7.8217 8.4632 8.4632 8.5604 8.5604 10.6525 10.6525 11.2215 11.2215 11.6408 11.6408 11.8790 11.8790 12.9091 12.9091 k = 0.1111 0.1925-0.0000 ( 4497 PWs) bands (ev): -25.8469 -25.8469 -25.8400 -25.8400 -8.7214 -8.7214 -8.6685 -8.6685 -7.6636 -7.6636 -7.5588 -7.5588 -7.5154 -7.5154 -7.5056 -7.5056 -1.3288 -1.3288 -0.8640 -0.8640 5.0256 5.0256 5.0707 5.0707 5.3196 5.3196 5.3732 5.3732 5.5090 5.5090 6.0160 6.0160 6.2021 6.2021 6.2814 6.2814 6.3187 6.3187 6.4929 6.4929 6.6503 6.6503 7.6526 7.6526 7.8111 7.8111 7.8684 7.8684 8.5323 8.5323 8.6395 8.6395 10.6204 10.6204 11.3035 11.3035 11.5789 11.5789 11.8509 11.8509 12.8682 12.8682 k = 0.1046 0.1811-0.0000 ( 4497 PWs) bands (ev): -25.8474 -25.8474 -25.8405 -25.8405 -8.7201 -8.7201 -8.6653 -8.6653 -7.6635 -7.6635 -7.5521 -7.5521 -7.5105 -7.5105 -7.5049 -7.5049 -1.3628 -1.3628 -0.8724 -0.8724 5.0607 5.0607 5.0829 5.0829 5.2948 5.2948 5.3587 5.3587 5.4969 5.4969 6.0150 6.0150 6.2090 6.2090 6.2804 6.2804 6.3167 6.3167 6.4941 6.4941 6.6278 6.6278 7.7460 7.7460 7.8058 7.8058 7.9714 7.9714 8.5973 8.5973 8.7194 8.7194 10.5899 10.5899 11.3869 11.3869 11.5199 11.5199 11.8170 11.8170 12.8213 12.8213 k = 0.0980 0.1698-0.0000 ( 4507 PWs) bands (ev): -25.8480 -25.8480 -25.8410 -25.8410 -8.7189 -8.7189 -8.6622 -8.6622 -7.6635 -7.6635 -7.5457 -7.5457 -7.5058 -7.5058 -7.5042 -7.5042 -1.3954 -1.3954 -0.8804 -0.8804 5.0929 5.0929 5.0949 5.0949 5.2699 5.2699 5.3452 5.3452 5.4857 5.4857 6.0128 6.0128 6.2162 6.2162 6.2792 6.2792 6.3151 6.3151 6.4944 6.4944 6.6086 6.6086 7.7998 7.7998 7.8422 7.8422 8.0787 8.0787 8.6576 8.6576 8.7999 8.7999 10.5610 10.5610 11.4635 11.4635 11.4718 11.4718 11.7771 11.7771 12.7742 12.7742 k = 0.0915 0.1585-0.0000 ( 4507 PWs) bands (ev): -25.8485 -25.8485 -25.8415 -25.8415 -8.7178 -8.7178 -8.6592 -8.6592 -7.6634 -7.6634 -7.5394 -7.5394 -7.5036 -7.5036 -7.5009 -7.5009 -1.4264 -1.4264 -0.8879 -0.8879 5.1037 5.1037 5.1247 5.1247 5.2455 5.2455 5.3329 5.3329 5.4755 5.4755 6.0096 6.0096 6.2236 6.2236 6.2777 6.2777 6.3138 6.3138 6.4939 6.4939 6.5927 6.5927 7.7950 7.7950 7.9399 7.9399 8.1894 8.1894 8.7131 8.7131 8.8808 8.8808 10.5335 10.5335 11.4102 11.4102 11.5569 11.5569 11.7311 11.7311 12.7285 12.7285 k = 0.0850 0.1472-0.0000 ( 4513 PWs) bands (ev): -25.8490 -25.8490 -25.8420 -25.8420 -8.7167 -8.7167 -8.6564 -8.6564 -7.6634 -7.6634 -7.5335 -7.5335 -7.5028 -7.5028 -7.4964 -7.4964 -1.4558 -1.4558 -0.8949 -0.8949 5.1124 5.1124 5.1527 5.1527 5.2219 5.2219 5.3220 5.3220 5.4663 5.4663 6.0057 6.0057 6.2308 6.2308 6.2761 6.2761 6.3128 6.3128 6.4923 6.4923 6.5802 6.5802 7.7908 7.7908 8.0395 8.0395 8.3033 8.3033 8.7637 8.7637 8.9617 8.9617 10.5074 10.5074 11.3589 11.3589 11.6414 11.6414 11.6803 11.6803 12.6843 12.6843 k = 0.0784 0.1358-0.0000 ( 4525 PWs) bands (ev): -25.8494 -25.8494 -25.8424 -25.8424 -8.7158 -8.7158 -8.6538 -8.6538 -7.6634 -7.6634 -7.5281 -7.5281 -7.5019 -7.5019 -7.4921 -7.4921 -1.4834 -1.4834 -0.9014 -0.9014 5.1198 5.1198 5.1753 5.1753 5.2018 5.2018 5.3125 5.3125 5.4583 5.4583 6.0014 6.0014 6.2377 6.2377 6.2742 6.2742 6.3121 6.3121 6.4897 6.4897 6.5707 6.5707 7.7872 7.7872 8.1402 8.1402 8.4201 8.4201 8.8095 8.8095 9.0421 9.0421 10.4827 10.4827 11.3094 11.3094 11.6203 11.6203 11.7290 11.7290 12.6042 12.6042 k = 0.0719 0.1245-0.0000 ( 4529 PWs) bands (ev): -25.8499 -25.8499 -25.8428 -25.8428 -8.7149 -8.7149 -8.6513 -8.6513 -7.6634 -7.6634 -7.5232 -7.5232 -7.5007 -7.5007 -7.4880 -7.4880 -1.5092 -1.5092 -0.9074 -0.9074 5.1260 5.1260 5.1710 5.1710 5.2064 5.2064 5.3050 5.3050 5.4515 5.4515 5.9968 5.9968 6.2441 6.2441 6.2721 6.2721 6.3120 6.3120 6.4862 6.4862 6.5639 6.5639 7.7843 7.7843 8.2416 8.2416 8.5393 8.5393 8.8507 8.8507 9.1215 9.1215 10.4592 10.4592 11.2608 11.2608 11.5575 11.5575 11.8132 11.8132 12.4836 12.4836 k = 0.0654 0.1132-0.0000 ( 4523 PWs) bands (ev): -25.8503 -25.8503 -25.8432 -25.8432 -8.7141 -8.7141 -8.6490 -8.6490 -7.6634 -7.6634 -7.5189 -7.5189 -7.4993 -7.4993 -7.4841 -7.4841 -1.5331 -1.5331 -0.9129 -0.9129 5.1310 5.1310 5.1515 5.1515 5.2238 5.2238 5.2997 5.2997 5.4461 5.4461 5.9922 5.9922 6.2498 6.2498 6.2700 6.2700 6.3122 6.3122 6.4824 6.4824 6.5593 6.5593 7.7819 7.7819 8.3429 8.3429 8.6606 8.6606 8.8875 8.8875 9.1993 9.1993 10.4368 10.4368 11.2123 11.2123 11.4898 11.4898 11.8960 11.8960 12.3669 12.3669 k = 0.0588 0.1019-0.0000 ( 4523 PWs) bands (ev): -25.8506 -25.8506 -25.8436 -25.8436 -8.7134 -8.7134 -8.6469 -8.6469 -7.6635 -7.6635 -7.5155 -7.5155 -7.4974 -7.4974 -7.4805 -7.4805 -1.5550 -1.5550 -0.9179 -0.9179 5.1310 5.1310 5.1357 5.1357 5.2382 5.2382 5.2971 5.2971 5.4421 5.4421 5.9876 5.9876 6.2547 6.2547 6.2680 6.2680 6.3129 6.3129 6.4784 6.4784 6.5563 6.5563 7.7800 7.7800 8.4432 8.4432 8.7827 8.7827 8.9206 8.9206 9.2749 9.2749 10.4154 10.4154 11.1628 11.1628 11.4183 11.4183 11.9763 11.9763 12.2557 12.2557 k = 0.0523 0.0906-0.0000 ( 4523 PWs) bands (ev): -25.8510 -25.8510 -25.8439 -25.8439 -8.7127 -8.7127 -8.6450 -8.6450 -7.6635 -7.6635 -7.5129 -7.5129 -7.4952 -7.4952 -7.4772 -7.4772 -1.5747 -1.5747 -0.9224 -0.9224 5.1134 5.1134 5.1377 5.1377 5.2481 5.2481 5.2977 5.2977 5.4396 5.4396 5.9832 5.9832 6.2588 6.2588 6.2659 6.2659 6.3139 6.3139 6.4745 6.4745 6.5544 6.5544 7.7786 7.7786 8.5415 8.5415 8.9006 8.9006 8.9549 8.9549 9.3473 9.3473 10.3948 10.3948 11.1111 11.1111 11.3441 11.3441 12.0529 12.0529 12.1514 12.1514 k = 0.0458 0.0792-0.0000 ( 4525 PWs) bands (ev): -25.8513 -25.8513 -25.8442 -25.8442 -8.7122 -8.7122 -8.6433 -8.6433 -7.6635 -7.6635 -7.5110 -7.5110 -7.4928 -7.4928 -7.4742 -7.4742 -1.5923 -1.5923 -0.9263 -0.9263 5.0969 5.0969 5.1393 5.1393 5.2538 5.2538 5.3007 5.3007 5.4387 5.4387 5.9791 5.9791 6.2620 6.2620 6.2640 6.2640 6.3152 6.3152 6.4710 6.4710 6.5532 6.5532 7.7776 7.7776 8.6364 8.6364 8.9627 8.9627 9.0412 9.0412 9.4157 9.4157 10.3747 10.3747 11.0560 11.0560 11.2690 11.2690 12.0540 12.0540 12.0845 12.0845 k = 0.0392 0.0679-0.0000 ( 4523 PWs) bands (ev): -25.8516 -25.8516 -25.8445 -25.8445 -8.7117 -8.7117 -8.6418 -8.6418 -7.6635 -7.6635 -7.5097 -7.5097 -7.4903 -7.4903 -7.4715 -7.4715 -1.6077 -1.6077 -0.9298 -0.9298 5.0822 5.0822 5.1402 5.1402 5.2568 5.2568 5.3046 5.3046 5.4391 5.4391 5.9753 5.9753 6.2620 6.2620 6.2648 6.2648 6.3167 6.3167 6.4679 6.4679 6.5525 6.5525 7.7769 7.7769 8.7263 8.7263 8.9864 8.9864 9.1613 9.1613 9.4789 9.4789 10.3547 10.3547 10.9971 10.9971 11.1949 11.1949 11.9661 11.9661 11.9833 11.9833 k = 0.0327 0.0566-0.0000 ( 4517 PWs) bands (ev): -25.8518 -25.8518 -25.8447 -25.8447 -8.7113 -8.7113 -8.6406 -8.6406 -7.6636 -7.6636 -7.5087 -7.5087 -7.4879 -7.4879 -7.4693 -7.4693 -1.6208 -1.6208 -0.9327 -0.9327 5.0695 5.0695 5.1405 5.1405 5.2584 5.2584 5.3083 5.3083 5.4405 5.4405 5.9721 5.9721 6.2605 6.2605 6.2667 6.2667 6.3184 6.3184 6.4654 6.4654 6.5521 6.5521 7.7765 7.7765 8.8090 8.8090 9.0043 9.0043 9.2810 9.2810 9.5358 9.5358 10.3340 10.3340 10.9349 10.9349 11.1241 11.1241 11.8872 11.8872 11.8985 11.8985 k = 0.0261 0.0453-0.0000 ( 4521 PWs) bands (ev): -25.8520 -25.8520 -25.8449 -25.8449 -8.7110 -8.7110 -8.6395 -8.6395 -7.6636 -7.6636 -7.5081 -7.5081 -7.4858 -7.4858 -7.4674 -7.4674 -1.6315 -1.6315 -0.9351 -0.9351 5.0589 5.0589 5.1403 5.1403 5.2595 5.2595 5.3110 5.3110 5.4424 5.4424 5.9693 5.9693 6.2591 6.2591 6.2680 6.2680 6.3199 6.3199 6.4632 6.4632 6.5519 6.5519 7.7762 7.7762 8.8818 8.8818 9.0190 9.0190 9.3956 9.3956 9.5851 9.5851 10.3120 10.3120 10.8717 10.8717 11.0596 11.0596 11.8197 11.8197 11.8304 11.8304 k = 0.0196 0.0340-0.0000 ( 4525 PWs) bands (ev): -25.8521 -25.8521 -25.8450 -25.8450 -8.7107 -8.7107 -8.6387 -8.6387 -7.6636 -7.6636 -7.5077 -7.5077 -7.4841 -7.4841 -7.4659 -7.4659 -1.6399 -1.6399 -0.9369 -0.9369 5.0506 5.0506 5.1400 5.1400 5.2604 5.2604 5.3128 5.3128 5.4446 5.4446 5.9671 5.9671 6.2580 6.2580 6.2689 6.2689 6.3213 6.3213 6.4616 6.4616 6.5518 6.5518 7.7760 7.7760 8.9413 8.9413 9.0318 9.0318 9.5003 9.5003 9.6258 9.6258 10.2881 10.2881 10.8123 10.8123 11.0045 11.0045 11.7669 11.7669 11.7773 11.7773 k = 0.0131 0.0226-0.0000 ( 4525 PWs) bands (ev): -25.8522 -25.8522 -25.8451 -25.8451 -8.7105 -8.7105 -8.6382 -8.6382 -7.6636 -7.6636 -7.5074 -7.5074 -7.4829 -7.4829 -7.4648 -7.4648 -1.6460 -1.6460 -0.9383 -0.9383 5.0446 5.0446 5.1396 5.1396 5.2610 5.2610 5.3138 5.3138 5.4464 5.4464 5.9655 5.9655 6.2572 6.2572 6.2696 6.2696 6.3224 6.3224 6.4604 6.4604 6.5517 6.5517 7.7759 7.7759 8.9832 8.9832 9.0443 9.0443 9.5875 9.5875 9.6572 9.6572 10.2634 10.2634 10.7628 10.7628 10.9621 10.9621 11.7294 11.7294 11.7390 11.7390 k = 0.0065 0.0113-0.0000 ( 4537 PWs) bands (ev): -25.8523 -25.8523 -25.8452 -25.8452 -8.7104 -8.7104 -8.6378 -8.6378 -7.6637 -7.6637 -7.5072 -7.5072 -7.4821 -7.4821 -7.4642 -7.4642 -1.6496 -1.6496 -0.9391 -0.9391 5.0409 5.0409 5.1393 5.1393 5.2614 5.2614 5.3142 5.3142 5.4476 5.4476 5.9645 5.9645 6.2568 6.2568 6.2699 6.2699 6.3231 6.3231 6.4597 6.4597 6.5517 6.5517 7.7759 7.7759 9.0052 9.0052 9.0561 9.0561 9.6438 9.6438 9.6813 9.6813 10.2425 10.2425 10.7299 10.7299 10.9353 10.9353 11.7070 11.7070 11.7159 11.7159 k = 0.0000 0.0000 0.0000 ( 4553 PWs) bands (ev): -25.8523 -25.8523 -25.8452 -25.8452 -8.7104 -8.7104 -8.6377 -8.6377 -7.6637 -7.6637 -7.5072 -7.5072 -7.4818 -7.4818 -7.4640 -7.4640 -1.6508 -1.6508 -0.9393 -0.9393 5.0397 5.0397 5.1391 5.1391 5.2614 5.2614 5.3143 5.3143 5.4479 5.4479 5.9641 5.9641 6.2566 6.2566 6.2700 6.2700 6.3233 6.3233 6.4594 6.4594 6.5517 6.5517 7.7759 7.7759 9.0114 9.0114 9.0615 9.0615 9.6603 9.6603 9.6938 9.6938 10.2339 10.2339 10.7183 10.7183 10.9261 10.9261 11.6996 11.6996 11.7083 11.7083 k = 0.0000 0.0000 0.0000 ( 4553 PWs) bands (ev): -25.8523 -25.8523 -25.8452 -25.8452 -8.7104 -8.7104 -8.6377 -8.6377 -7.6637 -7.6637 -7.5072 -7.5072 -7.4818 -7.4818 -7.4640 -7.4640 -1.6508 -1.6508 -0.9393 -0.9393 5.0397 5.0397 5.1391 5.1391 5.2614 5.2614 5.3143 5.3143 5.4479 5.4479 5.9641 5.9641 6.2566 6.2566 6.2700 6.2700 6.3233 6.3233 6.4594 6.4594 6.5517 6.5517 7.7759 7.7759 9.0114 9.0114 9.0615 9.0615 9.6603 9.6603 9.6938 9.6938 10.2339 10.2339 10.7183 10.7183 10.9261 10.9261 11.6996 11.6996 11.7083 11.7083 k = 0.0000 0.0000 0.0129 ( 4541 PWs) bands (ev): -25.8523 -25.8523 -25.8452 -25.8452 -8.7103 -8.7103 -8.6378 -8.6378 -7.6634 -7.6634 -7.5075 -7.5075 -7.4818 -7.4818 -7.4640 -7.4640 -1.6497 -1.6497 -0.9407 -0.9407 5.0421 5.0421 5.1395 5.1395 5.2618 5.2618 5.3141 5.3141 5.4477 5.4477 5.9636 5.9636 6.2566 6.2566 6.2699 6.2699 6.3235 6.3235 6.4592 6.4592 6.5521 6.5521 7.7700 7.7700 9.0123 9.0123 9.0623 9.0623 9.6587 9.6587 9.6922 9.6922 10.2414 10.2414 10.7190 10.7190 10.9260 10.9260 11.7014 11.7014 11.7101 11.7101 k = 0.0000 0.0000 0.0257 ( 4529 PWs) bands (ev): -25.8523 -25.8523 -25.8452 -25.8452 -8.7098 -8.7098 -8.6381 -8.6381 -7.6627 -7.6627 -7.5084 -7.5084 -7.4817 -7.4817 -7.4641 -7.4641 -1.6463 -1.6463 -0.9447 -0.9447 5.0490 5.0490 5.1404 5.1404 5.2628 5.2628 5.3132 5.3132 5.4467 5.4467 5.9621 5.9621 6.2569 6.2569 6.2698 6.2698 6.3242 6.3242 6.4584 6.4584 6.5532 6.5532 7.7526 7.7526 9.0148 9.0148 9.0648 9.0648 9.6539 9.6539 9.6875 9.6875 10.2635 10.2635 10.7208 10.7208 10.9257 10.9257 11.7068 11.7068 11.7157 11.7157 k = 0.0000 0.0000 0.0386 ( 4529 PWs) bands (ev): -25.8522 -25.8522 -25.8453 -25.8453 -8.7091 -8.7091 -8.6387 -8.6387 -7.6616 -7.6616 -7.5100 -7.5100 -7.4816 -7.4816 -7.4642 -7.4642 -1.6407 -1.6407 -0.9513 -0.9513 5.0606 5.0606 5.1418 5.1418 5.2643 5.2643 5.3117 5.3117 5.4451 5.4451 5.9594 5.9594 6.2572 6.2572 6.2695 6.2695 6.3252 6.3252 6.4571 6.4571 6.5552 6.5552 7.7244 7.7244 9.0190 9.0190 9.0689 9.0689 9.6460 9.6460 9.6799 9.6799 10.2995 10.2995 10.7239 10.7239 10.9252 10.9252 11.7158 11.7158 11.7250 11.7250 k = 0.0000 0.0000 0.0515 ( 4517 PWs) bands (ev): -25.8521 -25.8521 -25.8454 -25.8454 -8.7081 -8.7081 -8.6394 -8.6394 -7.6600 -7.6600 -7.5121 -7.5121 -7.4814 -7.4814 -7.4644 -7.4644 -1.6330 -1.6330 -0.9606 -0.9606 5.0766 5.0766 5.1440 5.1440 5.2666 5.2666 5.3096 5.3096 5.4429 5.4429 5.9555 5.9555 6.2577 6.2577 6.2691 6.2691 6.3267 6.3267 6.4554 6.4554 6.5580 6.5580 7.6865 7.6865 9.0249 9.0249 9.0747 9.0747 9.6352 9.6352 9.6693 9.6693 10.3485 10.3485 10.7282 10.7282 10.9245 10.9245 11.7284 11.7284 11.7379 11.7379 k = 0.0000 0.0000 0.0644 ( 4511 PWs) bands (ev): -25.8520 -25.8520 -25.8455 -25.8455 -8.7069 -8.7069 -8.6404 -8.6404 -7.6580 -7.6580 -7.5148 -7.5148 -7.4811 -7.4811 -7.4647 -7.4647 -1.6230 -1.6230 -0.9723 -0.9723 5.0970 5.0970 5.1465 5.1465 5.2693 5.2693 5.3070 5.3070 5.4400 5.4400 5.9505 5.9505 6.2582 6.2582 6.2686 6.2686 6.3285 6.3285 6.4531 6.4531 6.5618 6.5618 7.6403 7.6403 9.0324 9.0324 9.0821 9.0821 9.6216 9.6216 9.6561 9.6561 10.4091 10.4091 10.7336 10.7336 10.9235 10.9235 11.7446 11.7446 11.7546 11.7546 k = 0.0000 0.0000 0.0772 ( 4511 PWs) bands (ev): -25.8519 -25.8519 -25.8456 -25.8456 -8.7054 -8.7054 -8.6415 -8.6415 -7.6555 -7.6555 -7.5180 -7.5180 -7.4808 -7.4808 -7.4650 -7.4650 -1.6110 -1.6110 -0.9863 -0.9863 5.1215 5.1215 5.1497 5.1497 5.2727 5.2727 5.3037 5.3037 5.4365 5.4365 5.9439 5.9439 6.2588 6.2588 6.2680 6.2680 6.3308 6.3308 6.4503 6.4503 6.5666 6.5666 7.5871 7.5871 9.0416 9.0416 9.0910 9.0910 9.6054 9.6054 9.6404 9.6404 10.4799 10.4799 10.7400 10.7400 10.9223 10.9223 11.7644 11.7644 11.7750 11.7750 k = 0.0000 0.0000 0.0901 ( 4511 PWs) bands (ev): -25.8517 -25.8517 -25.8458 -25.8458 -8.7037 -8.7037 -8.6429 -8.6429 -7.6527 -7.6527 -7.5218 -7.5218 -7.4804 -7.4804 -7.4654 -7.4654 -1.5970 -1.5970 -1.0027 -1.0027 5.1498 5.1498 5.1533 5.1533 5.2766 5.2766 5.3000 5.3000 5.4325 5.4325 5.9357 5.9357 6.2594 6.2594 6.2674 6.2674 6.3334 6.3334 6.4472 6.4472 6.5726 6.5726 7.5287 7.5287 9.0523 9.0523 9.1015 9.1015 9.5870 9.5870 9.6226 9.6226 10.5597 10.5597 10.7474 10.7474 10.9207 10.9207 11.7878 11.7878 11.7990 11.7990 k = 0.0000 0.0000 0.1030 ( 4511 PWs) bands (ev): -25.8516 -25.8516 -25.8459 -25.8459 -8.7018 -8.7018 -8.6444 -8.6444 -7.6494 -7.6494 -7.5260 -7.5260 -7.4800 -7.4800 -7.4659 -7.4659 -1.5810 -1.5810 -1.0211 -1.0211 5.1575 5.1575 5.1818 5.1818 5.2810 5.2810 5.2957 5.2957 5.4279 5.4279 5.9258 5.9258 6.2600 6.2600 6.2668 6.2668 6.3365 6.3365 6.4436 6.4436 6.5798 6.5798 7.4662 7.4662 9.0646 9.0646 9.1135 9.1135 9.5666 9.5666 9.6028 9.6028 10.6470 10.6470 10.7555 10.7555 10.9188 10.9188 11.8148 11.8148 11.8267 11.8267 k = 0.0000 0.0000 0.1159 ( 4499 PWs) bands (ev): -25.8514 -25.8514 -25.8461 -25.8461 -8.6997 -8.6997 -8.6462 -8.6462 -7.6457 -7.6457 -7.5307 -7.5307 -7.4795 -7.4795 -7.4663 -7.4663 -1.5632 -1.5632 -1.0415 -1.0415 5.1621 5.1621 5.2169 5.2169 5.2861 5.2861 5.2910 5.2910 5.4229 5.4229 5.9139 5.9139 6.2608 6.2608 6.2662 6.2662 6.3399 6.3399 6.4398 6.4398 6.5888 6.5888 7.4011 7.4011 9.0784 9.0784 9.1270 9.1270 9.5445 9.5445 9.5813 9.5813 10.7407 10.7407 10.7646 10.7646 10.9165 10.9165 11.8453 11.8453 11.8581 11.8581 k = 0.0000 0.0000 0.1287 ( 4499 PWs) bands (ev): -25.8512 -25.8512 -25.8463 -25.8463 -8.6973 -8.6973 -8.6481 -8.6481 -7.6416 -7.6416 -7.5358 -7.5358 -7.4790 -7.4790 -7.4669 -7.4669 -1.5436 -1.5436 -1.0637 -1.0637 5.1672 5.1672 5.2547 5.2547 5.2858 5.2858 5.2918 5.2918 5.4173 5.4173 5.9000 5.9000 6.2614 6.2614 6.2656 6.2656 6.3436 6.3436 6.4355 6.4355 6.5994 6.5994 7.3346 7.3346 9.0936 9.0936 9.1419 9.1419 9.5210 9.5210 9.5584 9.5584 10.7738 10.7738 10.8403 10.8403 10.9137 10.9137 11.8794 11.8794 11.8931 11.8931 k = 0.0000 0.0000 0.1416 ( 4499 PWs) bands (ev): -25.8509 -25.8509 -25.8465 -25.8465 -8.6949 -8.6949 -8.6502 -8.6502 -7.6372 -7.6372 -7.5412 -7.5412 -7.4784 -7.4784 -7.4674 -7.4674 -1.5224 -1.5224 -1.0874 -1.0874 5.1727 5.1727 5.2802 5.2802 5.2910 5.2910 5.3020 5.3020 5.4113 5.4113 5.8837 5.8837 6.2619 6.2619 6.2650 6.2650 6.3476 6.3476 6.4309 6.4309 6.6120 6.6120 7.2678 7.2678 9.1102 9.1102 9.1582 9.1582 9.4963 9.4963 9.5345 9.5345 10.7837 10.7837 10.9105 10.9105 10.9440 10.9440 11.9171 11.9171 11.9318 11.9318 k = 0.0000 0.0000 0.1545 ( 4510 PWs) bands (ev): -25.8507 -25.8507 -25.8468 -25.8468 -8.6922 -8.6922 -8.6525 -8.6525 -7.6324 -7.6324 -7.5470 -7.5470 -7.4778 -7.4778 -7.4680 -7.4680 -1.4997 -1.4997 -1.1125 -1.1125 5.1785 5.1785 5.2742 5.2742 5.3022 5.3022 5.3397 5.3397 5.4049 5.4049 5.8648 5.8648 6.2623 6.2623 6.2645 6.2645 6.3519 6.3519 6.4260 6.4260 6.6268 6.6268 7.2018 7.2018 9.1282 9.1282 9.1758 9.1758 9.4707 9.4707 9.5096 9.5096 10.7939 10.7939 10.9067 10.9067 11.0516 11.0516 11.9583 11.9583 11.9741 11.9741 k = 0.0000 0.0000 0.1673 ( 4510 PWs) bands (ev): -25.8504 -25.8504 -25.8470 -25.8470 -8.6895 -8.6895 -8.6549 -8.6549 -7.6273 -7.6273 -7.5529 -7.5529 -7.4772 -7.4772 -7.4687 -7.4687 -1.4756 -1.4756 -1.1389 -1.1389 5.1847 5.1847 5.2680 5.2680 5.3091 5.3091 5.3836 5.3836 5.3982 5.3982 5.8431 5.8431 6.2626 6.2626 6.2640 6.2640 6.3565 6.3565 6.4209 6.4209 6.6442 6.6442 7.1373 7.1373 9.1475 9.1475 9.1946 9.1946 9.4445 9.4445 9.4841 9.4841 10.8043 10.8043 10.9023 10.9023 11.1622 11.1622 12.0030 12.0030 12.0199 12.0199 k = 0.0000 0.0000 0.1802 ( 4522 PWs) bands (ev): -25.8502 -25.8502 -25.8473 -25.8473 -8.6866 -8.6866 -8.6574 -8.6574 -7.6219 -7.6219 -7.5591 -7.5591 -7.4765 -7.4765 -7.4693 -7.4693 -1.4502 -1.4502 -1.1662 -1.1662 5.1911 5.1911 5.2614 5.2614 5.3161 5.3161 5.3912 5.3912 5.4287 5.4287 5.8184 5.8184 6.2629 6.2629 6.2636 6.2636 6.3612 6.3612 6.4156 6.4156 6.6643 6.6643 7.0751 7.0751 9.1679 9.1679 9.2146 9.2146 9.4179 9.4179 9.4582 9.4582 10.8147 10.8147 10.8974 10.8974 11.2752 11.2752 12.0511 12.0511 12.0693 12.0693 k = 0.0000 0.0000 0.1931 ( 4540 PWs) bands (ev): -25.8499 -25.8499 -25.8476 -25.8476 -8.6837 -8.6837 -8.6601 -8.6601 -7.6162 -7.6162 -7.5655 -7.5655 -7.4758 -7.4758 -7.4700 -7.4700 -1.4238 -1.4238 -1.1943 -1.1943 5.1977 5.1977 5.2546 5.2546 5.3232 5.3232 5.3839 5.3839 5.4743 5.4743 5.7907 5.7907 6.2629 6.2629 6.2633 6.2633 6.3662 6.3662 6.4101 6.4101 6.6877 6.6877 7.0160 7.0160 9.1895 9.1895 9.2357 9.2357 9.3910 9.3910 9.4321 9.4321 10.8250 10.8250 10.8918 10.8918 11.3902 11.3902 12.1024 12.1024 12.1221 12.1221 k = 0.0000 0.0000 0.2060 ( 4540 PWs) bands (ev): -25.8496 -25.8496 -25.8479 -25.8479 -8.6807 -8.6807 -8.6629 -8.6629 -7.6103 -7.6103 -7.5720 -7.5720 -7.4751 -7.4751 -7.4707 -7.4707 -1.3965 -1.3965 -1.2231 -1.2231 5.2046 5.2046 5.2476 5.2476 5.3306 5.3306 5.3765 5.3765 5.5198 5.5198 5.7599 5.7599 6.2630 6.2630 6.2632 6.2632 6.3714 6.3714 6.4045 6.4045 6.7144 6.7144 6.9604 6.9604 9.2122 9.2122 9.2578 9.2578 9.3642 9.3642 9.4060 9.4060 10.8351 10.8351 10.8855 10.8855 11.5065 11.5065 12.1545 12.1545 12.1784 12.1784 k = 0.0000 0.0000 0.2188 ( 4540 PWs) bands (ev): -25.8493 -25.8493 -25.8482 -25.8482 -8.6777 -8.6777 -8.6657 -8.6657 -7.6042 -7.6042 -7.5785 -7.5785 -7.4744 -7.4744 -7.4714 -7.4714 -1.3684 -1.3684 -1.2522 -1.2522 5.2117 5.2117 5.2405 5.2405 5.3381 5.3381 5.3689 5.3689 5.5646 5.5646 5.7260 5.7260 6.2631 6.2631 6.2631 6.2631 6.3768 6.3768 6.3989 6.3989 6.7450 6.7450 6.9088 6.9088 9.2358 9.2358 9.2808 9.2808 9.3376 9.3376 9.3800 9.3800 10.8448 10.8448 10.8786 10.8786 11.6239 11.6239 12.0940 12.0940 12.2190 12.2190 k = 0.0000 0.0000 0.2317 ( 4540 PWs) bands (ev): -25.8490 -25.8490 -25.8485 -25.8485 -8.6747 -8.6747 -8.6687 -8.6687 -7.5979 -7.5979 -7.5850 -7.5850 -7.4737 -7.4737 -7.4722 -7.4722 -1.3398 -1.3398 -1.2814 -1.2814 5.2189 5.2189 5.2333 5.2333 5.3458 5.3458 5.3612 5.3612 5.6081 5.6081 5.6893 5.6893 6.2630 6.2630 6.2631 6.2631 6.3823 6.3823 6.3933 6.3933 6.7795 6.7795 6.8614 6.8614 9.2602 9.2602 9.3047 9.3047 9.3112 9.3112 9.3544 9.3544 10.8541 10.8541 10.8710 10.8710 11.7418 11.7418 11.9776 11.9776 12.2797 12.2797 k = 0.0000 0.0000 0.2446 ( 4522 PWs) bands (ev): -25.8487 -25.8487 -25.8487 -25.8487 -8.6716 -8.6716 -8.6716 -8.6716 -7.5915 -7.5915 -7.5915 -7.5915 -7.4729 -7.4729 -7.4729 -7.4729 -1.3107 -1.3107 -1.3107 -1.3107 5.2261 5.2261 5.2261 5.2261 5.3535 5.3535 5.3535 5.3535 5.6498 5.6498 5.6498 5.6498 6.2632 6.2632 6.2632 6.2632 6.3879 6.3879 6.3879 6.3879 6.8183 6.8183 6.8183 6.8183 9.2854 9.2854 9.2854 9.2854 9.3292 9.3292 9.3292 9.3292 10.8628 10.8628 10.8628 10.8628 11.8599 11.8599 11.8599 11.8599 12.3444 12.3444 k = 0.0000 0.0000 0.2446 ( 4522 PWs) bands (ev): -25.8487 -25.8487 -25.8487 -25.8487 -8.6716 -8.6716 -8.6716 -8.6716 -7.5915 -7.5915 -7.5915 -7.5915 -7.4729 -7.4729 -7.4729 -7.4729 -1.3107 -1.3107 -1.3107 -1.3107 5.2261 5.2261 5.2261 5.2261 5.3535 5.3535 5.3535 5.3535 5.6498 5.6498 5.6498 5.6498 6.2632 6.2632 6.2632 6.2632 6.3879 6.3879 6.3879 6.3879 6.8183 6.8183 6.8183 6.8183 9.2854 9.2854 9.2854 9.2854 9.3292 9.3292 9.3292 9.3292 10.8628 10.8628 10.8628 10.8628 11.8599 11.8599 11.8599 11.8599 12.3444 12.3444 k = 0.0114 0.0066 0.2446 ( 4532 PWs) bands (ev): -25.8487 -25.8487 -25.8487 -25.8487 -8.6717 -8.6717 -8.6717 -8.6717 -7.5915 -7.5915 -7.5915 -7.5915 -7.4732 -7.4732 -7.4732 -7.4732 -1.3099 -1.3099 -1.3099 -1.3099 5.2257 5.2257 5.2257 5.2257 5.3530 5.3530 5.3530 5.3530 5.6505 5.6505 5.6505 5.6505 6.2631 6.2631 6.2631 6.2631 6.3879 6.3879 6.3879 6.3879 6.8193 6.8193 6.8193 6.8193 9.2774 9.2774 9.2774 9.2774 9.3224 9.3224 9.3224 9.3224 10.8737 10.8737 10.8737 10.8737 11.8554 11.8554 11.8554 11.8554 12.3459 12.3459 k = 0.0227 0.0131 0.2446 ( 4536 PWs) bands (ev): -25.8487 -25.8487 -25.8487 -25.8487 -8.6720 -8.6720 -8.6720 -8.6720 -7.5916 -7.5916 -7.5916 -7.5916 -7.4738 -7.4738 -7.4738 -7.4738 -1.3075 -1.3075 -1.3075 -1.3075 5.2245 5.2245 5.2245 5.2245 5.3515 5.3515 5.3515 5.3515 5.6526 5.6526 5.6526 5.6526 6.2631 6.2631 6.2631 6.2631 6.3883 6.3883 6.3883 6.3883 6.8222 6.8222 6.8222 6.8222 9.2495 9.2495 9.2495 9.2495 9.3068 9.3068 9.3068 9.3068 10.9052 10.9052 10.9052 10.9052 11.8424 11.8424 11.8424 11.8424 12.3498 12.3498 k = 0.0341 0.0197 0.2446 ( 4536 PWs) bands (ev): -25.8486 -25.8486 -25.8486 -25.8486 -8.6723 -8.6723 -8.6723 -8.6723 -7.5917 -7.5917 -7.5917 -7.5917 -7.4750 -7.4750 -7.4750 -7.4750 -1.3035 -1.3035 -1.3035 -1.3035 5.2221 5.2221 5.2221 5.2221 5.3493 5.3493 5.3493 5.3493 5.6560 5.6560 5.6560 5.6560 6.2632 6.2632 6.2632 6.2632 6.3889 6.3889 6.3889 6.3889 6.8271 6.8271 6.8271 6.8271 9.1988 9.1988 9.1988 9.1988 9.2884 9.2884 9.2884 9.2884 10.9538 10.9538 10.9538 10.9538 11.8229 11.8229 11.8229 11.8229 12.3545 12.3545 k = 0.0455 0.0262 0.2446 ( 4524 PWs) bands (ev): -25.8484 -25.8484 -25.8484 -25.8484 -8.6729 -8.6729 -8.6729 -8.6729 -7.5919 -7.5919 -7.5919 -7.5919 -7.4766 -7.4766 -7.4766 -7.4766 -1.2979 -1.2979 -1.2979 -1.2979 5.2184 5.2184 5.2184 5.2184 5.3470 5.3470 5.3470 5.3470 5.6605 5.6605 5.6605 5.6605 6.2633 6.2633 6.2633 6.2633 6.3899 6.3899 6.3899 6.3899 6.8339 6.8339 6.8339 6.8339 9.1295 9.1295 9.1295 9.1295 9.2669 9.2669 9.2669 9.2669 11.0151 11.0151 11.0151 11.0151 11.7990 11.7990 11.7990 11.7990 12.3559 12.3559 k = 0.0568 0.0328 0.2446 ( 4526 PWs) bands (ev): -25.8482 -25.8482 -25.8482 -25.8482 -8.6736 -8.6736 -8.6736 -8.6736 -7.5921 -7.5921 -7.5921 -7.5921 -7.4786 -7.4786 -7.4786 -7.4786 -1.2908 -1.2908 -1.2908 -1.2908 5.2127 5.2127 5.2127 5.2127 5.3452 5.3452 5.3452 5.3452 5.6660 5.6660 5.6660 5.6660 6.2635 6.2635 6.2635 6.2635 6.3910 6.3910 6.3910 6.3910 6.8426 6.8426 6.8426 6.8426 9.0466 9.0466 9.0466 9.0466 9.2414 9.2414 9.2414 9.2414 11.0838 11.0838 11.0838 11.0838 11.7737 11.7737 11.7737 11.7737 12.3504 12.3504 k = 0.0682 0.0394 0.2446 ( 4524 PWs) bands (ev): -25.8480 -25.8480 -25.8480 -25.8480 -8.6744 -8.6744 -8.6744 -8.6744 -7.5924 -7.5924 -7.5924 -7.5924 -7.4810 -7.4810 -7.4810 -7.4810 -1.2821 -1.2821 -1.2821 -1.2821 5.2048 5.2048 5.2048 5.2048 5.3444 5.3444 5.3444 5.3444 5.6722 5.6722 5.6722 5.6722 6.2636 6.2636 6.2636 6.2636 6.3923 6.3923 6.3923 6.3923 6.8532 6.8532 6.8532 6.8532 8.9539 8.9539 8.9539 8.9539 9.2116 9.2116 9.2116 9.2116 11.1538 11.1538 11.1538 11.1538 11.7505 11.7505 11.7505 11.7505 12.3371 12.3371 k = 0.0795 0.0459 0.2446 ( 4522 PWs) bands (ev): -25.8477 -25.8477 -25.8477 -25.8477 -8.6755 -8.6755 -8.6755 -8.6755 -7.5928 -7.5928 -7.5928 -7.5928 -7.4838 -7.4838 -7.4838 -7.4838 -1.2720 -1.2720 -1.2720 -1.2720 5.1943 5.1943 5.1943 5.1943 5.3451 5.3451 5.3451 5.3451 5.6789 5.6789 5.6789 5.6789 6.2638 6.2638 6.2638 6.2638 6.3938 6.3938 6.3938 6.3938 6.8658 6.8658 6.8658 6.8658 8.8544 8.8544 8.8544 8.8544 9.1774 9.1774 9.1774 9.1774 11.2180 11.2180 11.2180 11.2180 11.7342 11.7342 11.7342 11.7342 12.3172 12.3172 k = 0.0909 0.0525 0.2446 ( 4518 PWs) bands (ev): -25.8474 -25.8474 -25.8474 -25.8474 -8.6766 -8.6766 -8.6766 -8.6766 -7.5932 -7.5932 -7.5932 -7.5932 -7.4869 -7.4869 -7.4869 -7.4869 -1.2603 -1.2603 -1.2603 -1.2603 5.1812 5.1812 5.1812 5.1812 5.3476 5.3476 5.3476 5.3476 5.6859 5.6859 5.6859 5.6859 6.2640 6.2640 6.2640 6.2640 6.3955 6.3955 6.3955 6.3955 6.8802 6.8802 6.8802 6.8802 8.7503 8.7503 8.7503 8.7503 9.1393 9.1393 9.1393 9.1393 11.2675 11.2675 11.2675 11.2675 11.7311 11.7311 11.7311 11.7311 12.2932 12.2932 k = 0.1023 0.0590 0.2446 ( 4518 PWs) bands (ev): -25.8471 -25.8471 -25.8471 -25.8471 -8.6779 -8.6779 -8.6779 -8.6779 -7.5937 -7.5937 -7.5937 -7.5937 -7.4904 -7.4904 -7.4904 -7.4904 -1.2473 -1.2473 -1.2473 -1.2473 5.1655 5.1655 5.1655 5.1655 5.3519 5.3519 5.3519 5.3519 5.6932 5.6932 5.6932 5.6932 6.2643 6.2643 6.2643 6.2643 6.3973 6.3973 6.3973 6.3973 6.8965 6.8965 6.8965 6.8965 8.6432 8.6432 8.6432 8.6432 9.0976 9.0976 9.0976 9.0976 11.2938 11.2938 11.2938 11.2938 11.7466 11.7466 11.7466 11.7466 12.2687 12.2687 k = 0.1136 0.0656 0.2446 ( 4510 PWs) bands (ev): -25.8467 -25.8467 -25.8467 -25.8467 -8.6794 -8.6794 -8.6794 -8.6794 -7.5944 -7.5944 -7.5944 -7.5944 -7.4941 -7.4941 -7.4941 -7.4941 -1.2328 -1.2328 -1.2328 -1.2328 5.1475 5.1475 5.1475 5.1475 5.3579 5.3579 5.3579 5.3579 5.7004 5.7004 5.7004 5.7004 6.2646 6.2646 6.2646 6.2646 6.3992 6.3992 6.3992 6.3992 6.9146 6.9146 6.9146 6.9146 8.5346 8.5346 8.5346 8.5346 9.0525 9.0525 9.0525 9.0525 11.2940 11.2940 11.2940 11.2940 11.7796 11.7796 11.7796 11.7796 12.2492 12.2492 k = 0.1250 0.0722 0.2446 ( 4504 PWs) bands (ev): -25.8463 -25.8463 -25.8463 -25.8463 -8.6810 -8.6810 -8.6810 -8.6810 -7.5951 -7.5951 -7.5951 -7.5951 -7.4980 -7.4980 -7.4980 -7.4980 -1.2170 -1.2170 -1.2170 -1.2170 5.1273 5.1273 5.1273 5.1273 5.3656 5.3656 5.3656 5.3656 5.7076 5.7076 5.7076 5.7076 6.2649 6.2649 6.2649 6.2649 6.4013 6.4013 6.4013 6.4013 6.9344 6.9344 6.9344 6.9344 8.4254 8.4254 8.4254 8.4254 9.0045 9.0045 9.0045 9.0045 11.2722 11.2722 11.2722 11.2722 11.8197 11.8197 11.8197 11.8197 12.2418 12.2418 k = 0.1364 0.0787 0.2446 ( 4504 PWs) bands (ev): -25.8459 -25.8459 -25.8459 -25.8459 -8.6827 -8.6827 -8.6827 -8.6827 -7.5961 -7.5961 -7.5961 -7.5961 -7.5021 -7.5021 -7.5021 -7.5021 -1.2000 -1.2000 -1.2000 -1.2000 5.1052 5.1052 5.1052 5.1052 5.3748 5.3748 5.3748 5.3748 5.7145 5.7145 5.7145 5.7145 6.2652 6.2652 6.2652 6.2652 6.4034 6.4034 6.4034 6.4034 6.9558 6.9558 6.9558 6.9558 8.3165 8.3165 8.3165 8.3165 8.9539 8.9539 8.9539 8.9539 11.2351 11.2351 11.2351 11.2351 11.8528 11.8528 11.8528 11.8528 12.2551 12.2551 k = 0.1477 0.0853 0.2446 ( 4504 PWs) bands (ev): -25.8455 -25.8455 -25.8455 -25.8455 -8.6845 -8.6845 -8.6845 -8.6845 -7.5971 -7.5971 -7.5971 -7.5971 -7.5062 -7.5062 -7.5062 -7.5062 -1.1818 -1.1818 -1.1818 -1.1818 5.0812 5.0812 5.0812 5.0812 5.3853 5.3853 5.3853 5.3853 5.7211 5.7211 5.7211 5.7211 6.2655 6.2655 6.2655 6.2655 6.4055 6.4055 6.4055 6.4055 6.9787 6.9787 6.9787 6.9787 8.2089 8.2089 8.2089 8.2089 8.9011 8.9011 8.9011 8.9011 11.1878 11.1878 11.1878 11.1878 11.8694 11.8694 11.8694 11.8694 12.2944 12.2944 k = 0.1591 0.0919 0.2446 ( 4504 PWs) bands (ev): -25.8450 -25.8450 -25.8450 -25.8450 -8.6865 -8.6865 -8.6865 -8.6865 -7.5984 -7.5984 -7.5984 -7.5984 -7.5105 -7.5105 -7.5105 -7.5105 -1.1624 -1.1624 -1.1624 -1.1624 5.0558 5.0558 5.0558 5.0558 5.3971 5.3971 5.3971 5.3971 5.7272 5.7272 5.7272 5.7272 6.2658 6.2658 6.2658 6.2658 6.4077 6.4077 6.4077 6.4077 7.0030 7.0030 7.0030 7.0030 8.1030 8.1030 8.1030 8.1030 8.8464 8.8464 8.8464 8.8464 11.1334 11.1334 11.1334 11.1334 11.8695 11.8695 11.8695 11.8695 12.3572 12.3572 k = 0.1705 0.0984 0.2446 ( 4508 PWs) bands (ev): -25.8445 -25.8445 -25.8445 -25.8445 -8.6886 -8.6886 -8.6886 -8.6886 -7.5999 -7.5999 -7.5999 -7.5999 -7.5147 -7.5147 -7.5147 -7.5147 -1.1419 -1.1419 -1.1419 -1.1419 5.0290 5.0290 5.0290 5.0290 5.4099 5.4099 5.4099 5.4099 5.7330 5.7330 5.7330 5.7330 6.2660 6.2660 6.2660 6.2660 6.4098 6.4098 6.4098 6.4098 7.0282 7.0282 7.0282 7.0282 7.9998 7.9998 7.9998 7.9998 8.7902 8.7902 8.7902 8.7902 11.0743 11.0743 11.0743 11.0743 11.8586 11.8586 11.8586 11.8586 12.4363 12.4363 k = 0.1818 0.1050 0.2446 ( 4516 PWs) bands (ev): -25.8440 -25.8440 -25.8440 -25.8440 -8.6909 -8.6909 -8.6909 -8.6909 -7.6017 -7.6017 -7.6017 -7.6017 -7.5188 -7.5188 -7.5188 -7.5188 -1.1205 -1.1205 -1.1205 -1.1205 5.0009 5.0009 5.0009 5.0009 5.4238 5.4238 5.4238 5.4238 5.7381 5.7381 5.7381 5.7381 6.2662 6.2662 6.2662 6.2662 6.4119 6.4119 6.4119 6.4119 7.0541 7.0541 7.0541 7.0541 7.8999 7.8999 7.8999 7.8999 8.7327 8.7327 8.7327 8.7327 11.0118 11.0118 11.0118 11.0118 11.8422 11.8422 11.8422 11.8422 12.5251 12.5251 k = 0.1932 0.1115 0.2446 ( 4502 PWs) bands (ev): -25.8434 -25.8434 -25.8434 -25.8434 -8.6932 -8.6932 -8.6932 -8.6932 -7.6037 -7.6037 -7.6037 -7.6037 -7.5227 -7.5227 -7.5227 -7.5227 -1.0981 -1.0981 -1.0981 -1.0981 4.9716 4.9716 4.9716 4.9716 5.4387 5.4387 5.4387 5.4387 5.7428 5.7428 5.7428 5.7428 6.2665 6.2665 6.2665 6.2665 6.4140 6.4140 6.4140 6.4140 7.0799 7.0799 7.0799 7.0799 7.8044 7.8044 7.8044 7.8044 8.6743 8.6743 8.6743 8.6743 10.9471 10.9471 10.9471 10.9471 11.8236 11.8236 11.8236 11.8236 12.6194 12.6194 k = 0.2045 0.1181 0.2446 ( 4506 PWs) bands (ev): -25.8429 -25.8429 -25.8429 -25.8429 -8.6956 -8.6956 -8.6956 -8.6956 -7.6061 -7.6061 -7.6061 -7.6061 -7.5265 -7.5265 -7.5265 -7.5265 -1.0750 -1.0750 -1.0750 -1.0750 4.9412 4.9412 4.9412 4.9412 5.4545 5.4545 5.4545 5.4545 5.7468 5.7468 5.7468 5.7468 6.2667 6.2667 6.2667 6.2667 6.4160 6.4160 6.4160 6.4160 7.1045 7.1045 7.1045 7.1045 7.7145 7.7145 7.7145 7.7145 8.6152 8.6152 8.6152 8.6152 10.8811 10.8811 10.8811 10.8811 11.8047 11.8047 11.8047 11.8047 12.7167 12.7167 k = 0.2159 0.1247 0.2446 ( 4508 PWs) bands (ev): -25.8423 -25.8423 -25.8423 -25.8423 -8.6981 -8.6981 -8.6981 -8.6981 -7.6087 -7.6087 -7.6087 -7.6087 -7.5299 -7.5299 -7.5299 -7.5299 -1.0511 -1.0511 -1.0511 -1.0511 4.9098 4.9098 4.9098 4.9098 5.4710 5.4710 5.4710 5.4710 5.7502 5.7502 5.7502 5.7502 6.2668 6.2668 6.2668 6.2668 6.4179 6.4179 6.4179 6.4179 7.1259 7.1259 7.1259 7.1259 7.6323 7.6323 7.6323 7.6323 8.5557 8.5557 8.5557 8.5557 10.8146 10.8146 10.8146 10.8146 11.7861 11.7861 11.7861 11.7861 12.8153 12.8153 k = 0.2273 0.1312 0.2446 ( 4504 PWs) bands (ev): -25.8417 -25.8417 -25.8417 -25.8417 -8.7007 -8.7007 -8.7007 -8.7007 -7.6117 -7.6117 -7.6117 -7.6117 -7.5331 -7.5331 -7.5331 -7.5331 -1.0266 -1.0266 -1.0266 -1.0266 4.8776 4.8776 4.8776 4.8776 5.4884 5.4884 5.4884 5.4884 5.7530 5.7530 5.7530 5.7530 6.2669 6.2669 6.2669 6.2669 6.4197 6.4197 6.4197 6.4197 7.1409 7.1409 7.1409 7.1409 7.5614 7.5614 7.5614 7.5614 8.4960 8.4960 8.4960 8.4960 10.7482 10.7482 10.7482 10.7482 11.7684 11.7684 11.7684 11.7684 12.9142 12.9142 k = 0.2386 0.1378 0.2446 ( 4496 PWs) bands (ev): -25.8411 -25.8411 -25.8411 -25.8411 -8.7033 -8.7033 -8.7033 -8.7033 -7.6151 -7.6151 -7.6151 -7.6151 -7.5359 -7.5359 -7.5359 -7.5359 -1.0016 -1.0016 -1.0016 -1.0016 4.8445 4.8445 4.8445 4.8445 5.5064 5.5064 5.5064 5.5064 5.7552 5.7552 5.7552 5.7552 6.2670 6.2670 6.2670 6.2670 6.4214 6.4214 6.4214 6.4214 7.1440 7.1440 7.1440 7.1440 7.5072 7.5072 7.5072 7.5072 8.4364 8.4364 8.4364 8.4364 10.6824 10.6824 10.6824 10.6824 11.7514 11.7514 11.7514 11.7514 13.0121 13.0121 k = 0.2500 0.1443 0.2446 ( 4496 PWs) bands (ev): -25.8405 -25.8405 -25.8405 -25.8405 -8.7060 -8.7060 -8.7060 -8.7060 -7.6187 -7.6187 -7.6187 -7.6187 -7.5384 -7.5384 -7.5384 -7.5384 -0.9762 -0.9762 -0.9762 -0.9762 4.8108 4.8108 4.8108 4.8108 5.5251 5.5251 5.5251 5.5251 5.7569 5.7569 5.7569 5.7569 6.2669 6.2669 6.2669 6.2669 6.4229 6.4229 6.4229 6.4229 7.1295 7.1295 7.1295 7.1295 7.4755 7.4755 7.4755 7.4755 8.3770 8.3770 8.3770 8.3770 10.6177 10.6177 10.6177 10.6177 11.7353 11.7353 11.7353 11.7353 13.1038 13.1038 k = 0.2614 0.1509 0.2446 ( 4500 PWs) bands (ev): -25.8400 -25.8400 -25.8400 -25.8400 -8.7088 -8.7088 -8.7088 -8.7088 -7.6226 -7.6226 -7.6226 -7.6226 -7.5405 -7.5405 -7.5405 -7.5405 -0.9505 -0.9505 -0.9505 -0.9505 4.7765 4.7765 4.7765 4.7765 5.5442 5.5442 5.5442 5.5442 5.7580 5.7580 5.7580 5.7580 6.2668 6.2668 6.2668 6.2668 6.4242 6.4242 6.4242 6.4242 7.0958 7.0958 7.0958 7.0958 7.4678 7.4678 7.4678 7.4678 8.3181 8.3181 8.3181 8.3181 10.5545 10.5545 10.5545 10.5545 11.7196 11.7196 11.7196 11.7196 13.1766 13.1766 k = 0.2727 0.1575 0.2446 ( 4492 PWs) bands (ev): -25.8394 -25.8394 -25.8394 -25.8394 -8.7115 -8.7115 -8.7115 -8.7115 -7.6267 -7.6267 -7.6267 -7.6267 -7.5423 -7.5423 -7.5423 -7.5423 -0.9247 -0.9247 -0.9247 -0.9247 4.7417 4.7417 4.7417 4.7417 5.5638 5.5638 5.5638 5.5638 5.7586 5.7586 5.7586 5.7586 6.2667 6.2667 6.2667 6.2667 6.4255 6.4255 6.4255 6.4255 7.0482 7.0482 7.0482 7.0482 7.4789 7.4789 7.4789 7.4789 8.2599 8.2599 8.2599 8.2599 10.4930 10.4930 10.4930 10.4930 11.7044 11.7044 11.7044 11.7044 13.2462 13.2462 k = 0.2841 0.1640 0.2446 ( 4496 PWs) bands (ev): -25.8388 -25.8388 -25.8388 -25.8388 -8.7143 -8.7143 -8.7143 -8.7143 -7.6310 -7.6310 -7.6310 -7.6310 -7.5439 -7.5439 -7.5439 -7.5439 -0.8987 -0.8987 -0.8987 -0.8987 4.7065 4.7065 4.7065 4.7065 5.5836 5.5836 5.5836 5.5836 5.7587 5.7587 5.7587 5.7587 6.2665 6.2665 6.2665 6.2665 6.4265 6.4265 6.4265 6.4265 6.9934 6.9934 6.9934 6.9934 7.5017 7.5017 7.5017 7.5017 8.2026 8.2026 8.2026 8.2026 10.4336 10.4336 10.4336 10.4336 11.6892 11.6892 11.6892 11.6892 13.3170 13.3170 k = 0.2955 0.1706 0.2446 ( 4500 PWs) bands (ev): -25.8382 -25.8382 -25.8382 -25.8382 -8.7170 -8.7170 -8.7170 -8.7170 -7.6354 -7.6354 -7.6354 -7.6354 -7.5451 -7.5451 -7.5451 -7.5451 -0.8729 -0.8729 -0.8729 -0.8729 4.6712 4.6712 4.6712 4.6712 5.6037 5.6037 5.6037 5.6037 5.7586 5.7586 5.7586 5.7586 6.2662 6.2662 6.2662 6.2662 6.4274 6.4274 6.4274 6.4274 6.9363 6.9363 6.9363 6.9363 7.5316 7.5316 7.5316 7.5316 8.1464 8.1464 8.1464 8.1464 10.3765 10.3765 10.3765 10.3765 11.6741 11.6741 11.6741 11.6741 13.3891 13.3891 k = 0.3068 0.1771 0.2446 ( 4506 PWs) bands (ev): -25.8377 -25.8377 -25.8377 -25.8377 -8.7198 -8.7198 -8.7198 -8.7198 -7.6399 -7.6399 -7.6399 -7.6399 -7.5461 -7.5461 -7.5461 -7.5461 -0.8473 -0.8473 -0.8473 -0.8473 4.6359 4.6359 4.6359 4.6359 5.6237 5.6237 5.6237 5.6237 5.7582 5.7582 5.7582 5.7582 6.2658 6.2658 6.2658 6.2658 6.4280 6.4280 6.4280 6.4280 6.8796 6.8796 6.8796 6.8796 7.5653 7.5653 7.5653 7.5653 8.0914 8.0914 8.0914 8.0914 10.3218 10.3218 10.3218 10.3218 11.6587 11.6587 11.6587 11.6587 13.4624 13.4624 k = 0.3182 0.1837 0.2446 ( 4502 PWs) bands (ev): -25.8371 -25.8371 -25.8371 -25.8371 -8.7225 -8.7225 -8.7225 -8.7225 -7.6443 -7.6443 -7.6443 -7.6443 -7.5469 -7.5469 -7.5469 -7.5469 -0.8221 -0.8221 -0.8221 -0.8221 4.6008 4.6008 4.6008 4.6008 5.6435 5.6435 5.6435 5.6435 5.7578 5.7578 5.7578 5.7578 6.2654 6.2654 6.2654 6.2654 6.4286 6.4286 6.4286 6.4286 6.8248 6.8248 6.8248 6.8248 7.6014 7.6014 7.6014 7.6014 8.0378 8.0378 8.0378 8.0378 10.2698 10.2698 10.2698 10.2698 11.6431 11.6431 11.6431 11.6431 13.5366 13.5366 k = 0.3295 0.1903 0.2446 ( 4496 PWs) bands (ev): -25.8366 -25.8366 -25.8366 -25.8366 -8.7251 -8.7251 -8.7251 -8.7251 -7.6487 -7.6487 -7.6487 -7.6487 -7.5475 -7.5475 -7.5475 -7.5475 -0.7974 -0.7974 -0.7974 -0.7974 4.5662 4.5662 4.5662 4.5662 5.6628 5.6628 5.6628 5.6628 5.7577 5.7577 5.7577 5.7577 6.2650 6.2650 6.2650 6.2650 6.4289 6.4289 6.4289 6.4289 6.7729 6.7729 6.7729 6.7729 7.6385 7.6385 7.6385 7.6385 7.9860 7.9860 7.9860 7.9860 10.2205 10.2205 10.2205 10.2205 11.6270 11.6270 11.6270 11.6270 13.6115 13.6115 k = 0.3409 0.1968 0.2446 ( 4484 PWs) bands (ev): -25.8361 -25.8361 -25.8361 -25.8361 -8.7276 -8.7276 -8.7276 -8.7276 -7.6530 -7.6530 -7.6530 -7.6530 -7.5479 -7.5479 -7.5479 -7.5479 -0.7733 -0.7733 -0.7733 -0.7733 4.5321 4.5321 4.5321 4.5321 5.6809 5.6809 5.6809 5.6809 5.7583 5.7583 5.7583 5.7583 6.2645 6.2645 6.2645 6.2645 6.4291 6.4291 6.4291 6.4291 6.7242 6.7242 6.7242 6.7242 7.6760 7.6760 7.6760 7.6760 7.9360 7.9360 7.9360 7.9360 10.1741 10.1741 10.1741 10.1741 11.6106 11.6106 11.6106 11.6106 13.6868 13.6868 k = 0.3523 0.2034 0.2446 ( 4480 PWs) bands (ev): -25.8356 -25.8356 -25.8356 -25.8356 -8.7301 -8.7301 -8.7301 -8.7301 -7.6572 -7.6572 -7.6572 -7.6572 -7.5483 -7.5483 -7.5483 -7.5483 -0.7500 -0.7500 -0.7500 -0.7500 4.4988 4.4988 4.4988 4.4988 5.6971 5.6971 5.6971 5.6971 5.7604 5.7604 5.7604 5.7604 6.2640 6.2640 6.2640 6.2640 6.4289 6.4289 6.4289 6.4289 6.6792 6.6792 6.6792 6.6792 7.7131 7.7131 7.7131 7.7131 7.8882 7.8882 7.8882 7.8882 10.1306 10.1306 10.1306 10.1306 11.5939 11.5939 11.5939 11.5939 13.7620 13.7620 k = 0.3636 0.2099 0.2446 ( 4476 PWs) bands (ev): -25.8352 -25.8352 -25.8352 -25.8352 -8.7325 -8.7325 -8.7325 -8.7325 -7.6612 -7.6612 -7.6612 -7.6612 -7.5485 -7.5485 -7.5485 -7.5485 -0.7277 -0.7277 -0.7277 -0.7277 4.4667 4.4667 4.4667 4.4667 5.7098 5.7098 5.7098 5.7098 5.7654 5.7654 5.7654 5.7654 6.2634 6.2634 6.2634 6.2634 6.4285 6.4285 6.4285 6.4285 6.6380 6.6380 6.6380 6.6380 7.7491 7.7491 7.7491 7.7491 7.8430 7.8430 7.8430 7.8430 10.0901 10.0901 10.0901 10.0901 11.5769 11.5769 11.5769 11.5769 13.8368 13.8368 k = 0.3750 0.2165 0.2446 ( 4460 PWs) bands (ev): -25.8347 -25.8347 -25.8347 -25.8347 -8.7347 -8.7347 -8.7347 -8.7347 -7.6650 -7.6650 -7.6650 -7.6650 -7.5487 -7.5487 -7.5487 -7.5487 -0.7064 -0.7064 -0.7064 -0.7064 4.4359 4.4359 4.4359 4.4359 5.7180 5.7180 5.7180 5.7180 5.7743 5.7743 5.7743 5.7743 6.2627 6.2627 6.2627 6.2627 6.4278 6.4278 6.4278 6.4278 6.6007 6.6007 6.6007 6.6007 7.7786 7.7786 7.7786 7.7786 7.8056 7.8056 7.8056 7.8056 10.0528 10.0528 10.0528 10.0528 11.5598 11.5598 11.5598 11.5598 13.9108 13.9108 k = 0.3864 0.2231 0.2446 ( 4470 PWs) bands (ev): -25.8343 -25.8343 -25.8343 -25.8343 -8.7368 -8.7368 -8.7368 -8.7368 -7.6685 -7.6685 -7.6685 -7.6685 -7.5487 -7.5487 -7.5487 -7.5487 -0.6864 -0.6864 -0.6864 -0.6864 4.4067 4.4067 4.4067 4.4067 5.7220 5.7220 5.7220 5.7220 5.7865 5.7865 5.7865 5.7865 6.2620 6.2620 6.2620 6.2620 6.4266 6.4266 6.4266 6.4266 6.5675 6.5675 6.5675 6.5675 7.7550 7.7550 7.7550 7.7550 7.8224 7.8224 7.8224 7.8224 10.0186 10.0186 10.0186 10.0186 11.5429 11.5429 11.5429 11.5429 13.9833 13.9833 k = 0.3977 0.2296 0.2446 ( 4466 PWs) bands (ev): -25.8340 -25.8340 -25.8340 -25.8340 -8.7388 -8.7388 -8.7388 -8.7388 -7.6718 -7.6718 -7.6718 -7.6718 -7.5488 -7.5488 -7.5488 -7.5488 -0.6679 -0.6679 -0.6679 -0.6679 4.3794 4.3794 4.3794 4.3794 5.7235 5.7235 5.7235 5.7235 5.8003 5.8003 5.8003 5.8003 6.2613 6.2613 6.2613 6.2613 6.4247 6.4247 6.4247 6.4247 6.5386 6.5386 6.5386 6.5386 7.7183 7.7183 7.7183 7.7183 7.8532 7.8532 7.8532 7.8532 9.9875 9.9875 9.9875 9.9875 11.5263 11.5263 11.5263 11.5263 14.0538 14.0538 k = 0.4091 0.2362 0.2446 ( 4468 PWs) bands (ev): -25.8336 -25.8336 -25.8336 -25.8336 -8.7405 -8.7405 -8.7405 -8.7405 -7.6748 -7.6748 -7.6748 -7.6748 -7.5488 -7.5488 -7.5488 -7.5488 -0.6508 -0.6508 -0.6508 -0.6508 4.3542 4.3542 4.3542 4.3542 5.7235 5.7235 5.7235 5.7235 5.8145 5.8145 5.8145 5.8145 6.2605 6.2605 6.2605 6.2605 6.4220 6.4220 6.4220 6.4220 6.5141 6.5141 6.5141 6.5141 7.6839 7.6839 7.6839 7.6839 7.8826 7.8826 7.8826 7.8826 9.9597 9.9597 9.9597 9.9597 11.5104 11.5104 11.5104 11.5104 14.1217 14.1217 k = 0.4205 0.2427 0.2446 ( 4464 PWs) bands (ev): -25.8333 -25.8333 -25.8333 -25.8333 -8.7421 -8.7421 -8.7421 -8.7421 -7.6775 -7.6775 -7.6775 -7.6775 -7.5488 -7.5488 -7.5488 -7.5488 -0.6354 -0.6354 -0.6354 -0.6354 4.3313 4.3313 4.3313 4.3313 5.7229 5.7229 5.7229 5.7229 5.8282 5.8282 5.8282 5.8282 6.2598 6.2598 6.2598 6.2598 6.4182 6.4182 6.4182 6.4182 6.4943 6.4943 6.4943 6.4943 7.6527 7.6527 7.6527 7.6527 7.9095 7.9095 7.9095 7.9095 9.9350 9.9350 9.9350 9.9350 11.4955 11.4955 11.4955 11.4955 14.1861 14.1861 k = 0.4318 0.2493 0.2446 ( 4462 PWs) bands (ev): -25.8331 -25.8331 -25.8331 -25.8331 -8.7436 -8.7436 -8.7436 -8.7436 -7.6799 -7.6799 -7.6799 -7.6799 -7.5487 -7.5487 -7.5487 -7.5487 -0.6217 -0.6217 -0.6217 -0.6217 4.3110 4.3110 4.3110 4.3110 5.7219 5.7219 5.7219 5.7219 5.8408 5.8408 5.8408 5.8408 6.2590 6.2590 6.2590 6.2590 6.4130 6.4130 6.4130 6.4130 6.4793 6.4793 6.4793 6.4793 7.6250 7.6250 7.6250 7.6250 7.9336 7.9336 7.9336 7.9336 9.9137 9.9137 9.9137 9.9137 11.4818 11.4818 11.4818 11.4818 14.2461 14.2461 k = 0.4432 0.2559 0.2446 ( 4478 PWs) bands (ev): -25.8328 -25.8328 -25.8328 -25.8328 -8.7448 -8.7448 -8.7448 -8.7448 -7.6819 -7.6819 -7.6819 -7.6819 -7.5487 -7.5487 -7.5487 -7.5487 -0.6100 -0.6100 -0.6100 -0.6100 4.2934 4.2934 4.2934 4.2934 5.7209 5.7209 5.7209 5.7209 5.8519 5.8519 5.8519 5.8519 6.2583 6.2583 6.2583 6.2583 6.4066 6.4066 6.4066 6.4066 6.4688 6.4688 6.4688 6.4688 7.6011 7.6011 7.6011 7.6011 7.9545 7.9545 7.9545 7.9545 9.8956 9.8956 9.8956 9.8956 11.4696 11.4696 11.4696 11.4696 14.3006 14.3006 k = 0.4545 0.2624 0.2446 ( 4478 PWs) bands (ev): -25.8326 -25.8326 -25.8326 -25.8326 -8.7458 -8.7458 -8.7458 -8.7458 -7.6835 -7.6835 -7.6835 -7.6835 -7.5486 -7.5486 -7.5486 -7.5486 -0.6003 -0.6003 -0.6003 -0.6003 4.2788 4.2788 4.2788 4.2788 5.7200 5.7200 5.7200 5.7200 5.8614 5.8614 5.8614 5.8614 6.2577 6.2577 6.2577 6.2577 6.3999 6.3999 6.3999 6.3999 6.4618 6.4618 6.4618 6.4618 7.5811 7.5811 7.5811 7.5811 7.9720 7.9720 7.9720 7.9720 9.8807 9.8807 9.8807 9.8807 11.4592 11.4592 11.4592 11.4592 14.3483 14.3483 k = 0.4659 0.2690 0.2446 ( 4474 PWs) bands (ev): -25.8325 -25.8325 -25.8325 -25.8325 -8.7466 -8.7466 -8.7466 -8.7466 -7.6848 -7.6848 -7.6848 -7.6848 -7.5486 -7.5486 -7.5486 -7.5486 -0.5926 -0.5926 -0.5926 -0.5926 4.2672 4.2672 4.2672 4.2672 5.7192 5.7192 5.7192 5.7192 5.8689 5.8689 5.8689 5.8689 6.2572 6.2572 6.2572 6.2572 6.3937 6.3937 6.3937 6.3937 6.4576 6.4576 6.4576 6.4576 7.5654 7.5654 7.5654 7.5654 7.9859 7.9859 7.9859 7.9859 9.8692 9.8692 9.8692 9.8692 11.4509 11.4509 11.4509 11.4509 14.3878 14.3878 k = 0.4773 0.2756 0.2446 ( 4472 PWs) bands (ev): -25.8324 -25.8324 -25.8324 -25.8324 -8.7471 -8.7471 -8.7471 -8.7471 -7.6858 -7.6858 -7.6858 -7.6858 -7.5485 -7.5485 -7.5485 -7.5485 -0.5871 -0.5871 -0.5871 -0.5871 4.2589 4.2589 4.2589 4.2589 5.7186 5.7186 5.7186 5.7186 5.8744 5.8744 5.8744 5.8744 6.2567 6.2567 6.2567 6.2567 6.3889 6.3889 6.3889 6.3889 6.4550 6.4550 6.4550 6.4550 7.5541 7.5541 7.5541 7.5541 7.9959 7.9959 7.9959 7.9959 9.8610 9.8610 9.8610 9.8610 11.4448 11.4448 11.4448 11.4448 14.4175 14.4175 k = 0.4886 0.2821 0.2446 ( 4464 PWs) bands (ev): -25.8323 -25.8323 -25.8323 -25.8323 -8.7475 -8.7475 -8.7475 -8.7475 -7.6864 -7.6864 -7.6864 -7.6864 -7.5485 -7.5485 -7.5485 -7.5485 -0.5837 -0.5837 -0.5837 -0.5837 4.2539 4.2539 4.2539 4.2539 5.7183 5.7183 5.7183 5.7183 5.8778 5.8778 5.8778 5.8778 6.2565 6.2565 6.2565 6.2565 6.3858 6.3858 6.3858 6.3858 6.4536 6.4536 6.4536 6.4536 7.5473 7.5473 7.5473 7.5473 8.0020 8.0020 8.0020 8.0020 9.8560 9.8560 9.8560 9.8560 11.4411 11.4411 11.4411 11.4411 14.4361 14.4361 k = 0.5000 0.2887 0.2446 ( 4468 PWs) bands (ev): -25.8323 -25.8323 -25.8323 -25.8323 -8.7476 -8.7476 -8.7476 -8.7476 -7.6865 -7.6865 -7.6865 -7.6865 -7.5485 -7.5485 -7.5485 -7.5485 -0.5826 -0.5826 -0.5826 -0.5826 4.2522 4.2522 4.2522 4.2522 5.7182 5.7182 5.7182 5.7182 5.8789 5.8789 5.8789 5.8789 6.2564 6.2564 6.2564 6.2564 6.3848 6.3848 6.3848 6.3848 6.4532 6.4532 6.4532 6.4532 7.5450 7.5450 7.5450 7.5450 8.0040 8.0040 8.0040 8.0040 9.8544 9.8544 9.8544 9.8544 11.4398 11.4398 11.4398 11.4398 14.4424 14.4424 k = 0.5000 0.2887 0.2446 ( 4468 PWs) bands (ev): -25.8323 -25.8323 -25.8323 -25.8323 -8.7476 -8.7476 -8.7476 -8.7476 -7.6865 -7.6865 -7.6865 -7.6865 -7.5485 -7.5485 -7.5485 -7.5485 -0.5826 -0.5826 -0.5826 -0.5826 4.2522 4.2522 4.2522 4.2522 5.7182 5.7182 5.7182 5.7182 5.8789 5.8789 5.8789 5.8789 6.2564 6.2564 6.2564 6.2564 6.3848 6.3848 6.3848 6.3848 6.4532 6.4532 6.4532 6.4532 7.5450 7.5450 7.5450 7.5450 8.0040 8.0040 8.0040 8.0040 9.8544 9.8544 9.8544 9.8544 11.4398 11.4398 11.4398 11.4398 14.4424 14.4424 k = 0.4936 0.2998 0.2446 ( 4476 PWs) bands (ev): -25.8323 -25.8323 -25.8323 -25.8323 -8.7477 -8.7477 -8.7475 -8.7475 -7.6867 -7.6867 -7.6863 -7.6863 -7.5487 -7.5487 -7.5487 -7.5487 -0.5827 -0.5827 -0.5819 -0.5819 4.2526 4.2526 4.2533 4.2533 5.7154 5.7154 5.7195 5.7195 5.8794 5.8794 5.8795 5.8795 6.2519 6.2519 6.2607 6.2607 6.3826 6.3826 6.3861 6.3861 6.4521 6.4521 6.4540 6.4540 7.5362 7.5362 7.5447 7.5447 8.0033 8.0033 8.0056 8.0056 9.8550 9.8550 9.8565 9.8565 11.4464 11.4464 11.4468 11.4468 14.4217 14.4223 k = 0.4872 0.3109 0.2446 ( 4480 PWs) bands (ev): -25.8323 -25.8323 -25.8323 -25.8323 -8.7479 -8.7479 -8.7474 -8.7474 -7.6868 -7.6868 -7.6859 -7.6859 -7.5491 -7.5491 -7.5491 -7.5491 -0.5821 -0.5821 -0.5805 -0.5805 4.2546 4.2546 4.2559 4.2559 5.7114 5.7114 5.7195 5.7195 5.8810 5.8810 5.8811 5.8811 6.2472 6.2472 6.2648 6.2648 6.3796 6.3796 6.3868 6.3868 6.4511 6.4511 6.4546 6.4546 7.5184 7.5184 7.5355 7.5355 8.0035 8.0035 8.0080 8.0080 9.8584 9.8584 9.8614 9.8614 11.4664 11.4664 11.4671 11.4671 14.3732 14.3739 k = 0.4808 0.3220 0.2446 ( 4480 PWs) bands (ev): -25.8323 -25.8323 -25.8323 -25.8323 -8.7480 -8.7480 -8.7473 -8.7473 -7.6867 -7.6867 -7.6855 -7.6855 -7.5499 -7.5499 -7.5499 -7.5499 -0.5809 -0.5809 -0.5786 -0.5786 4.2581 4.2581 4.2600 4.2600 5.7064 5.7064 5.7182 5.7182 5.8835 5.8835 5.8839 5.8839 6.2424 6.2424 6.2686 6.2686 6.3755 6.3755 6.3869 6.3869 6.4500 6.4500 6.4549 6.4549 7.4921 7.4921 7.5178 7.5178 8.0045 8.0045 8.0113 8.0113 9.8643 9.8643 9.8689 9.8689 11.4995 11.4995 11.5005 11.5005 14.3145 14.3153 k = 0.4744 0.3331 0.2446 ( 4480 PWs) bands (ev): -25.8322 -25.8322 -25.8322 -25.8322 -8.7482 -8.7482 -8.7473 -8.7473 -7.6866 -7.6866 -7.6849 -7.6849 -7.5509 -7.5509 -7.5509 -7.5509 -0.5791 -0.5791 -0.5760 -0.5760 4.2631 4.2631 4.2656 4.2656 5.7004 5.7004 5.7157 5.7157 5.8868 5.8868 5.8876 5.8876 6.2375 6.2375 6.2723 6.2723 6.3704 6.3704 6.3864 6.3864 6.4490 6.4490 6.4548 6.4548 7.4582 7.4582 7.4925 7.4925 8.0064 8.0064 8.0154 8.0154 9.8724 9.8724 9.8788 9.8788 11.5450 11.5450 11.5465 11.5465 14.2524 14.2533 k = 0.4679 0.3442 0.2446 ( 4484 PWs) bands (ev): -25.8322 -25.8322 -25.8322 -25.8322 -8.7484 -8.7484 -8.7472 -8.7472 -7.6864 -7.6864 -7.6843 -7.6843 -7.5523 -7.5523 -7.5522 -7.5522 -0.5767 -0.5767 -0.5728 -0.5728 4.2695 4.2695 4.2726 4.2726 5.6938 5.6938 5.7121 5.7121 5.8905 5.8905 5.8920 5.8920 6.2324 6.2324 6.2758 6.2758 6.3640 6.3640 6.3854 6.3854 6.4481 6.4481 6.4543 6.4543 7.4174 7.4174 7.4604 7.4604 8.0092 8.0092 8.0202 8.0202 9.8824 9.8824 9.8908 9.8908 11.6022 11.6022 11.6041 11.6041 14.1900 14.1909 k = 0.4615 0.3553 0.2446 ( 4474 PWs) bands (ev): -25.8321 -25.8321 -25.8321 -25.8321 -8.7486 -8.7486 -8.7472 -8.7472 -7.6861 -7.6861 -7.6836 -7.6836 -7.5538 -7.5538 -7.5538 -7.5538 -0.5737 -0.5737 -0.5691 -0.5691 4.2772 4.2772 4.2808 4.2808 5.6867 5.6867 5.7079 5.7079 5.8946 5.8946 5.8970 5.8970 6.2272 6.2272 6.2791 6.2791 6.3565 6.3565 6.3840 6.3840 6.4475 6.4475 6.4534 6.4534 7.3709 7.3709 7.4227 7.4227 8.0128 8.0128 8.0257 8.0257 9.8939 9.8939 9.9044 9.9044 11.6702 11.6702 11.6727 11.6727 14.1295 14.1298 k = 0.4551 0.3664 0.2446 ( 4474 PWs) bands (ev): -25.8320 -25.8320 -25.8320 -25.8320 -8.7489 -8.7489 -8.7472 -8.7472 -7.6857 -7.6857 -7.6828 -7.6828 -7.5557 -7.5557 -7.5555 -7.5555 -0.5702 -0.5702 -0.5648 -0.5648 4.2862 4.2862 4.2903 4.2903 5.6794 5.6794 5.7030 5.7030 5.8987 5.8987 5.9022 5.9022 6.2218 6.2218 6.2822 6.2822 6.3476 6.3476 6.3820 6.3820 6.4469 6.4469 6.4520 6.4520 7.3198 7.3198 7.3805 7.3805 8.0171 8.0171 8.0319 8.0319 9.9066 9.9066 9.9194 9.9194 11.7478 11.7478 11.7510 11.7510 14.0716 14.0721 k = 0.4487 0.3775 0.2446 ( 4474 PWs) bands (ev): -25.8319 -25.8319 -25.8319 -25.8319 -8.7491 -8.7491 -8.7473 -8.7473 -7.6852 -7.6852 -7.6819 -7.6819 -7.5577 -7.5577 -7.5575 -7.5575 -0.5662 -0.5662 -0.5601 -0.5601 4.2962 4.2962 4.3009 4.3009 5.6720 5.6720 5.6978 5.6978 5.9027 5.9027 5.9075 5.9075 6.2161 6.2161 6.2850 6.2850 6.3376 6.3376 6.3796 6.3796 6.4465 6.4465 6.4500 6.4500 7.2653 7.2653 7.3351 7.3351 8.0222 8.0222 8.0387 8.0387 9.9202 9.9202 9.9355 9.9355 11.8340 11.8340 11.8379 11.8379 14.0171 14.0172 k = 0.4423 0.3886 0.2446 ( 4474 PWs) bands (ev): -25.8318 -25.8318 -25.8318 -25.8318 -8.7494 -8.7494 -8.7473 -8.7473 -7.6847 -7.6847 -7.6810 -7.6810 -7.5599 -7.5599 -7.5596 -7.5596 -0.5617 -0.5617 -0.5549 -0.5549 4.3073 4.3073 4.3124 4.3124 5.6648 5.6648 5.6925 5.6925 5.9064 5.9064 5.9126 5.9126 6.2100 6.2100 6.2876 6.2876 6.3266 6.3266 6.3767 6.3767 6.4462 6.4462 6.4475 6.4475 7.2085 7.2085 7.2876 7.2876 8.0278 8.0278 8.0460 8.0460 9.9344 9.9344 9.9522 9.9522 11.9273 11.9273 11.9321 11.9321 13.9665 13.9666 k = 0.4359 0.3997 0.2446 ( 4482 PWs) bands (ev): -25.8317 -25.8317 -25.8317 -25.8317 -8.7497 -8.7497 -8.7474 -8.7474 -7.6842 -7.6842 -7.6800 -7.6800 -7.5623 -7.5623 -7.5619 -7.5619 -0.5569 -0.5569 -0.5494 -0.5494 4.3192 4.3192 4.3247 4.3247 5.6580 5.6580 5.6872 5.6872 5.9096 5.9096 5.9173 5.9173 6.2033 6.2033 6.2899 6.2899 6.3148 6.3148 6.3734 6.3734 6.4445 6.4445 6.4461 6.4461 7.1506 7.1506 7.2391 7.2391 8.0341 8.0341 8.0537 8.0537 9.9489 9.9489 9.9693 9.9693 12.0265 12.0265 12.0323 12.0323 13.9203 13.9203 k = 0.4295 0.4108 0.2446 ( 4486 PWs) bands (ev): -25.8316 -25.8316 -25.8316 -25.8316 -8.7499 -8.7499 -8.7475 -8.7475 -7.6836 -7.6836 -7.6790 -7.6790 -7.5648 -7.5648 -7.5643 -7.5643 -0.5517 -0.5517 -0.5435 -0.5435 4.3318 4.3318 4.3376 4.3376 5.6517 5.6517 5.6821 5.6821 5.9120 5.9120 5.9214 5.9214 6.1957 6.1957 6.2919 6.2919 6.3026 6.3026 6.3698 6.3698 6.4409 6.4409 6.4460 6.4460 7.0927 7.0927 7.1907 7.1907 8.0408 8.0408 8.0618 8.0618 9.9635 9.9635 9.9865 9.9865 12.1301 12.1301 12.1371 12.1371 13.8790 13.8791 k = 0.4231 0.4219 0.2446 ( 4486 PWs) bands (ev): -25.8315 -25.8315 -25.8315 -25.8315 -8.7502 -8.7502 -8.7476 -8.7476 -7.6831 -7.6831 -7.6779 -7.6779 -7.5674 -7.5674 -7.5668 -7.5668 -0.5462 -0.5462 -0.5374 -0.5374 4.3449 4.3449 4.3509 4.3509 5.6461 5.6461 5.6774 5.6774 5.9136 5.9136 5.9247 5.9247 6.1869 6.1869 6.2906 6.2906 6.2934 6.2934 6.3659 6.3659 6.4369 6.4369 6.4461 6.4461 7.0358 7.0358 7.1433 7.1433 8.0480 8.0480 8.0702 8.0702 9.9779 9.9779 10.0036 10.0036 12.2366 12.2366 12.2450 12.2450 13.8430 13.8431 k = 0.4167 0.4330 0.2446 ( 4482 PWs) bands (ev): -25.8314 -25.8314 -25.8314 -25.8314 -8.7506 -8.7506 -8.7478 -8.7478 -7.6825 -7.6825 -7.6769 -7.6769 -7.5701 -7.5701 -7.5692 -7.5692 -0.5405 -0.5405 -0.5312 -0.5312 4.3582 4.3582 4.3645 4.3645 5.6414 5.6414 5.6734 5.6734 5.9139 5.9139 5.9268 5.9268 6.1765 6.1765 6.2795 6.2795 6.2942 6.2942 6.3619 6.3619 6.4325 6.4325 6.4462 6.4462 6.9808 6.9808 7.0976 7.0976 8.0554 8.0554 8.0788 8.0788 9.9920 9.9920 10.0203 10.0203 12.3444 12.3444 12.3544 12.3544 13.8125 13.8126 k = 0.4103 0.4441 0.2446 ( 4486 PWs) bands (ev): -25.8312 -25.8312 -25.8312 -25.8312 -8.7509 -8.7509 -8.7479 -8.7479 -7.6819 -7.6819 -7.6759 -7.6759 -7.5727 -7.5727 -7.5717 -7.5717 -0.5347 -0.5347 -0.5248 -0.5248 4.3716 4.3716 4.3780 4.3780 5.6378 5.6378 5.6701 5.6701 5.9128 5.9128 5.9275 5.9275 6.1643 6.1643 6.2696 6.2696 6.2942 6.2942 6.3581 6.3581 6.4277 6.4277 6.4464 6.4464 6.9285 6.9285 7.0542 7.0542 8.0631 8.0631 8.0875 8.0875 10.0056 10.0056 10.0364 10.0364 12.4517 12.4517 12.4635 12.4635 13.7880 13.7884 k = 0.4038 0.4552 0.2446 ( 4490 PWs) bands (ev): -25.8311 -25.8311 -25.8311 -25.8311 -8.7512 -8.7512 -8.7481 -8.7481 -7.6813 -7.6813 -7.6748 -7.6748 -7.5753 -7.5753 -7.5741 -7.5741 -0.5288 -0.5288 -0.5184 -0.5184 4.3848 4.3848 4.3913 4.3913 5.6355 5.6355 5.6677 5.6677 5.9099 5.9099 5.9264 5.9264 6.1506 6.1506 6.2616 6.2616 6.2930 6.2930 6.3549 6.3549 6.4226 6.4226 6.4466 6.4466 6.8797 6.8797 7.0137 7.0137 8.0709 8.0709 8.0962 8.0962 10.0184 10.0184 10.0516 10.0516 12.5569 12.5569 12.5706 12.5706 13.7695 13.7696 k = 0.3974 0.4663 0.2446 ( 4490 PWs) bands (ev): -25.8310 -25.8310 -25.8310 -25.8310 -8.7515 -8.7515 -8.7483 -8.7483 -7.6808 -7.6808 -7.6739 -7.6739 -7.5779 -7.5779 -7.5764 -7.5764 -0.5229 -0.5229 -0.5121 -0.5121 4.3976 4.3976 4.4041 4.4041 5.6346 5.6346 5.6665 5.6665 5.9050 5.9050 5.9229 5.9229 6.1361 6.1361 6.2553 6.2553 6.2907 6.2907 6.3527 6.3527 6.4173 6.4173 6.4469 6.4469 6.8349 6.8349 6.9764 6.9764 8.0787 8.0787 8.1047 8.1047 10.0303 10.0303 10.0659 10.0659 12.6582 12.6582 12.6740 12.6740 13.7573 13.7576 k = 0.3910 0.4774 0.2446 ( 4490 PWs) bands (ev): -25.8309 -25.8309 -25.8309 -25.8309 -8.7519 -8.7519 -8.7485 -8.7485 -7.6804 -7.6804 -7.6730 -7.6730 -7.5803 -7.5803 -7.5786 -7.5786 -0.5172 -0.5172 -0.5059 -0.5059 4.4097 4.4097 4.4161 4.4161 5.6353 5.6353 5.6667 5.6667 5.8979 5.8979 5.9167 5.9167 6.1217 6.1217 6.2506 6.2506 6.2871 6.2871 6.3515 6.3515 6.4119 6.4119 6.4473 6.4473 6.7945 6.7945 6.9425 6.9425 8.0864 8.0864 8.1131 8.1131 10.0412 10.0412 10.0789 10.0789 12.7538 12.7538 12.7719 12.7719 13.7511 13.7511 k = 0.3846 0.4885 0.2446 ( 4486 PWs) bands (ev): -25.8308 -25.8308 -25.8308 -25.8308 -8.7522 -8.7522 -8.7487 -8.7487 -7.6800 -7.6800 -7.6722 -7.6722 -7.5825 -7.5825 -7.5806 -7.5806 -0.5116 -0.5116 -0.4999 -0.4999 4.4209 4.4209 4.4273 4.4273 5.6377 5.6377 5.6684 5.6684 5.8884 5.8884 5.9073 5.9073 6.1083 6.1083 6.2473 6.2473 6.2828 6.2828 6.3514 6.3514 6.4065 6.4065 6.4477 6.4477 6.7588 6.7588 6.9122 6.9122 8.0938 8.0938 8.1211 8.1211 10.0509 10.0509 10.0907 10.0907 12.8422 12.8422 12.8626 12.8626 13.7510 13.7510 k = 0.3782 0.4996 0.2446 ( 4486 PWs) bands (ev): -25.8307 -25.8307 -25.8307 -25.8307 -8.7525 -8.7525 -8.7489 -8.7489 -7.6796 -7.6796 -7.6714 -7.6714 -7.5846 -7.5846 -7.5825 -7.5825 -0.5064 -0.5064 -0.4943 -0.4943 4.4311 4.4311 4.4373 4.4373 5.6420 5.6420 5.6717 5.6717 5.8767 5.8767 5.8949 5.8949 6.0968 6.0968 6.2450 6.2450 6.2782 6.2782 6.3522 6.3522 6.4011 6.4011 6.4481 6.4481 6.7277 6.7277 6.8854 6.8854 8.1009 8.1009 8.1286 8.1286 10.0593 10.0593 10.1009 10.1009 12.9219 12.9219 12.9447 12.9447 13.7566 13.7566 k = 0.3718 0.5107 0.2446 ( 4482 PWs) bands (ev): -25.8306 -25.8306 -25.8306 -25.8306 -8.7528 -8.7528 -8.7491 -8.7491 -7.6794 -7.6794 -7.6708 -7.6708 -7.5864 -7.5864 -7.5841 -7.5841 -0.5015 -0.5015 -0.4892 -0.4892 4.4400 4.4400 4.4460 4.4460 5.6482 5.6482 5.6769 5.6769 5.8628 5.8628 5.8795 5.8795 6.0876 6.0876 6.2435 6.2435 6.2738 6.2738 6.3537 6.3537 6.3959 6.3959 6.4485 6.4485 6.7013 6.7013 6.8623 6.8623 8.1074 8.1074 8.1355 8.1355 10.0664 10.0664 10.1096 10.1096 12.9922 12.9922 13.0172 13.0172 13.7677 13.7677 k = 0.3654 0.5218 0.2446 ( 4470 PWs) bands (ev): -25.8305 -25.8305 -25.8305 -25.8305 -8.7530 -8.7530 -8.7493 -8.7493 -7.6792 -7.6792 -7.6703 -7.6703 -7.5880 -7.5880 -7.5855 -7.5855 -0.4971 -0.4971 -0.4845 -0.4845 4.4474 4.4474 4.4533 4.4533 5.6562 5.6562 5.6839 5.6839 5.8473 5.8473 5.8619 5.8619 6.0806 6.0806 6.2426 6.2426 6.2701 6.2701 6.3557 6.3557 6.3908 6.3908 6.4490 6.4490 6.6794 6.6794 6.8428 6.8428 8.1134 8.1134 8.1418 8.1418 10.0721 10.0721 10.1168 10.1168 13.0523 13.0523 13.0796 13.0796 13.7837 13.7838 k = 0.3590 0.5329 0.2446 ( 4464 PWs) bands (ev): -25.8304 -25.8304 -25.8304 -25.8304 -8.7533 -8.7533 -8.7495 -8.7495 -7.6791 -7.6791 -7.6699 -7.6699 -7.5893 -7.5893 -7.5866 -7.5866 -0.4933 -0.4933 -0.4805 -0.4805 4.4534 4.4534 4.4592 4.4592 5.6657 5.6657 5.6927 5.6927 5.8307 5.8307 5.8431 5.8431 6.0755 6.0755 6.2421 6.2421 6.2671 6.2671 6.3581 6.3581 6.3860 6.3860 6.4495 6.4495 6.6617 6.6617 6.8268 6.8268 8.1185 8.1185 8.1472 8.1472 10.0765 10.0765 10.1223 10.1223 13.1020 13.1020 13.1314 13.1314 13.8043 13.8045 k = 0.3526 0.5440 0.2446 ( 4462 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7535 -8.7535 -8.7496 -8.7496 -7.6790 -7.6790 -7.6697 -7.6697 -7.5903 -7.5903 -7.5875 -7.5875 -0.4902 -0.4902 -0.4773 -0.4773 4.4579 4.4579 4.4635 4.4635 5.6765 5.6765 5.7032 5.7032 5.8139 5.8139 5.8241 5.8241 6.0720 6.0720 6.2418 6.2418 6.2650 6.2650 6.3606 6.3606 6.3815 6.3815 6.4499 6.4499 6.6481 6.6481 6.8143 6.8143 8.1228 8.1228 8.1516 8.1516 10.0797 10.0797 10.1264 10.1264 13.1411 13.1411 13.1724 13.1724 13.8287 13.8287 k = 0.3462 0.5551 0.2446 ( 4466 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7536 -8.7536 -8.7498 -8.7498 -7.6790 -7.6790 -7.6695 -7.6695 -7.5910 -7.5910 -7.5881 -7.5881 -0.4879 -0.4879 -0.4748 -0.4748 4.4609 4.4609 4.4664 4.4664 5.6874 5.6874 5.7146 5.7146 5.7985 5.7985 5.8061 5.8061 6.0697 6.0697 6.2417 6.2417 6.2636 6.2636 6.3633 6.3633 6.3773 6.3773 6.4502 6.4502 6.6385 6.6385 6.8053 6.8053 8.1260 8.1260 8.1549 8.1549 10.0817 10.0817 10.1291 10.1291 13.1694 13.1694 13.2023 13.2023 13.8537 13.8545 k = 0.3397 0.5662 0.2446 ( 4466 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7537 -8.7537 -8.7498 -8.7498 -7.6790 -7.6790 -7.6694 -7.6694 -7.5914 -7.5914 -7.5884 -7.5884 -0.4864 -0.4864 -0.4733 -0.4733 4.4626 4.4626 4.4681 4.4681 5.6965 5.6965 5.7251 5.7251 5.7866 5.7866 5.7916 5.7916 6.0684 6.0684 6.2416 6.2416 6.2629 6.2629 6.3660 6.3660 6.3737 6.3737 6.4504 6.4504 6.6327 6.6327 6.7999 6.7999 8.1281 8.1281 8.1570 8.1570 10.0828 10.0828 10.1305 10.1305 13.1867 13.1867 13.2207 13.2207 13.8752 13.8754 k = 0.3333 0.5774 0.2446 ( 4470 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7537 -8.7537 -8.7499 -8.7499 -7.6790 -7.6790 -7.6694 -7.6694 -7.5916 -7.5916 -7.5886 -7.5886 -0.4859 -0.4859 -0.4728 -0.4728 4.4631 4.4631 4.4685 4.4685 5.7002 5.7002 5.7300 5.7300 5.7819 5.7819 5.7853 5.7853 6.0680 6.0680 6.2416 6.2416 6.2626 6.2626 6.3679 6.3679 6.3714 6.3714 6.4504 6.4504 6.6307 6.6307 6.7981 6.7981 8.1288 8.1288 8.1577 8.1577 10.0831 10.0831 10.1309 10.1309 13.1925 13.1925 13.2270 13.2270 13.8840 13.8852 k = 0.3333 0.5774 0.2446 ( 4470 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7537 -8.7537 -8.7499 -8.7499 -7.6790 -7.6790 -7.6694 -7.6694 -7.5916 -7.5916 -7.5886 -7.5886 -0.4859 -0.4859 -0.4728 -0.4728 4.4631 4.4631 4.4685 4.4685 5.7002 5.7002 5.7300 5.7300 5.7819 5.7819 5.7853 5.7853 6.0680 6.0680 6.2416 6.2416 6.2626 6.2626 6.3679 6.3679 6.3714 6.3714 6.4504 6.4504 6.6307 6.6307 6.7981 6.7981 8.1288 8.1288 8.1577 8.1577 10.0831 10.0831 10.1309 10.1309 13.1925 13.1925 13.2270 13.2270 13.8840 13.8845 k = 0.3268 0.5660 0.2446 ( 4470 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7537 -8.7537 -8.7498 -8.7498 -7.6790 -7.6790 -7.6694 -7.6694 -7.5914 -7.5914 -7.5884 -7.5884 -0.4865 -0.4865 -0.4733 -0.4733 4.4626 4.4626 4.4681 4.4681 5.6962 5.6962 5.7248 5.7248 5.7868 5.7868 5.7919 5.7919 6.0684 6.0684 6.2416 6.2416 6.2628 6.2628 6.3660 6.3660 6.3737 6.3737 6.4504 6.4504 6.6328 6.6328 6.8000 6.8000 8.1280 8.1280 8.1569 8.1569 10.0829 10.0829 10.1306 10.1306 13.1864 13.1864 13.2204 13.2204 13.8764 13.8764 k = 0.3203 0.5547 0.2446 ( 4466 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7536 -8.7536 -8.7497 -8.7497 -7.6789 -7.6789 -7.6694 -7.6694 -7.5911 -7.5911 -7.5881 -7.5881 -0.4882 -0.4882 -0.4751 -0.4751 4.4615 4.4615 4.4671 4.4671 5.6865 5.6865 5.7135 5.7135 5.7992 5.7992 5.8070 5.8070 6.0699 6.0699 6.2417 6.2417 6.2636 6.2636 6.3632 6.3632 6.3776 6.3776 6.4502 6.4502 6.6388 6.6388 6.8057 6.8057 8.1256 8.1256 8.1545 8.1545 10.0824 10.0824 10.1297 10.1297 13.1681 13.1681 13.2007 13.2007 13.8621 13.8621 k = 0.3137 0.5434 0.2446 ( 4464 PWs) bands (ev): -25.8304 -25.8304 -25.8304 -25.8304 -8.7534 -8.7534 -8.7495 -8.7495 -7.6788 -7.6788 -7.6694 -7.6694 -7.5904 -7.5904 -7.5876 -7.5876 -0.4912 -0.4912 -0.4782 -0.4782 4.4600 4.4600 4.4656 4.4656 5.6743 5.6743 5.7008 5.7008 5.8153 5.8153 5.8253 5.8253 6.0726 6.0726 6.2419 6.2419 6.2649 6.2649 6.3606 6.3606 6.3820 6.3820 6.4498 6.4498 6.6490 6.6490 6.8153 6.8153 8.1213 8.1213 8.1502 8.1502 10.0820 10.0820 10.1287 10.1287 13.1385 13.1385 13.1689 13.1689 13.8510 13.8510 k = 0.3072 0.5321 0.2446 ( 4472 PWs) bands (ev): -25.8304 -25.8304 -25.8304 -25.8304 -8.7531 -8.7531 -8.7493 -8.7493 -7.6785 -7.6785 -7.6693 -7.6693 -7.5896 -7.5896 -7.5869 -7.5869 -0.4954 -0.4954 -0.4826 -0.4826 4.4585 4.4585 4.4642 4.4642 5.6618 5.6618 5.6883 5.6883 5.8324 5.8324 5.8443 5.8443 6.0770 6.0770 6.2424 6.2424 6.2671 6.2671 6.3585 6.3585 6.3867 6.3867 6.4493 6.4493 6.6633 6.6633 6.8286 6.8286 8.1152 8.1152 8.1440 8.1440 10.0820 10.0820 10.1279 10.1279 13.0988 13.0988 13.1267 13.1267 13.8469 13.8469 k = 0.3007 0.5207 0.2446 ( 4462 PWs) bands (ev): -25.8305 -25.8305 -25.8305 -25.8305 -8.7526 -8.7526 -8.7489 -8.7489 -7.6781 -7.6781 -7.6691 -7.6691 -7.5887 -7.5887 -7.5860 -7.5860 -0.5010 -0.5010 -0.4884 -0.4884 4.4573 4.4573 4.4630 4.4630 5.6499 5.6499 5.6769 5.6769 5.8491 5.8491 5.8624 5.8624 6.0837 6.0837 6.2435 6.2435 6.2704 6.2704 6.3572 6.3572 6.3918 6.3918 6.4489 6.4489 6.6818 6.6818 6.8459 6.8459 8.1071 8.1071 8.1359 8.1359 10.0828 10.0828 10.1275 10.1275 13.0512 13.0512 13.0762 13.0762 13.8502 13.8502 k = 0.2941 0.5094 0.2446 ( 4470 PWs) bands (ev): -25.8307 -25.8307 -25.8307 -25.8307 -8.7521 -8.7521 -8.7484 -8.7484 -7.6776 -7.6776 -7.6688 -7.6688 -7.5875 -7.5875 -7.5850 -7.5850 -0.5080 -0.5080 -0.4957 -0.4957 4.4567 4.4567 4.4624 4.4624 5.6390 5.6390 5.6665 5.6665 5.8640 5.8640 5.8782 5.8782 6.0932 6.0932 6.2453 6.2453 6.2748 6.2748 6.3571 6.3571 6.3970 6.3970 6.4483 6.4483 6.7045 6.7045 6.8669 6.8669 8.0969 8.0969 8.1256 8.1256 10.0847 10.0847 10.1281 10.1281 12.9974 12.9974 13.0198 13.0198 13.8603 13.8603 k = 0.2876 0.4981 0.2446 ( 4478 PWs) bands (ev): -25.8308 -25.8308 -25.8308 -25.8308 -8.7514 -8.7514 -8.7478 -8.7478 -7.6768 -7.6768 -7.6683 -7.6683 -7.5863 -7.5863 -7.5839 -7.5839 -0.5165 -0.5165 -0.5044 -0.5044 4.4570 4.4570 4.4627 4.4627 5.6293 5.6293 5.6573 5.6573 5.8764 5.8764 5.8907 5.8907 6.1055 6.1055 6.2486 6.2486 6.2800 6.2800 6.3592 6.3592 6.4023 6.4023 6.4478 6.4478 6.7313 6.7313 6.8916 6.8916 8.0846 8.0846 8.1133 8.1133 10.0880 10.0880 10.1300 10.1300 12.9393 12.9393 12.9591 12.9591 13.8758 13.8758 k = 0.2810 0.4868 0.2446 ( 4474 PWs) bands (ev): -25.8310 -25.8310 -25.8310 -25.8310 -8.7506 -8.7506 -8.7471 -8.7471 -7.6759 -7.6759 -7.6677 -7.6677 -7.5850 -7.5850 -7.5827 -7.5827 -0.5263 -0.5263 -0.5146 -0.5146 4.4584 4.4584 4.4641 4.4641 5.6210 5.6210 5.6492 5.6492 5.8857 5.8857 5.8995 5.8995 6.1204 6.1204 6.2541 6.2541 6.2852 6.2852 6.3645 6.3645 6.4077 6.4077 6.4473 6.4473 6.7623 6.7623 6.9199 6.9199 8.0702 8.0702 8.0988 8.0988 10.0930 10.0930 10.1334 10.1334 12.8783 12.8783 12.8958 12.8958 13.8946 13.8946 k = 0.2745 0.4755 0.2446 ( 4474 PWs) bands (ev): -25.8313 -25.8313 -25.8312 -25.8312 -8.7497 -8.7497 -8.7463 -8.7463 -7.6747 -7.6747 -7.6668 -7.6668 -7.5835 -7.5835 -7.5815 -7.5815 -0.5376 -0.5376 -0.5263 -0.5263 4.4613 4.4613 4.4668 4.4668 5.6138 5.6138 5.6420 5.6420 5.8917 5.8917 5.9044 5.9044 6.1365 6.1365 6.2631 6.2631 6.2892 6.2892 6.3742 6.3742 6.4135 6.4135 6.4470 6.4470 6.7972 6.7972 6.9519 6.9519 8.0537 8.0537 8.0822 8.0822 10.1001 10.1001 10.1387 10.1387 12.8157 12.8157 12.8311 12.8311 13.9128 13.9128 k = 0.2680 0.4641 0.2446 ( 4474 PWs) bands (ev): -25.8315 -25.8315 -25.8315 -25.8315 -8.7486 -8.7486 -8.7453 -8.7453 -7.6734 -7.6734 -7.6658 -7.6658 -7.5821 -7.5821 -7.5801 -7.5801 -0.5504 -0.5504 -0.5394 -0.5394 4.4656 4.4656 4.4711 4.4711 5.6079 5.6079 5.6357 5.6357 5.8943 5.8943 5.9059 5.9059 6.1521 6.1521 6.2768 6.2768 6.2916 6.2916 6.3880 6.3880 6.4202 6.4202 6.4468 6.4468 6.8358 6.8358 6.9872 6.9872 8.0351 8.0351 8.0637 8.0637 10.1095 10.1095 10.1463 10.1463 12.7522 12.7522 12.7657 12.7657 13.9192 13.9192 k = 0.2614 0.4528 0.2446 ( 4476 PWs) bands (ev): -25.8318 -25.8318 -25.8318 -25.8318 -8.7474 -8.7474 -8.7442 -8.7442 -7.6718 -7.6718 -7.6645 -7.6645 -7.5805 -7.5805 -7.5787 -7.5787 -0.5646 -0.5646 -0.5540 -0.5540 4.4717 4.4717 4.4769 4.4769 5.6030 5.6030 5.6299 5.6299 5.8939 5.8939 5.9047 5.9047 6.1654 6.1654 6.2922 6.2922 6.2965 6.2965 6.4033 6.4033 6.4306 6.4306 6.4467 6.4467 6.8781 6.8781 7.0257 7.0257 8.0146 8.0146 8.0431 8.0431 10.1215 10.1215 10.1563 10.1563 12.6886 12.6886 12.7004 12.7004 13.8929 13.8929 k = 0.2549 0.4415 0.2446 ( 4472 PWs) bands (ev): -25.8321 -25.8321 -25.8321 -25.8321 -8.7460 -8.7460 -8.7429 -8.7429 -7.6700 -7.6700 -7.6630 -7.6630 -7.5790 -7.5790 -7.5773 -7.5773 -0.5801 -0.5801 -0.5700 -0.5700 4.4796 4.4796 4.4845 4.4845 5.5990 5.5990 5.6247 5.6247 5.8908 5.8908 5.9013 5.9013 6.1757 6.1757 6.2915 6.2915 6.3221 6.3221 6.4144 6.4144 6.4470 6.4470 6.4496 6.4496 6.9237 6.9237 7.0671 7.0671 7.9924 7.9924 8.0209 8.0209 10.1363 10.1363 10.1690 10.1690 12.6254 12.6254 12.6356 12.6356 13.8340 13.8340 k = 0.2484 0.4302 0.2446 ( 4480 PWs) bands (ev): -25.8324 -25.8324 -25.8324 -25.8324 -8.7445 -8.7445 -8.7415 -8.7415 -7.6679 -7.6679 -7.6613 -7.6613 -7.5774 -7.5774 -7.5758 -7.5758 -0.5970 -0.5970 -0.5874 -0.5874 4.4893 4.4893 4.4939 4.4939 5.5958 5.5958 5.6197 5.6197 5.8854 5.8854 5.8962 5.8962 6.1835 6.1835 6.2899 6.2899 6.3527 6.3527 6.4209 6.4209 6.4479 6.4479 6.4768 6.4768 6.9721 6.9721 7.1111 7.1111 7.9686 7.9686 7.9972 7.9972 10.1540 10.1540 10.1847 10.1847 12.5630 12.5630 12.5717 12.5717 13.7597 13.7597 k = 0.2418 0.4189 0.2446 ( 4480 PWs) bands (ev): -25.8328 -25.8328 -25.8328 -25.8328 -8.7428 -8.7428 -8.7400 -8.7400 -7.6656 -7.6656 -7.6593 -7.6593 -7.5757 -7.5757 -7.5743 -7.5743 -0.6152 -0.6152 -0.6060 -0.6060 4.5010 4.5010 4.5052 4.5052 5.5932 5.5932 5.6147 5.6147 5.8782 5.8782 5.8899 5.8899 6.1895 6.1895 6.2879 6.2879 6.3859 6.3859 6.4253 6.4253 6.4507 6.4507 6.5093 6.5093 7.0230 7.0230 7.1574 7.1574 7.9437 7.9437 7.9725 7.9725 10.1748 10.1748 10.2033 10.2033 12.5016 12.5016 12.5090 12.5090 13.6794 13.6794 k = 0.2353 0.4075 0.2446 ( 4484 PWs) bands (ev): -25.8331 -25.8331 -25.8331 -25.8331 -8.7410 -8.7410 -8.7383 -8.7383 -7.6631 -7.6631 -7.6572 -7.6572 -7.5741 -7.5741 -7.5728 -7.5728 -0.6346 -0.6346 -0.6259 -0.6259 4.5145 4.5145 4.5182 4.5182 5.5910 5.5910 5.6097 5.6097 5.8697 5.8697 5.8828 5.8828 6.1944 6.1944 6.2857 6.2857 6.4157 6.4157 6.4288 6.4288 6.4605 6.4605 6.5455 6.5455 7.0758 7.0758 7.2052 7.2052 7.9181 7.9181 7.9472 7.9472 10.1988 10.1988 10.2252 10.2252 12.4417 12.4417 12.4478 12.4478 13.5962 13.5962 k = 0.2288 0.3962 0.2446 ( 4484 PWs) bands (ev): -25.8336 -25.8336 -25.8336 -25.8336 -8.7391 -8.7391 -8.7365 -8.7365 -7.6603 -7.6603 -7.6548 -7.6548 -7.5724 -7.5724 -7.5712 -7.5712 -0.6551 -0.6551 -0.6469 -0.6469 4.5298 4.5298 4.5331 4.5331 5.5889 5.5889 5.6044 5.6044 5.8603 5.8603 5.8752 5.8752 6.1987 6.1987 6.2834 6.2834 6.4304 6.4304 6.4316 6.4316 6.4887 6.4887 6.5848 6.5848 7.1298 7.1298 7.2538 7.2538 7.8924 7.8924 7.9222 7.9222 10.2260 10.2260 10.2504 10.2504 12.3832 12.3832 12.3882 12.3882 13.5115 13.5115 k = 0.2222 0.3849 0.2446 ( 4490 PWs) bands (ev): -25.8340 -25.8340 -25.8340 -25.8340 -8.7370 -8.7370 -8.7346 -8.7346 -7.6574 -7.6574 -7.6522 -7.6522 -7.5707 -7.5707 -7.5696 -7.5696 -0.6767 -0.6767 -0.6689 -0.6689 4.5469 4.5469 4.5497 4.5497 5.5869 5.5869 5.5987 5.5987 5.8503 5.8503 5.8673 5.8673 6.2027 6.2027 6.2811 6.2811 6.4339 6.4339 6.4344 6.4344 6.5303 6.5303 6.6270 6.6270 7.1840 7.1840 7.3021 7.3021 7.8676 7.8676 7.8986 7.8986 10.2566 10.2566 10.2789 10.2789 12.3265 12.3265 12.3304 12.3304 13.4263 13.4263 k = 0.2157 0.3736 0.2446 ( 4478 PWs) bands (ev): -25.8345 -25.8345 -25.8345 -25.8345 -8.7348 -8.7348 -8.7325 -8.7325 -7.6543 -7.6543 -7.6494 -7.6494 -7.5689 -7.5689 -7.5680 -7.5680 -0.6992 -0.6992 -0.6919 -0.6919 4.5658 4.5658 4.5679 4.5679 5.5845 5.5845 5.5925 5.5925 5.8401 5.8401 5.8593 5.8593 6.2067 6.2067 6.2790 6.2790 6.4354 6.4354 6.4358 6.4358 6.5776 6.5776 6.6721 6.6721 7.2371 7.2371 7.3484 7.3484 7.8450 7.8450 7.8780 7.8780 10.2905 10.2905 10.3107 10.3107 12.2717 12.2717 12.2745 12.2745 13.3413 13.3413 k = 0.2092 0.3623 0.2446 ( 4480 PWs) bands (ev): -25.8349 -25.8349 -25.8349 -25.8349 -8.7325 -8.7325 -8.7304 -8.7304 -7.6510 -7.6510 -7.6464 -7.6464 -7.5671 -7.5671 -7.5663 -7.5663 -0.7225 -0.7225 -0.7157 -0.7157 4.5862 4.5862 4.5877 4.5877 5.5817 5.5817 5.5855 5.5855 5.8300 5.8300 5.8515 5.8515 6.2107 6.2107 6.2770 6.2770 6.4354 6.4354 6.4373 6.4373 6.6285 6.6285 6.7198 6.7198 7.2871 7.2871 7.3902 7.3902 7.8266 7.8266 7.8628 7.8628 10.3278 10.3278 10.3460 10.3460 12.2189 12.2189 12.2206 12.2206 13.2568 13.2568 k = 0.2026 0.3509 0.2446 ( 4476 PWs) bands (ev): -25.8354 -25.8354 -25.8354 -25.8354 -8.7301 -8.7301 -8.7281 -8.7281 -7.6475 -7.6475 -7.6433 -7.6433 -7.5653 -7.5653 -7.5645 -7.5645 -0.7466 -0.7466 -0.7403 -0.7403 4.6080 4.6080 4.6089 4.6089 5.5778 5.5778 5.5781 5.5781 5.8203 5.8203 5.8438 5.8438 6.2147 6.2147 6.2752 6.2752 6.4348 6.4348 6.4384 6.4384 6.6824 6.6824 6.7703 6.7703 7.3313 7.3313 7.4243 7.4243 7.8149 7.8149 7.8565 7.8565 10.3684 10.3684 10.3847 10.3847 12.1681 12.1681 12.1689 12.1689 13.1733 13.1733 k = 0.1961 0.3396 0.2446 ( 4484 PWs) bands (ev): -25.8360 -25.8360 -25.8360 -25.8360 -8.7277 -8.7277 -8.7258 -8.7258 -7.6440 -7.6440 -7.6400 -7.6400 -7.5633 -7.5633 -7.5627 -7.5627 -0.7713 -0.7713 -0.7655 -0.7655 4.6312 4.6312 4.6314 4.6314 5.5693 5.5693 5.5736 5.5736 5.8110 5.8110 5.8364 5.8364 6.2188 6.2188 6.2735 6.2735 6.4338 6.4338 6.4392 6.4392 6.7391 6.7391 6.8234 6.8234 7.3664 7.3664 7.4472 7.4472 7.8136 7.8136 7.8625 7.8625 10.4123 10.4123 10.4266 10.4266 12.1195 12.1195 12.1196 12.1196 13.0910 13.0910 k = 0.1895 0.3283 0.2446 ( 4478 PWs) bands (ev): -25.8365 -25.8365 -25.8365 -25.8365 -8.7251 -8.7251 -8.7233 -8.7233 -7.6403 -7.6403 -7.6367 -7.6367 -7.5613 -7.5613 -7.5608 -7.5608 -0.7966 -0.7966 -0.7912 -0.7912 4.6552 4.6552 4.6556 4.6556 5.5600 5.5600 5.5681 5.5681 5.8025 5.8025 5.8293 5.8293 6.2230 6.2230 6.2720 6.2720 6.4327 6.4327 6.4396 6.4396 6.7987 6.7987 6.8792 6.8792 7.3891 7.3891 7.4565 7.4565 7.8260 7.8260 7.8833 7.8833 10.4593 10.4593 10.4719 10.4719 12.0724 12.0724 12.0733 12.0733 13.0101 13.0101 k = 0.1830 0.3170 0.2446 ( 4488 PWs) bands (ev): -25.8371 -25.8371 -25.8371 -25.8371 -8.7225 -8.7225 -8.7208 -8.7208 -7.6366 -7.6366 -7.6333 -7.6333 -7.5592 -7.5592 -7.5587 -7.5587 -0.8222 -0.8222 -0.8173 -0.8173 4.6799 4.6799 4.6811 4.6811 5.5498 5.5498 5.5614 5.5614 5.7948 5.7948 5.8225 5.8225 6.2273 6.2273 6.2706 6.2706 6.4312 6.4312 6.4396 6.4396 6.8609 6.8609 6.9373 6.9373 7.3981 7.3981 7.4527 7.4527 7.8536 7.8536 7.9184 7.9184 10.5095 10.5095 10.5203 10.5203 12.0277 12.0277 12.0294 12.0294 12.9308 12.9308 k = 0.1765 0.3057 0.2446 ( 4488 PWs) bands (ev): -25.8376 -25.8376 -25.8376 -25.8376 -8.7198 -8.7198 -8.7183 -8.7183 -7.6329 -7.6329 -7.6299 -7.6299 -7.5569 -7.5569 -7.5566 -7.5566 -0.8482 -0.8482 -0.8437 -0.8437 4.7056 4.7056 4.7075 4.7075 5.5390 5.5390 5.5536 5.5536 5.7879 5.7879 5.8161 5.8161 6.2315 6.2315 6.2695 6.2695 6.4296 6.4296 6.4394 6.4394 6.9256 6.9256 6.9975 6.9975 7.3952 7.3952 7.4390 7.4390 7.8951 7.8951 7.9652 7.9652 10.5627 10.5627 10.5718 10.5718 11.9856 11.9856 11.9881 11.9881 12.8533 12.8533 k = 0.1699 0.2943 0.2446 ( 4496 PWs) bands (ev): -25.8382 -25.8382 -25.8382 -25.8382 -8.7170 -8.7170 -8.7157 -8.7157 -7.6292 -7.6292 -7.6265 -7.6265 -7.5545 -7.5545 -7.5542 -7.5542 -0.8743 -0.8743 -0.8702 -0.8702 4.7320 4.7320 4.7346 4.7346 5.5275 5.5275 5.5446 5.5446 5.7817 5.7817 5.8098 5.8098 6.2357 6.2357 6.2685 6.2685 6.4279 6.4279 6.4388 6.4388 6.9923 6.9923 7.0588 7.0588 7.3846 7.3846 7.4188 7.4188 7.9473 7.9473 8.0205 8.0205 10.6187 10.6187 10.6263 10.6263 11.9462 11.9462 11.9493 11.9493 12.7777 12.7777 k = 0.1634 0.2830 0.2446 ( 4492 PWs) bands (ev): -25.8388 -25.8388 -25.8388 -25.8388 -8.7143 -8.7143 -8.7131 -8.7131 -7.6255 -7.6255 -7.6231 -7.6231 -7.5519 -7.5519 -7.5517 -7.5517 -0.9005 -0.9005 -0.8969 -0.8969 4.7590 4.7590 4.7624 4.7624 5.5155 5.5155 5.5346 5.5346 5.7763 5.7763 5.8038 5.8038 6.2398 6.2398 6.2676 6.2676 6.4259 6.4259 6.4380 6.4380 7.0598 7.0598 7.1188 7.1188 7.3717 7.3717 7.3961 7.3961 8.0073 8.0073 8.0816 8.0816 10.6774 10.6774 10.6834 10.6834 11.9095 11.9095 11.9132 11.9132 12.7040 12.7040 k = 0.1569 0.2717 0.2446 ( 4502 PWs) bands (ev): -25.8394 -25.8394 -25.8394 -25.8394 -8.7115 -8.7115 -8.7104 -8.7104 -7.6220 -7.6220 -7.6199 -7.6199 -7.5492 -7.5492 -7.5490 -7.5490 -0.9267 -0.9267 -0.9234 -0.9234 4.7865 4.7865 4.7906 4.7906 5.5031 5.5031 5.5236 5.5236 5.7713 5.7713 5.7979 5.7979 6.2437 6.2437 6.2669 6.2669 6.4239 6.4239 6.4368 6.4368 7.1251 7.1251 7.1711 7.1711 7.3654 7.3654 7.3757 7.3757 8.0725 8.0725 8.1467 8.1467 10.7385 10.7385 10.7431 10.7431 11.8758 11.8758 11.8799 11.8799 12.6323 12.6323 k = 0.1503 0.2604 0.2446 ( 4506 PWs) bands (ev): -25.8400 -25.8400 -25.8400 -25.8400 -8.7088 -8.7088 -8.7078 -8.7078 -7.6186 -7.6186 -7.6168 -7.6168 -7.5462 -7.5462 -7.5461 -7.5461 -0.9528 -0.9528 -0.9498 -0.9498 4.8143 4.8143 4.8192 4.8192 5.4903 5.4903 5.5119 5.5119 5.7668 5.7668 5.7920 5.7920 6.2474 6.2474 6.2663 6.2663 6.4217 6.4217 6.4354 6.4354 7.1797 7.1797 7.2019 7.2019 7.3674 7.3674 7.3813 7.3813 8.1411 8.1411 8.2145 8.2145 10.8018 10.8018 10.8051 10.8051 11.8451 11.8451 11.8497 11.8497 12.5627 12.5627 k = 0.1438 0.2491 0.2446 ( 4506 PWs) bands (ev): -25.8406 -25.8406 -25.8406 -25.8406 -8.7061 -8.7061 -8.7052 -8.7052 -7.6154 -7.6154 -7.6138 -7.6138 -7.5429 -7.5429 -7.5429 -7.5429 -0.9785 -0.9785 -0.9759 -0.9759 4.8423 4.8423 4.8479 4.8479 5.4774 5.4774 5.4997 5.4997 5.7626 5.7626 5.7862 5.7862 6.2509 6.2509 6.2657 6.2657 6.4195 6.4195 6.4337 6.4337 7.2033 7.2033 7.2060 7.2060 7.3898 7.3898 7.4285 7.4285 8.2119 8.2119 8.2839 8.2839 10.8669 10.8669 10.8689 10.8689 11.8177 11.8177 11.8225 11.8225 12.4953 12.4953 k = 0.1373 0.2377 0.2446 ( 4508 PWs) bands (ev): -25.8411 -25.8411 -25.8411 -25.8411 -8.7034 -8.7034 -8.7026 -8.7026 -7.6124 -7.6124 -7.6111 -7.6111 -7.5395 -7.5395 -7.5395 -7.5395 -1.0039 -1.0039 -1.0016 -1.0016 4.8704 4.8704 4.8767 4.8767 5.4644 5.4644 5.4870 5.4870 5.7584 5.7584 5.7802 5.7802 6.2540 6.2540 6.2653 6.2653 6.4173 6.4173 6.4318 6.4318 7.1864 7.1864 7.2000 7.2000 7.4473 7.4473 7.4965 7.4965 8.2841 8.2841 8.3542 8.3542 10.9334 10.9334 10.9341 10.9341 11.7938 11.7938 11.7986 11.7986 12.4301 12.4301 k = 0.1307 0.2264 0.2446 ( 4500 PWs) bands (ev): -25.8417 -25.8417 -25.8417 -25.8417 -8.7007 -8.7007 -8.7000 -8.7000 -7.6096 -7.6096 -7.6085 -7.6085 -7.5359 -7.5359 -7.5358 -7.5358 -1.0289 -1.0289 -1.0269 -1.0269 4.8985 4.8985 4.9053 4.9053 5.4515 5.4515 5.4741 5.4741 5.7543 5.7543 5.7742 5.7742 6.2569 6.2569 6.2649 6.2649 6.4150 6.4150 6.4297 6.4297 7.1620 7.1620 7.1781 7.1781 7.5240 7.5240 7.5752 7.5752 8.3570 8.3570 8.4250 8.4250 11.0002 11.0002 11.0008 11.0008 11.7734 11.7734 11.7782 11.7782 12.3671 12.3671 k = 0.1242 0.2151 0.2446 ( 4498 PWs) bands (ev): -25.8423 -25.8423 -25.8423 -25.8423 -8.6981 -8.6981 -8.6975 -8.6975 -7.6071 -7.6071 -7.6062 -7.6062 -7.5320 -7.5320 -7.5319 -7.5319 -1.0533 -1.0533 -1.0515 -1.0515 4.9263 4.9263 4.9337 4.9337 5.4387 5.4387 5.4611 5.4611 5.7500 5.7500 5.7681 5.7681 6.2593 6.2593 6.2646 6.2646 6.4128 6.4128 6.4274 6.4274 7.1347 7.1347 7.1506 7.1506 7.6099 7.6099 7.6603 7.6603 8.4299 8.4299 8.4957 8.4957 11.0663 11.0663 11.0682 11.0682 11.7569 11.7569 11.7615 11.7615 12.3068 12.3068 k = 0.1176 0.2038 0.2446 ( 4498 PWs) bands (ev): -25.8429 -25.8429 -25.8429 -25.8429 -8.6956 -8.6956 -8.6951 -8.6951 -7.6049 -7.6049 -7.6041 -7.6041 -7.5280 -7.5280 -7.5278 -7.5278 -1.0770 -1.0770 -1.0755 -1.0755 4.9538 4.9538 4.9618 4.9618 5.4262 5.4262 5.4482 5.4482 5.7455 5.7455 5.7617 5.7617 6.2614 6.2614 6.2643 6.2643 6.4106 6.4106 6.4249 6.4249 7.1065 7.1065 7.1213 7.1213 7.7013 7.7013 7.7499 7.7499 8.5025 8.5025 8.5658 8.5658 11.1316 11.1316 11.1348 11.1348 11.7444 11.7444 11.7485 11.7485 12.2493 12.2493 k = 0.1111 0.1925 0.2446 ( 4494 PWs) bands (ev): -25.8434 -25.8434 -25.8434 -25.8434 -8.6932 -8.6932 -8.6928 -8.6928 -7.6029 -7.6029 -7.6022 -7.6022 -7.5238 -7.5238 -7.5236 -7.5236 -1.1000 -1.1000 -1.0987 -1.0987 4.9809 4.9809 4.9893 4.9893 5.4140 5.4140 5.4354 5.4354 5.7407 5.7407 5.7551 5.7551 6.2630 6.2630 6.2640 6.2640 6.4084 6.4084 6.4222 6.4222 7.0783 7.0783 7.0917 7.0917 7.7968 7.7968 7.8432 7.8432 8.5743 8.5743 8.6350 8.6350 11.1946 11.1946 11.1993 11.1993 11.7358 11.7358 11.7392 11.7392 12.1956 12.1956 k = 0.1046 0.1811 0.2446 ( 4498 PWs) bands (ev): -25.8440 -25.8440 -25.8440 -25.8440 -8.6909 -8.6909 -8.6905 -8.6905 -7.6011 -7.6011 -7.6006 -7.6006 -7.5195 -7.5195 -7.5193 -7.5193 -1.1222 -1.1222 -1.1211 -1.1211 5.0074 5.0074 5.0161 5.0161 5.4023 5.4023 5.4230 5.4230 5.7356 5.7356 5.7482 5.7482 6.2638 6.2638 6.2643 6.2643 6.4064 6.4064 6.4195 6.4195 7.0507 7.0507 7.0626 7.0626 7.8956 7.8956 7.9397 7.9397 8.6448 8.6448 8.7027 8.7027 11.2538 11.2538 11.2600 11.2600 11.7305 11.7305 11.7331 11.7331 12.1471 12.1471 k = 0.0980 0.1698 0.2446 ( 4506 PWs) bands (ev): -25.8445 -25.8445 -25.8445 -25.8445 -8.6887 -8.6887 -8.6883 -8.6883 -7.5995 -7.5995 -7.5991 -7.5991 -7.5151 -7.5151 -7.5149 -7.5149 -1.1434 -1.1434 -1.1425 -1.1425 5.0331 5.0331 5.0422 5.0422 5.3912 5.3912 5.4110 5.4110 5.7301 5.7301 5.7411 5.7411 6.2636 6.2636 6.2652 6.2652 6.4044 6.4044 6.4166 6.4166 7.0241 7.0241 7.0345 7.0345 7.9971 7.9971 8.0389 8.0389 8.7136 8.7136 8.7688 8.7688 11.3073 11.3073 11.3150 11.3150 11.7270 11.7270 11.7288 11.7288 12.1064 12.1064 k = 0.0915 0.1585 0.2446 ( 4502 PWs) bands (ev): -25.8450 -25.8450 -25.8450 -25.8450 -8.6865 -8.6865 -8.6863 -8.6863 -7.5982 -7.5982 -7.5979 -7.5979 -7.5107 -7.5107 -7.5106 -7.5106 -1.1637 -1.1637 -1.1630 -1.1630 5.0581 5.0581 5.0672 5.0672 5.3810 5.3810 5.3996 5.3996 5.7243 5.7243 5.7338 5.7338 6.2634 6.2634 6.2658 6.2658 6.4026 6.4026 6.4137 6.4137 6.9987 6.9987 7.0077 7.0077 8.1009 8.1009 8.1404 8.1404 8.7805 8.7805 8.8326 8.8326 11.3527 11.3527 11.3620 11.3620 11.7227 11.7227 11.7239 11.7239 12.0775 12.0775 k = 0.0850 0.1472 0.2446 ( 4502 PWs) bands (ev): -25.8455 -25.8455 -25.8455 -25.8455 -8.6845 -8.6845 -8.6843 -8.6843 -7.5970 -7.5970 -7.5968 -7.5968 -7.5064 -7.5064 -7.5062 -7.5062 -1.1829 -1.1829 -1.1823 -1.1823 5.0819 5.0819 5.0911 5.0911 5.3715 5.3715 5.3889 5.3889 5.7182 5.7182 5.7262 5.7262 6.2633 6.2633 6.2660 6.2660 6.4009 6.4009 6.4107 6.4107 6.9747 6.9747 6.9823 6.9823 8.2067 8.2067 8.2438 8.2438 8.8449 8.8449 8.8940 8.8940 11.3877 11.3877 11.3983 11.3983 11.7140 11.7140 11.7150 11.7150 12.0653 12.0653 k = 0.0784 0.1358 0.2446 ( 4508 PWs) bands (ev): -25.8459 -25.8459 -25.8459 -25.8459 -8.6827 -8.6827 -8.6825 -8.6825 -7.5960 -7.5960 -7.5958 -7.5958 -7.5021 -7.5021 -7.5020 -7.5020 -1.2010 -1.2010 -1.2005 -1.2005 5.1046 5.1046 5.1136 5.1136 5.3630 5.3630 5.3790 5.3790 5.7118 5.7118 5.7185 5.7185 6.2632 6.2632 6.2661 6.2661 6.3992 6.3992 6.4078 6.4078 6.9522 6.9522 6.9584 6.9584 8.3139 8.3139 8.3487 8.3487 8.9065 8.9065 8.9524 8.9524 11.4089 11.4089 11.4204 11.4204 11.7002 11.7002 11.7015 11.7015 12.0724 12.0724 k = 0.0719 0.1245 0.2446 ( 4500 PWs) bands (ev): -25.8464 -25.8464 -25.8464 -25.8464 -8.6809 -8.6809 -8.6808 -8.6808 -7.5951 -7.5951 -7.5950 -7.5950 -7.4980 -7.4980 -7.4979 -7.4979 -1.2179 -1.2179 -1.2175 -1.2175 5.1260 5.1260 5.1345 5.1345 5.3557 5.3557 5.3702 5.3702 5.7052 5.7052 5.7107 5.7107 6.2632 6.2632 6.2659 6.2659 6.3977 6.3977 6.4050 6.4050 6.9313 6.9313 6.9363 6.9363 8.4220 8.4220 8.4545 8.4545 8.9649 8.9649 9.0075 9.0075 11.4122 11.4122 11.4238 11.4238 11.6860 11.6860 11.6878 11.6878 12.0950 12.0950 k = 0.0654 0.1132 0.2446 ( 4512 PWs) bands (ev): -25.8468 -25.8468 -25.8468 -25.8468 -8.6794 -8.6794 -8.6793 -8.6793 -7.5944 -7.5944 -7.5943 -7.5943 -7.4940 -7.4940 -7.4939 -7.4939 -1.2335 -1.2335 -1.2332 -1.2332 5.1456 5.1456 5.1536 5.1536 5.3497 5.3497 5.3625 5.3625 5.6983 5.6983 5.7027 5.7027 6.2631 6.2631 6.2656 6.2656 6.3963 6.3963 6.4022 6.4022 6.9120 6.9120 6.9160 6.9160 8.5304 8.5304 8.5606 8.5606 9.0198 9.0198 9.0589 9.0589 11.3934 11.3934 11.4040 11.4040 11.6792 11.6792 11.6817 11.6817 12.1301 12.1301 k = 0.0588 0.1019 0.2446 ( 4508 PWs) bands (ev): -25.8471 -25.8471 -25.8471 -25.8471 -8.6779 -8.6779 -8.6778 -8.6778 -7.5937 -7.5937 -7.5937 -7.5937 -7.4903 -7.4903 -7.4903 -7.4903 -1.2478 -1.2478 -1.2476 -1.2476 5.1634 5.1634 5.1706 5.1706 5.3452 5.3452 5.3562 5.3562 5.6914 5.6914 5.6949 5.6949 6.2632 6.2632 6.2653 6.2653 6.3950 6.3950 6.3997 6.3997 6.8945 6.8945 6.8975 6.8975 8.6383 8.6383 8.6662 8.6662 9.0708 9.0708 9.1063 9.1063 11.3527 11.3527 11.3618 11.3618 11.6838 11.6838 11.6870 11.6870 12.1722 12.1722 k = 0.0523 0.0906 0.2446 ( 4504 PWs) bands (ev): -25.8474 -25.8474 -25.8474 -25.8474 -8.6766 -8.6766 -8.6765 -8.6765 -7.5932 -7.5932 -7.5931 -7.5931 -7.4869 -7.4869 -7.4868 -7.4868 -1.2608 -1.2608 -1.2606 -1.2606 5.1792 5.1792 5.1852 5.1852 5.3424 5.3424 5.3514 5.3514 5.6845 5.6845 5.6872 5.6872 6.2632 6.2632 6.2649 6.2649 6.3937 6.3937 6.3973 6.3973 6.8787 6.8787 6.8809 6.8809 8.7448 8.7448 8.7703 8.7703 9.1176 9.1176 9.1493 9.1493 11.2955 11.2955 11.3029 11.3029 11.6984 11.6984 11.7018 11.7018 12.2159 12.2159 k = 0.0458 0.0792 0.2446 ( 4516 PWs) bands (ev): -25.8477 -25.8477 -25.8477 -25.8477 -8.6754 -8.6754 -8.6754 -8.6754 -7.5928 -7.5928 -7.5927 -7.5927 -7.4837 -7.4837 -7.4837 -7.4837 -1.2723 -1.2723 -1.2722 -1.2722 5.1925 5.1925 5.1973 5.1973 5.3413 5.3413 5.3482 5.3482 5.6778 5.6778 5.6797 5.6797 6.2632 6.2632 6.2645 6.2645 6.3925 6.3925 6.3951 6.3951 6.8647 6.8647 6.8662 6.8662 8.8486 8.8486 8.8715 8.8715 9.1599 9.1599 9.1878 9.1878 11.2281 11.2281 11.2338 11.2338 11.7197 11.7197 11.7228 11.7228 12.2570 12.2570 k = 0.0392 0.0679 0.2446 ( 4524 PWs) bands (ev): -25.8480 -25.8480 -25.8480 -25.8480 -8.6744 -8.6744 -8.6744 -8.6744 -7.5924 -7.5924 -7.5924 -7.5924 -7.4810 -7.4810 -7.4809 -7.4809 -1.2824 -1.2824 -1.2823 -1.2823 5.2034 5.2034 5.2069 5.2069 5.3418 5.3418 5.3467 5.3467 5.6714 5.6714 5.6727 5.6727 6.2632 6.2632 6.2641 6.2641 6.3914 6.3914 6.3931 6.3931 6.8525 6.8525 6.8535 6.8535 8.9480 8.9480 8.9682 8.9682 9.1976 9.1976 9.2215 9.2215 11.1557 11.1557 11.1599 11.1599 11.7448 11.7448 11.7474 11.7474 12.2921 12.2921 k = 0.0327 0.0566 0.2446 ( 4520 PWs) bands (ev): -25.8482 -25.8482 -25.8482 -25.8482 -8.6736 -8.6736 -8.6736 -8.6736 -7.5921 -7.5921 -7.5921 -7.5921 -7.4786 -7.4786 -7.4786 -7.4786 -1.2910 -1.2910 -1.2909 -1.2909 5.2118 5.2118 5.2140 5.2140 5.3436 5.3436 5.3467 5.3467 5.6655 5.6655 5.6663 5.6663 6.2632 6.2632 6.2637 6.2637 6.3904 6.3904 6.3915 6.3915 6.8421 6.8421 6.8427 6.8427 9.0409 9.0409 9.0582 9.0582 9.2305 9.2305 9.2503 9.2503 11.0828 11.0828 11.0856 11.0856 11.7717 11.7717 11.7737 11.7737 12.3188 12.3188 k = 0.0261 0.0453 0.2446 ( 4524 PWs) bands (ev): -25.8484 -25.8484 -25.8484 -25.8484 -8.6729 -8.6729 -8.6729 -8.6729 -7.5919 -7.5919 -7.5919 -7.5919 -7.4766 -7.4766 -7.4766 -7.4766 -1.2980 -1.2980 -1.2980 -1.2980 5.2178 5.2178 5.2190 5.2190 5.3462 5.3462 5.3479 5.3479 5.6603 5.6603 5.6607 5.6607 6.2632 6.2632 6.2635 6.2635 6.3896 6.3896 6.3901 6.3901 6.8336 6.8336 6.8339 6.8339 9.1244 9.1244 9.1384 9.1384 9.2587 9.2587 9.2742 9.2742 11.0138 11.0138 11.0154 11.0154 11.7984 11.7984 11.7997 11.7997 12.3360 12.3360 k = 0.0196 0.0340 0.2446 ( 4528 PWs) bands (ev): -25.8486 -25.8486 -25.8486 -25.8486 -8.6723 -8.6723 -8.6723 -8.6723 -7.5917 -7.5917 -7.5917 -7.5917 -7.4750 -7.4750 -7.4750 -7.4750 -1.3036 -1.3036 -1.3036 -1.3036 5.2219 5.2219 5.2224 5.2224 5.3490 5.3490 5.3497 5.3497 5.6559 5.6559 5.6561 5.6561 6.2632 6.2632 6.2633 6.2633 6.3888 6.3888 6.3891 6.3891 6.8269 6.8269 6.8271 6.8271 9.1949 9.1949 9.2049 9.2049 9.2829 9.2829 9.2935 9.2935 10.9529 10.9529 10.9537 10.9537 11.8227 11.8227 11.8234 11.8234 12.3446 12.3446 k = 0.0131 0.0226 0.2446 ( 4532 PWs) bands (ev): -25.8487 -25.8487 -25.8487 -25.8487 -8.6719 -8.6719 -8.6719 -8.6719 -7.5916 -7.5916 -7.5916 -7.5916 -7.4738 -7.4738 -7.4738 -7.4738 -1.3075 -1.3075 -1.3075 -1.3075 5.2244 5.2244 5.2246 5.2246 5.3513 5.3513 5.3516 5.3516 5.6526 5.6526 5.6526 5.6526 6.2631 6.2631 6.2632 6.2632 6.3883 6.3883 6.3883 6.3883 6.8222 6.8222 6.8222 6.8222 9.2474 9.2474 9.2523 9.2523 9.3043 9.3043 9.3094 9.3094 10.9047 10.9047 10.9050 10.9050 11.8425 11.8425 11.8427 11.8427 12.3467 12.3467 k = 0.0065 0.0113 0.2446 ( 4530 PWs) bands (ev): -25.8487 -25.8487 -25.8487 -25.8487 -8.6717 -8.6717 -8.6717 -8.6717 -7.5915 -7.5915 -7.5915 -7.5915 -7.4732 -7.4732 -7.4732 -7.4732 -1.3099 -1.3099 -1.3099 -1.3099 5.2257 5.2257 5.2257 5.2257 5.3529 5.3529 5.3530 5.3530 5.6505 5.6505 5.6505 5.6505 6.2631 6.2631 6.2631 6.2631 6.3879 6.3879 6.3879 6.3879 6.8193 6.8193 6.8193 6.8193 9.2770 9.2770 9.2778 9.2778 9.3220 9.3220 9.3229 9.3229 10.8736 10.8736 10.8737 10.8737 11.8554 11.8554 11.8554 11.8554 12.3455 12.3455 k = 0.0000 0.0000 0.2446 ( 4522 PWs) bands (ev): -25.8487 -25.8487 -25.8487 -25.8487 -8.6716 -8.6716 -8.6716 -8.6716 -7.5915 -7.5915 -7.5915 -7.5915 -7.4729 -7.4729 -7.4729 -7.4729 -1.3107 -1.3107 -1.3107 -1.3107 5.2261 5.2261 5.2261 5.2261 5.3535 5.3535 5.3535 5.3535 5.6498 5.6498 5.6498 5.6498 6.2632 6.2632 6.2632 6.2632 6.3879 6.3879 6.3879 6.3879 6.8183 6.8183 6.8183 6.8183 9.2854 9.2854 9.2854 9.2854 9.3292 9.3292 9.3292 9.3292 10.8628 10.8628 10.8628 10.8628 11.8599 11.8599 11.8599 11.8599 12.3444 12.3444 k = 0.5000 0.2887 0.2446 ( 4468 PWs) bands (ev): -25.8323 -25.8323 -25.8323 -25.8323 -8.7476 -8.7476 -8.7476 -8.7476 -7.6865 -7.6865 -7.6865 -7.6865 -7.5485 -7.5485 -7.5485 -7.5485 -0.5826 -0.5826 -0.5826 -0.5826 4.2522 4.2522 4.2522 4.2522 5.7182 5.7182 5.7182 5.7182 5.8789 5.8789 5.8789 5.8789 6.2564 6.2564 6.2564 6.2564 6.3848 6.3848 6.3848 6.3848 6.4532 6.4532 6.4532 6.4532 7.5450 7.5450 7.5450 7.5450 8.0040 8.0040 8.0040 8.0040 9.8544 9.8544 9.8544 9.8544 11.4398 11.4398 11.4398 11.4398 14.4424 14.4424 k = 0.5000 0.2887 0.2317 ( 4472 PWs) bands (ev): -25.8326 -25.8326 -25.8321 -25.8321 -8.7483 -8.7483 -8.7470 -8.7470 -7.6870 -7.6870 -7.6862 -7.6862 -7.5513 -7.5513 -7.5456 -7.5456 -0.5950 -0.5950 -0.5702 -0.5702 4.2197 4.2197 4.2852 4.2852 5.7052 5.7052 5.7310 5.7310 5.8768 5.8768 5.8810 5.8810 6.2531 6.2531 6.2597 6.2597 6.3804 6.3804 6.3890 6.3890 6.4499 6.4499 6.4566 6.4566 7.5222 7.5222 7.5680 7.5680 8.0011 8.0011 8.0054 8.0054 9.8241 9.8241 9.8830 9.8830 11.4317 11.4317 11.4571 11.4571 14.3687 14.3687 k = 0.5000 0.2887 0.2188 ( 4476 PWs) bands (ev): -25.8328 -25.8328 -25.8318 -25.8318 -8.7490 -8.7490 -8.7463 -8.7463 -7.6875 -7.6875 -7.6860 -7.6860 -7.5539 -7.5539 -7.5426 -7.5426 -0.6072 -0.6072 -0.5579 -0.5579 4.1880 4.1880 4.3186 4.3186 5.6921 5.6921 5.7436 5.7436 5.8748 5.8748 5.8831 5.8831 6.2497 6.2497 6.2629 6.2629 6.3758 6.3758 6.3928 6.3928 6.4468 6.4468 6.4602 6.4602 7.4997 7.4997 7.5910 7.5910 7.9968 7.9968 8.0055 8.0055 9.7931 9.7931 9.9091 9.9091 11.4336 11.4336 11.4826 11.4826 14.2977 14.2977 k = 0.5000 0.2887 0.2060 ( 4484 PWs) bands (ev): -25.8331 -25.8331 -25.8315 -25.8315 -8.7497 -8.7497 -8.7457 -8.7457 -7.6880 -7.6880 -7.6858 -7.6858 -7.5564 -7.5564 -7.5395 -7.5395 -0.6192 -0.6192 -0.5457 -0.5457 4.1572 4.1572 4.3522 4.3522 5.6790 5.6790 5.7559 5.7559 5.8729 5.8729 5.8853 5.8853 6.2462 6.2462 6.2660 6.2660 6.3710 6.3710 6.3962 6.3962 6.4440 6.4440 6.4638 6.4638 7.4777 7.4777 7.6139 7.6139 7.9909 7.9909 8.0045 8.0045 9.7621 9.7621 9.9320 9.9320 11.4462 11.4462 11.5153 11.5153 14.2295 14.2295 k = 0.5000 0.2887 0.1931 ( 4490 PWs) bands (ev): -25.8333 -25.8333 -25.8313 -25.8313 -8.7504 -8.7504 -8.7452 -8.7452 -7.6887 -7.6887 -7.6858 -7.6858 -7.5587 -7.5587 -7.5363 -7.5363 -0.6310 -0.6310 -0.5338 -0.5338 4.1275 4.1275 4.3858 4.3858 5.6659 5.6659 5.7680 5.7680 5.8710 5.8710 5.8877 5.8877 6.2427 6.2427 6.2690 6.2690 6.3662 6.3662 6.3991 6.3991 6.4416 6.4416 6.4674 6.4674 7.4563 7.4563 7.6365 7.6365 7.9835 7.9835 8.0024 8.0024 9.7320 9.7320 9.9512 9.9512 11.4700 11.4700 11.5540 11.5540 14.1645 14.1645 k = 0.5000 0.2887 0.1802 ( 4486 PWs) bands (ev): -25.8336 -25.8336 -25.8310 -25.8310 -8.7511 -8.7511 -8.7446 -8.7446 -7.6894 -7.6894 -7.6858 -7.6858 -7.5607 -7.5607 -7.5332 -7.5332 -0.6424 -0.6424 -0.5221 -0.5221 4.0989 4.0989 4.4191 4.4191 5.6529 5.6529 5.7796 5.7796 5.8692 5.8692 5.8901 5.8901 6.2392 6.2392 6.2720 6.2720 6.3615 6.3615 6.4014 6.4014 6.4398 6.4398 6.4711 6.4711 7.4357 7.4357 7.6587 7.6587 7.9748 7.9748 7.9994 7.9994 9.7033 9.7033 9.9663 9.9663 11.5049 11.5049 11.5978 11.5978 14.1026 14.1026 k = 0.5000 0.2887 0.1673 ( 4480 PWs) bands (ev): -25.8338 -25.8338 -25.8308 -25.8308 -8.7518 -8.7518 -8.7441 -8.7441 -7.6901 -7.6901 -7.6859 -7.6859 -7.5626 -7.5626 -7.5301 -7.5301 -0.6534 -0.6534 -0.5108 -0.5108 4.0717 4.0717 4.4520 4.4520 5.6400 5.6400 5.7908 5.7908 5.8674 5.8674 5.8926 5.8926 6.2358 6.2358 6.2749 6.2749 6.3567 6.3567 6.4030 6.4030 6.4386 6.4386 6.4747 6.4747 7.4159 7.4159 7.6804 7.6804 7.9648 7.9648 7.9957 7.9957 9.6765 9.6765 9.9774 9.9774 11.5509 11.5509 11.6456 11.6456 14.0441 14.0441 k = 0.5000 0.2887 0.1545 ( 4468 PWs) bands (ev): -25.8340 -25.8340 -25.8306 -25.8306 -8.7524 -8.7524 -8.7437 -8.7437 -7.6909 -7.6909 -7.6861 -7.6861 -7.5643 -7.5643 -7.5270 -7.5270 -0.6639 -0.6639 -0.5000 -0.5000 4.0460 4.0460 4.4842 4.4842 5.6273 5.6273 5.8013 5.8013 5.8657 5.8657 5.8954 5.8954 6.2324 6.2324 6.2776 6.2776 6.3522 6.3522 6.4038 6.4038 6.4381 6.4381 6.4782 6.4782 7.3971 7.3971 7.7012 7.7012 7.9538 7.9538 7.9915 7.9915 9.6519 9.6519 9.9846 9.9846 11.6072 11.6072 11.6965 11.6965 13.9891 13.9891 k = 0.5000 0.2887 0.1416 ( 4462 PWs) bands (ev): -25.8342 -25.8342 -25.8304 -25.8304 -8.7531 -8.7531 -8.7432 -8.7432 -7.6917 -7.6917 -7.6863 -7.6863 -7.5658 -7.5658 -7.5240 -7.5240 -0.6738 -0.6738 -0.4898 -0.4898 4.0219 4.0219 4.5154 4.5154 5.6149 5.6149 5.8111 5.8111 5.8642 5.8642 5.8983 5.8983 6.2290 6.2290 6.2802 6.2802 6.3477 6.3477 6.4037 6.4037 6.4382 6.4382 6.4817 6.4817 7.3793 7.3793 7.7211 7.7211 7.9419 7.9419 7.9869 7.9869 9.6297 9.6297 9.9886 9.9886 11.6730 11.6730 11.7495 11.7495 13.9378 13.9378 k = 0.5000 0.2887 0.1287 ( 4458 PWs) bands (ev): -25.8344 -25.8344 -25.8302 -25.8302 -8.7537 -8.7537 -8.7429 -8.7429 -7.6925 -7.6925 -7.6866 -7.6866 -7.5671 -7.5671 -7.5212 -7.5212 -0.6830 -0.6830 -0.4801 -0.4801 3.9995 3.9995 4.5454 4.5454 5.6027 5.6027 5.8201 5.8201 5.8627 5.8627 5.9014 5.9014 6.2257 6.2257 6.2827 6.2827 6.3434 6.3434 6.4030 6.4030 6.4389 6.4389 6.4850 6.4850 7.3627 7.3627 7.7399 7.7399 7.9295 7.9295 7.9822 7.9822 9.6101 9.6101 9.9898 9.9898 11.7470 11.7470 11.8040 11.8040 13.8903 13.8903 k = 0.5000 0.2887 0.1159 ( 4458 PWs) bands (ev): -25.8346 -25.8346 -25.8300 -25.8300 -8.7543 -8.7543 -8.7425 -8.7425 -7.6933 -7.6933 -7.6869 -7.6869 -7.5682 -7.5682 -7.5185 -7.5185 -0.6916 -0.6916 -0.4712 -0.4712 3.9789 3.9789 4.5739 4.5739 5.5910 5.5910 5.8282 5.8282 5.8613 5.8613 5.9047 5.9047 6.2225 6.2225 6.2851 6.2851 6.3393 6.3393 6.4019 6.4019 6.4399 6.4399 6.4881 6.4881 7.3474 7.3474 7.7575 7.7575 7.9169 7.9169 7.9774 7.9774 9.5930 9.5930 9.9888 9.9888 11.8260 11.8260 11.8608 11.8608 13.8467 13.8467 k = 0.5000 0.2887 0.1030 ( 4462 PWs) bands (ev): -25.8348 -25.8348 -25.8298 -25.8298 -8.7549 -8.7549 -8.7422 -8.7422 -7.6940 -7.6940 -7.6872 -7.6872 -7.5692 -7.5692 -7.5160 -7.5160 -0.6994 -0.6994 -0.4630 -0.4630 3.9602 3.9602 4.6006 4.6006 5.5799 5.5799 5.8352 5.8352 5.8600 5.8600 5.9081 5.9081 6.2193 6.2193 6.2872 6.2872 6.3355 6.3355 6.4004 6.4004 6.4412 6.4412 6.4910 6.4910 7.3335 7.3335 7.7736 7.7736 7.9043 7.9043 7.9728 7.9728 9.5783 9.5783 9.9862 9.9862 11.8970 11.8970 11.9306 11.9306 13.8073 13.8073 k = 0.5000 0.2887 0.0901 ( 4460 PWs) bands (ev): -25.8349 -25.8349 -25.8297 -25.8297 -8.7554 -8.7554 -8.7419 -8.7419 -7.6947 -7.6947 -7.6875 -7.6875 -7.5700 -7.5700 -7.5137 -7.5137 -0.7065 -0.7065 -0.4556 -0.4556 3.9435 3.9435 4.6253 4.6253 5.5695 5.5695 5.8413 5.8413 5.8589 5.8589 5.9118 5.9118 6.2164 6.2164 6.2892 6.2892 6.3320 6.3320 6.3988 6.3988 6.4425 6.4425 6.4936 6.4936 7.3210 7.3210 7.7882 7.7882 7.8923 7.8923 7.9684 7.9684 9.5659 9.5659 9.9826 9.9826 11.9511 11.9511 12.0198 12.0198 13.7721 13.7721 k = 0.5000 0.2887 0.0772 ( 4456 PWs) bands (ev): -25.8351 -25.8351 -25.8295 -25.8295 -8.7558 -8.7558 -8.7417 -8.7417 -7.6954 -7.6954 -7.6878 -7.6878 -7.5706 -7.5706 -7.5117 -7.5117 -0.7127 -0.7127 -0.4491 -0.4491 3.9289 3.9289 4.6474 4.6474 5.5600 5.5600 5.8463 5.8463 5.8579 5.8579 5.9155 5.9155 6.2137 6.2137 6.2910 6.2910 6.3288 6.3288 6.3971 6.3971 6.4439 6.4439 6.4960 6.4960 7.3100 7.3100 7.8012 7.8012 7.8811 7.8811 7.9644 7.9644 9.5556 9.5556 9.9786 9.9786 11.9982 11.9982 12.1160 12.1160 13.7412 13.7412 k = 0.5000 0.2887 0.0644 ( 4456 PWs) bands (ev): -25.8352 -25.8352 -25.8294 -25.8294 -8.7562 -8.7562 -8.7415 -8.7415 -7.6959 -7.6959 -7.6880 -7.6880 -7.5712 -7.5712 -7.5099 -7.5099 -0.7180 -0.7180 -0.4435 -0.4435 3.9164 3.9164 4.6669 4.6669 5.5515 5.5515 5.8503 5.8503 5.8572 5.8572 5.9190 5.9190 6.2113 6.2113 6.2926 6.2926 6.3261 6.3261 6.3956 6.3956 6.4451 6.4451 6.4980 6.4980 7.3005 7.3005 7.8123 7.8123 7.8710 7.8710 7.9608 7.9608 9.5474 9.5474 9.9745 9.9745 12.0397 12.0397 12.2144 12.2144 13.7038 13.7038 k = 0.5000 0.2887 0.0515 ( 4468 PWs) bands (ev): -25.8353 -25.8353 -25.8293 -25.8293 -8.7565 -8.7565 -8.7414 -8.7414 -7.6964 -7.6964 -7.6883 -7.6883 -7.5716 -7.5716 -7.5085 -7.5085 -0.7223 -0.7223 -0.4389 -0.4389 3.9061 3.9061 4.6833 4.6833 5.5442 5.5442 5.8531 5.8531 5.8568 5.8568 5.9222 5.9222 6.2091 6.2091 6.2938 6.2938 6.3237 6.3237 6.3943 6.3943 6.4461 6.4461 6.4997 6.4997 7.2927 7.2927 7.8216 7.8216 7.8623 7.8623 7.9578 7.9578 9.5409 9.5409 9.9707 9.9707 12.0752 12.0752 12.3117 12.3117 13.5969 13.5969 k = 0.5000 0.2887 0.0386 ( 4464 PWs) bands (ev): -25.8354 -25.8354 -25.8293 -25.8293 -8.7568 -8.7568 -8.7412 -8.7412 -7.6968 -7.6968 -7.6885 -7.6885 -7.5719 -7.5719 -7.5073 -7.5073 -0.7258 -0.7258 -0.4352 -0.4352 3.8981 3.8981 4.6965 4.6965 5.5383 5.5383 5.8544 5.8544 5.8574 5.8574 5.9250 5.9250 6.2075 6.2075 6.2949 6.2949 6.3219 6.3219 6.3932 6.3932 6.4469 6.4469 6.5011 6.5011 7.2866 7.2866 7.8288 7.8288 7.8552 7.8552 7.9554 7.9554 9.5360 9.5360 9.9675 9.9675 12.1038 12.1038 12.4036 12.4036 13.4962 13.4962 k = 0.5000 0.2887 0.0257 ( 4460 PWs) bands (ev): -25.8354 -25.8354 -25.8292 -25.8292 -8.7570 -8.7570 -8.7411 -8.7411 -7.6971 -7.6971 -7.6886 -7.6886 -7.5721 -7.5721 -7.5065 -7.5065 -0.7282 -0.7282 -0.4326 -0.4326 3.8923 3.8923 4.7060 4.7060 5.5339 5.5339 5.8545 5.8545 5.8585 5.8585 5.9270 5.9270 6.2062 6.2062 6.2957 6.2957 6.3205 6.3205 6.3924 6.3924 6.4476 6.4476 6.5021 6.5021 7.2822 7.2822 7.8341 7.8341 7.8500 7.8500 7.9537 7.9537 9.5327 9.5327 9.9650 9.9650 12.1249 12.1249 12.4831 12.4831 13.4103 13.4103 k = 0.5000 0.2887 0.0129 ( 4454 PWs) bands (ev): -25.8355 -25.8355 -25.8292 -25.8292 -8.7571 -8.7571 -8.7411 -8.7411 -7.6972 -7.6972 -7.6887 -7.6887 -7.5723 -7.5723 -7.5059 -7.5059 -0.7297 -0.7297 -0.4310 -0.4310 3.8888 3.8888 4.7118 4.7118 5.5313 5.5313 5.8545 5.8545 5.8594 5.8594 5.9284 5.9284 6.2055 6.2055 6.2961 6.2961 6.3197 6.3197 6.3919 6.3919 6.4480 6.4480 6.5027 6.5027 7.2796 7.2796 7.8373 7.8373 7.8469 7.8469 7.9526 7.9526 9.5307 9.5307 9.9635 9.9635 12.1377 12.1377 12.5397 12.5397 13.3498 13.3498 k = 0.5000 0.2887-0.0000 ( 4462 PWs) bands (ev): -25.8355 -25.8355 -25.8292 -25.8292 -8.7571 -8.7571 -8.7411 -8.7411 -7.6973 -7.6973 -7.6887 -7.6887 -7.5723 -7.5723 -7.5058 -7.5058 -0.7302 -0.7302 -0.4305 -0.4305 3.8877 3.8877 4.7138 4.7138 5.5303 5.5303 5.8544 5.8544 5.8596 5.8596 5.9288 5.9288 6.2052 6.2052 6.2963 6.2963 6.3194 6.3194 6.3917 6.3917 6.4481 6.4481 6.5029 6.5029 7.2787 7.2787 7.8383 7.8383 7.8458 7.8458 7.9523 7.9523 9.5300 9.5300 9.9630 9.9630 12.1421 12.1421 12.5607 12.5607 13.3275 13.3275 k = 0.3333 0.5774-0.0000 ( 4476 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7600 -8.7600 -8.7462 -8.7462 -7.6981 -7.6981 -7.6500 -7.6500 -7.6391 -7.6391 -7.5363 -7.5363 -0.4874 -0.4874 -0.4748 -0.4748 4.4623 4.4623 4.4697 4.4697 5.3483 5.3483 5.7112 5.7112 5.7560 5.7560 6.0555 6.0555 6.1382 6.1382 6.2153 6.2153 6.3108 6.3108 6.3775 6.3775 6.4425 6.4425 6.5068 6.5068 6.6269 6.6269 6.8027 6.8027 8.0148 8.0148 8.0315 8.0315 10.5354 10.5354 10.5651 10.5651 12.1792 12.1792 12.1993 12.1993 13.4766 13.4766 k = 0.3333 0.5774 0.0129 ( 4476 PWs) bands (ev): -25.8334 -25.8334 -25.8272 -25.8272 -8.7599 -8.7599 -8.7462 -8.7462 -7.6981 -7.6981 -7.6501 -7.6501 -7.6389 -7.6389 -7.5365 -7.5365 -0.4874 -0.4874 -0.4748 -0.4748 4.4623 4.4623 4.4697 4.4697 5.3497 5.3497 5.7112 5.7112 5.7559 5.7559 6.0554 6.0554 6.1377 6.1377 6.2154 6.2154 6.3107 6.3107 6.3775 6.3775 6.4424 6.4424 6.5056 6.5056 6.6270 6.6270 6.8027 6.8027 8.0155 8.0155 8.0323 8.0323 10.5315 10.5315 10.5614 10.5614 12.1850 12.1850 12.2051 12.2051 13.4783 13.4783 k = 0.3333 0.5774 0.0257 ( 4476 PWs) bands (ev): -25.8333 -25.8333 -25.8272 -25.8272 -8.7598 -8.7598 -8.7462 -8.7462 -7.6978 -7.6978 -7.6503 -7.6503 -7.6384 -7.6384 -7.5371 -7.5371 -0.4874 -0.4874 -0.4747 -0.4747 4.4623 4.4623 4.4696 4.4696 5.3541 5.3541 5.7109 5.7109 5.7555 5.7555 6.0550 6.0550 6.1360 6.1360 6.2157 6.2157 6.3104 6.3104 6.3774 6.3774 6.4420 6.4420 6.5021 6.5021 6.6273 6.6273 6.8026 6.8026 8.0176 8.0176 8.0347 8.0347 10.5201 10.5201 10.5503 10.5503 12.2022 12.2022 12.2224 12.2224 13.4835 13.4835 k = 0.3333 0.5774 0.0386 ( 4479 PWs) bands (ev): -25.8333 -25.8333 -25.8272 -25.8272 -8.7597 -8.7597 -8.7463 -8.7463 -7.6974 -7.6974 -7.6507 -7.6507 -7.6377 -7.6377 -7.5380 -7.5380 -0.4873 -0.4873 -0.4747 -0.4747 4.4623 4.4623 4.4696 4.4696 5.3612 5.3612 5.7105 5.7105 5.7549 5.7549 6.0544 6.0544 6.1333 6.1333 6.2161 6.2161 6.3098 6.3098 6.3772 6.3772 6.4413 6.4413 6.4965 6.4965 6.6276 6.6276 6.8024 6.8024 8.0212 8.0212 8.0386 8.0386 10.5018 10.5018 10.5325 10.5325 12.2301 12.2301 12.2505 12.2505 13.4921 13.4921 k = 0.3333 0.5774 0.0515 ( 4497 PWs) bands (ev): -25.8332 -25.8332 -25.8273 -25.8273 -8.7595 -8.7595 -8.7464 -8.7464 -7.6969 -7.6969 -7.6513 -7.6513 -7.6366 -7.6366 -7.5394 -7.5394 -0.4872 -0.4872 -0.4746 -0.4746 4.4624 4.4624 4.4695 4.4695 5.3713 5.3713 5.7100 5.7100 5.7540 5.7540 6.0533 6.0533 6.1293 6.1293 6.2168 6.2168 6.3090 6.3090 6.3768 6.3768 6.4400 6.4400 6.4892 6.4892 6.6281 6.6281 6.8021 6.8021 8.0260 8.0260 8.0438 8.0438 10.4775 10.4775 10.5089 10.5089 12.2679 12.2679 12.2886 12.2886 13.5042 13.5042 k = 0.3333 0.5774 0.0644 ( 4500 PWs) bands (ev): -25.8331 -25.8331 -25.8274 -25.8274 -8.7592 -8.7592 -8.7465 -8.7465 -7.6962 -7.6962 -7.6520 -7.6520 -7.6352 -7.6352 -7.5410 -7.5410 -0.4872 -0.4872 -0.4745 -0.4745 4.4624 4.4624 4.4695 4.4695 5.3840 5.3840 5.7094 5.7094 5.7529 5.7529 6.0519 6.0519 6.1243 6.1243 6.2177 6.2177 6.3079 6.3079 6.3764 6.3764 6.4381 6.4381 6.4810 6.4810 6.6285 6.6285 6.8019 6.8019 8.0320 8.0320 8.0504 8.0504 10.4483 10.4483 10.4807 10.4807 12.3145 12.3145 12.3355 12.3355 13.5197 13.5197 k = 0.3333 0.5774 0.0772 ( 4500 PWs) bands (ev): -25.8330 -25.8330 -25.8275 -25.8275 -8.7589 -8.7589 -8.7467 -8.7467 -7.6954 -7.6954 -7.6528 -7.6528 -7.6334 -7.6334 -7.5431 -7.5431 -0.4871 -0.4871 -0.4743 -0.4743 4.4625 4.4625 4.4694 4.4694 5.3995 5.3995 5.7086 5.7086 5.7517 5.7517 6.0498 6.0498 6.1180 6.1180 6.2187 6.2187 6.3064 6.3064 6.3760 6.3760 6.4349 6.4349 6.4727 6.4727 6.6290 6.6290 6.8016 6.8016 8.0391 8.0391 8.0582 8.0582 10.4155 10.4155 10.4489 10.4489 12.3687 12.3687 12.3901 12.3901 13.5386 13.5386 k = 0.3333 0.5774 0.0901 ( 4500 PWs) bands (ev): -25.8329 -25.8329 -25.8277 -25.8277 -8.7586 -8.7586 -8.7469 -8.7469 -7.6944 -7.6944 -7.6538 -7.6538 -7.6314 -7.6314 -7.5454 -7.5454 -0.4870 -0.4870 -0.4742 -0.4742 4.4625 4.4625 4.4693 4.4693 5.4175 5.4175 5.7078 5.7078 5.7504 5.7504 6.0468 6.0468 6.1107 6.1107 6.2199 6.2199 6.3046 6.3046 6.3756 6.3756 6.4300 6.4300 6.4656 6.4656 6.6294 6.6294 6.8012 6.8012 8.0471 8.0471 8.0670 8.0670 10.3801 10.3801 10.4148 10.4148 12.4294 12.4294 12.4513 12.4513 13.5608 13.5608 k = 0.3333 0.5774 0.1030 ( 4488 PWs) bands (ev): -25.8327 -25.8327 -25.8278 -25.8278 -8.7582 -8.7582 -8.7471 -8.7471 -7.6933 -7.6933 -7.6549 -7.6549 -7.6292 -7.6292 -7.5480 -7.5480 -0.4868 -0.4868 -0.4740 -0.4740 4.4626 4.4626 4.4692 4.4692 5.4381 5.4381 5.7070 5.7070 5.7490 5.7490 6.0424 6.0424 6.1027 6.1027 6.2214 6.2214 6.3023 6.3023 6.3751 6.3751 6.4229 6.4229 6.4603 6.4603 6.6298 6.6298 6.8009 6.8009 8.0558 8.0558 8.0765 8.0765 10.3434 10.3434 10.3795 10.3795 12.4954 12.4954 12.5179 12.5179 13.5864 13.5864 k = 0.3333 0.5774 0.1159 ( 4485 PWs) bands (ev): -25.8325 -25.8325 -25.8280 -25.8280 -8.7577 -8.7577 -8.7473 -8.7473 -7.6921 -7.6921 -7.6561 -7.6561 -7.6266 -7.6266 -7.5510 -7.5510 -0.4867 -0.4867 -0.4739 -0.4739 4.4627 4.4627 4.4692 4.4692 5.4609 5.4609 5.7061 5.7061 5.7475 5.7475 6.0356 6.0356 6.0945 6.0945 6.2230 6.2230 6.2993 6.2993 6.3747 6.3747 6.4143 6.4143 6.4569 6.4569 6.6301 6.6301 6.8005 6.8005 8.0649 8.0649 8.0866 8.0866 10.3064 10.3064 10.3439 10.3439 12.5658 12.5658 12.5889 12.5889 13.6152 13.6152 k = 0.3333 0.5774 0.1287 ( 4479 PWs) bands (ev): -25.8324 -25.8324 -25.8282 -25.8282 -8.7573 -8.7573 -8.7475 -8.7475 -7.6908 -7.6908 -7.6575 -7.6575 -7.6238 -7.6238 -7.5542 -7.5542 -0.4866 -0.4866 -0.4737 -0.4737 4.4627 4.4627 4.4691 4.4691 5.4860 5.4860 5.7052 5.7052 5.7460 5.7460 6.0254 6.0254 6.0871 6.0871 6.2247 6.2247 6.2959 6.2959 6.3742 6.3742 6.4053 6.4053 6.4547 6.4547 6.6303 6.6303 6.8002 6.8002 8.0743 8.0743 8.0970 8.0970 10.2700 10.2700 10.3090 10.3090 12.6396 12.6396 12.6633 12.6633 13.6472 13.6472 k = 0.3333 0.5774 0.1416 ( 4479 PWs) bands (ev): -25.8322 -25.8322 -25.8284 -25.8284 -8.7568 -8.7568 -8.7478 -8.7478 -7.6894 -7.6894 -7.6589 -7.6589 -7.6208 -7.6208 -7.5576 -7.5576 -0.4865 -0.4865 -0.4735 -0.4735 4.4628 4.4628 4.4690 4.4690 5.5132 5.5132 5.7043 5.7043 5.7445 5.7445 6.0109 6.0109 6.0812 6.0812 6.2266 6.2266 6.2919 6.2919 6.3737 6.3737 6.3968 6.3968 6.4533 6.4533 6.6305 6.6305 6.7998 6.7998 8.0837 8.0837 8.1074 8.1074 10.2351 10.2351 10.2756 10.2756 12.7157 12.7157 12.7402 12.7402 13.6823 13.6823 k = 0.3333 0.5774 0.1545 ( 4479 PWs) bands (ev): -25.8320 -25.8320 -25.8286 -25.8286 -8.7563 -8.7563 -8.7481 -8.7481 -7.6879 -7.6879 -7.6604 -7.6604 -7.6175 -7.6175 -7.5612 -7.5612 -0.4864 -0.4864 -0.4734 -0.4734 4.4628 4.4628 4.4689 4.4689 5.5422 5.5422 5.7035 5.7035 5.7431 5.7431 5.9921 5.9921 6.0768 6.0768 6.2286 6.2286 6.2875 6.2875 6.3732 6.3732 6.3892 6.3892 6.4524 6.4524 6.6306 6.6306 6.7994 6.7994 8.0928 8.0928 8.1175 8.1175 10.2024 10.2024 10.2444 10.2444 12.7932 12.7932 12.8185 12.8185 13.7203 13.7203 k = 0.3333 0.5774 0.1673 ( 4473 PWs) bands (ev): -25.8317 -25.8317 -25.8288 -25.8288 -8.7558 -8.7558 -8.7484 -8.7484 -7.6864 -7.6864 -7.6620 -7.6620 -7.6140 -7.6140 -7.5650 -7.5650 -0.4863 -0.4863 -0.4732 -0.4732 4.4629 4.4629 4.4688 4.4688 5.5728 5.5728 5.7027 5.7027 5.7419 5.7419 5.9694 5.9694 6.0737 6.0737 6.2307 6.2307 6.2828 6.2828 6.3728 6.3728 6.3830 6.3830 6.4517 6.4517 6.6307 6.6307 6.7991 6.7991 8.1014 8.1014 8.1270 8.1270 10.1727 10.1727 10.2160 10.2160 12.8708 12.8708 12.8971 12.8971 13.7611 13.7611 k = 0.3333 0.5774 0.1802 ( 4476 PWs) bands (ev): -25.8315 -25.8315 -25.8290 -25.8290 -8.7553 -8.7553 -8.7487 -8.7487 -7.6848 -7.6848 -7.6636 -7.6636 -7.6104 -7.6104 -7.5690 -7.5690 -0.4862 -0.4862 -0.4731 -0.4731 4.4630 4.4630 4.4687 4.4687 5.6047 5.6047 5.7019 5.7019 5.7409 5.7409 5.9433 5.9433 6.0716 6.0716 6.2329 6.2329 6.2781 6.2781 6.3724 6.3724 6.3779 6.3779 6.4513 6.4513 6.6307 6.6307 6.7988 6.7988 8.1091 8.1091 8.1357 8.1357 10.1464 10.1464 10.1910 10.1910 12.9470 12.9470 12.9745 12.9745 13.8044 13.8044 k = 0.3333 0.5774 0.1931 ( 4473 PWs) bands (ev): -25.8313 -25.8313 -25.8293 -25.8293 -8.7548 -8.7548 -8.7491 -8.7491 -7.6832 -7.6832 -7.6652 -7.6652 -7.6066 -7.6066 -7.5731 -7.5731 -0.4861 -0.4861 -0.4730 -0.4730 4.4630 4.4630 4.4687 4.4687 5.6378 5.6378 5.7013 5.7013 5.7402 5.7402 5.9144 5.9144 6.0701 6.0701 6.2352 6.2352 6.2735 6.2735 6.3721 6.3721 6.3741 6.3741 6.4509 6.4509 6.6307 6.6307 6.7986 6.7986 8.1159 8.1159 8.1432 8.1432 10.1242 10.1242 10.1699 10.1699 13.0199 13.0199 13.0487 13.0487 13.8499 13.8499 k = 0.3333 0.5774 0.2060 ( 4446 PWs) bands (ev): -25.8310 -25.8310 -25.8295 -25.8295 -8.7544 -8.7544 -8.7493 -8.7493 -7.6817 -7.6817 -7.6667 -7.6667 -7.6026 -7.6026 -7.5772 -7.5772 -0.4860 -0.4860 -0.4729 -0.4729 4.4630 4.4630 4.4686 4.4686 5.6712 5.6712 5.7009 5.7009 5.7401 5.7401 5.8834 5.8834 6.0692 6.0692 6.2376 6.2376 6.2694 6.2694 6.3714 6.3714 6.3719 6.3719 6.4508 6.4508 6.6308 6.6308 6.7984 6.7984 8.1214 8.1214 8.1494 8.1494 10.1065 10.1065 10.1531 10.1531 13.0862 13.0862 13.1166 13.1166 13.8968 13.8968 k = 0.3333 0.5774 0.2188 ( 4458 PWs) bands (ev): -25.8308 -25.8308 -25.8297 -25.8297 -8.7541 -8.7541 -8.7496 -8.7496 -7.6804 -7.6804 -7.6680 -7.6680 -7.5986 -7.5986 -7.5814 -7.5814 -0.4860 -0.4860 -0.4728 -0.4728 4.4631 4.4631 4.4686 4.4686 5.7005 5.7005 5.7035 5.7035 5.7419 5.7419 5.8507 5.8507 6.0685 6.0685 6.2396 6.2396 6.2659 6.2659 6.3694 6.3694 6.3716 6.3716 6.4506 6.4506 6.6308 6.6308 6.7983 6.7983 8.1255 8.1255 8.1540 8.1540 10.0936 10.0936 10.1409 10.1409 13.1413 13.1413 13.1736 13.1736 13.9339 13.9339 k = 0.3333 0.5774 0.2317 ( 4470 PWs) bands (ev): -25.8305 -25.8305 -25.8300 -25.8300 -8.7538 -8.7538 -8.7498 -8.7498 -7.6794 -7.6794 -7.6690 -7.6690 -7.5946 -7.5946 -7.5855 -7.5855 -0.4859 -0.4859 -0.4728 -0.4728 4.4631 4.4631 4.4686 4.4686 5.7003 5.7003 5.7257 5.7257 5.7542 5.7542 5.8171 5.8171 6.0681 6.0681 6.2410 6.2410 6.2635 6.2635 6.3683 6.3683 6.3715 6.3715 6.4505 6.4505 6.6307 6.6307 6.7982 6.7982 8.1279 8.1279 8.1568 8.1568 10.0857 10.0857 10.1334 10.1334 13.1790 13.1790 13.2127 13.2127 13.8988 13.8988 k = 0.3333 0.5774 0.2446 ( 4470 PWs) bands (ev): -25.8303 -25.8303 -25.8303 -25.8303 -8.7537 -8.7537 -8.7499 -8.7499 -7.6790 -7.6790 -7.6694 -7.6694 -7.5916 -7.5916 -7.5886 -7.5886 -0.4859 -0.4859 -0.4728 -0.4728 4.4631 4.4631 4.4685 4.4685 5.7002 5.7002 5.7300 5.7300 5.7819 5.7819 5.7853 5.7853 6.0680 6.0680 6.2416 6.2416 6.2626 6.2626 6.3679 6.3679 6.3714 6.3714 6.4504 6.4504 6.6307 6.6307 6.7981 6.7981 8.1288 8.1288 8.1577 8.1577 10.0831 10.0831 10.1309 10.1309 13.1925 13.1925 13.2270 13.2270 13.8840 13.8842 Writing output data file SrCuP.save init_run : 0.32s CPU 0.47s WALL ( 1 calls) electrons : 194.08s CPU 197.31s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.03s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 194.07s CPU 197.31s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.10s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.09s WALL ( 308 calls) cegterg : 178.08s CPU 180.48s WALL ( 430 calls) Called by sum_band: Called by *egterg: h_psi : 86.06s CPU 87.61s WALL ( 7169 calls) s_psi : 9.07s CPU 9.09s WALL ( 7169 calls) g_psi : 0.23s CPU 0.27s WALL ( 6431 calls) cdiaghg : 72.84s CPU 73.92s WALL ( 6739 calls) cegterg:over : 8.44s CPU 8.43s WALL ( 6431 calls) cegterg:upda : 7.38s CPU 7.44s WALL ( 6431 calls) cegterg:last : 3.56s CPU 3.53s WALL ( 1069 calls) cdiaghg:chol : 4.16s CPU 4.24s WALL ( 6739 calls) cdiaghg:inve : 3.05s CPU 3.08s WALL ( 6739 calls) cdiaghg:para : 5.26s CPU 5.13s WALL ( 13478 calls) Called by h_psi: h_psi:vloc : 66.68s CPU 68.00s WALL ( 7169 calls) h_psi:vnl : 19.07s CPU 19.32s WALL ( 7169 calls) add_vuspsi : 10.71s CPU 10.70s WALL ( 7169 calls) General routines calbec : 8.33s CPU 8.59s WALL ( 7169 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 61.89s CPU 63.14s WALL ( 886464 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.31s WALL ( 616 calls) Parallel routines fft_scatter : 25.57s CPU 26.28s WALL ( 886487 calls) PWSCF : 3m33.45s CPU 3m49.31s WALL This run was terminated on: 18: 0:11 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=