Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:55:40 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: ./ZrNi2Sb.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 29 23 7 1514 1129 177 Max 32 24 8 1519 1144 186 Sum 1057 859 253 54617 40973 6495 bravais-lattice index = 14 lattice parameter (alat) = 7.9569 a.u. unit-cell volume = 859.8964 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 242.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.956880 celldm(2)= 1.000000 celldm(3)= 1.971002 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 1.971002 ) 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 0.507356 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 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 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Zr 4.00 91.22400 Zr( 1.00) Sb 5.00 121.76000 Sb( 1.00) Ni 10.00 58.69340 Ni( 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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 ) ( 0.9855009 ) 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= 304 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 2) = ( 0.0113636 0.0065608 -0.0000000), wk = 0.0032895 k( 3) = ( 0.0227273 0.0131216 -0.0000000), wk = 0.0032895 k( 4) = ( 0.0340909 0.0196824 -0.0000000), wk = 0.0032895 k( 5) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0032895 k( 6) = ( 0.0568182 0.0328040 -0.0000000), wk = 0.0032895 k( 7) = ( 0.0681818 0.0393648 -0.0000000), wk = 0.0032895 k( 8) = ( 0.0795455 0.0459256 -0.0000000), wk = 0.0032895 k( 9) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0032895 k( 10) = ( 0.1022727 0.0590472 -0.0000000), wk = 0.0032895 k( 11) = ( 0.1136364 0.0656080 -0.0000000), wk = 0.0032895 k( 12) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0032895 k( 13) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0032895 k( 14) = ( 0.1477273 0.0852904 -0.0000000), wk = 0.0032895 k( 15) = ( 0.1590909 0.0918512 -0.0000000), wk = 0.0032895 k( 16) = ( 0.1704546 0.0984120 -0.0000000), wk = 0.0032895 k( 17) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0032895 k( 18) = ( 0.1931818 0.1115336 -0.0000000), wk = 0.0032895 k( 19) = ( 0.2045454 0.1180944 -0.0000000), wk = 0.0032895 k( 20) = ( 0.2159091 0.1246552 -0.0000000), wk = 0.0032895 k( 21) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0032895 k( 22) = ( 0.2386364 0.1377768 -0.0000000), wk = 0.0032895 k( 23) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0032895 k( 24) = ( 0.2613636 0.1508984 -0.0000000), wk = 0.0032895 k( 25) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0032895 k( 26) = ( 0.2840909 0.1640200 -0.0000000), wk = 0.0032895 k( 27) = ( 0.2954545 0.1705808 -0.0000000), wk = 0.0032895 k( 28) = ( 0.3068182 0.1771416 -0.0000000), wk = 0.0032895 k( 29) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0032895 k( 30) = ( 0.3295455 0.1902632 -0.0000000), wk = 0.0032895 k( 31) = ( 0.3409091 0.1968240 -0.0000000), wk = 0.0032895 k( 32) = ( 0.3522727 0.2033848 -0.0000000), wk = 0.0032895 k( 33) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0032895 k( 34) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0032895 k( 35) = ( 0.3863636 0.2230672 -0.0000000), wk = 0.0032895 k( 36) = ( 0.3977273 0.2296279 -0.0000000), wk = 0.0032895 k( 37) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0032895 k( 38) = ( 0.4204545 0.2427495 -0.0000000), wk = 0.0032895 k( 39) = ( 0.4318182 0.2493103 -0.0000000), wk = 0.0032895 k( 40) = ( 0.4431818 0.2558711 -0.0000000), wk = 0.0032895 k( 41) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0032895 k( 42) = ( 0.4659091 0.2689927 -0.0000000), wk = 0.0032895 k( 43) = ( 0.4772727 0.2755535 -0.0000000), wk = 0.0032895 k( 44) = ( 0.4886364 0.2821143 -0.0000000), wk = 0.0032895 k( 45) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0032895 k( 46) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0032895 k( 47) = ( 0.4933333 0.3002221 -0.0000000), wk = 0.0032895 k( 48) = ( 0.4866667 0.3117692 -0.0000000), wk = 0.0032895 k( 49) = ( 0.4800000 0.3233162 -0.0000000), wk = 0.0032895 k( 50) = ( 0.4733333 0.3348632 -0.0000000), wk = 0.0032895 k( 51) = ( 0.4666667 0.3464102 -0.0000000), wk = 0.0032895 k( 52) = ( 0.4600000 0.3579572 -0.0000000), wk = 0.0032895 k( 53) = ( 0.4533333 0.3695042 -0.0000000), wk = 0.0032895 k( 54) = ( 0.4466667 0.3810512 -0.0000000), wk = 0.0032895 k( 55) = ( 0.4400000 0.3925982 -0.0000000), wk = 0.0032895 k( 56) = ( 0.4333333 0.4041452 -0.0000000), wk = 0.0032895 k( 57) = ( 0.4266667 0.4156922 -0.0000000), wk = 0.0032895 k( 58) = ( 0.4200000 0.4272392 -0.0000000), wk = 0.0032895 k( 59) = ( 0.4133333 0.4387862 -0.0000000), wk = 0.0032895 k( 60) = ( 0.4066667 0.4503332 -0.0000000), wk = 0.0032895 k( 61) = ( 0.4000000 0.4618802 -0.0000000), wk = 0.0032895 k( 62) = ( 0.3933333 0.4734272 -0.0000000), wk = 0.0032895 k( 63) = ( 0.3866667 0.4849742 -0.0000000), wk = 0.0032895 k( 64) = ( 0.3800000 0.4965212 -0.0000000), wk = 0.0032895 k( 65) = ( 0.3733333 0.5080682 -0.0000000), wk = 0.0032895 k( 66) = ( 0.3666667 0.5196152 -0.0000000), wk = 0.0032895 k( 67) = ( 0.3600000 0.5311622 -0.0000000), wk = 0.0032895 k( 68) = ( 0.3533333 0.5427092 -0.0000000), wk = 0.0032895 k( 69) = ( 0.3466667 0.5542563 -0.0000000), wk = 0.0032895 k( 70) = ( 0.3400000 0.5658033 -0.0000000), wk = 0.0032895 k( 71) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0032895 k( 72) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0032895 k( 73) = ( 0.3266667 0.5658033 -0.0000000), wk = 0.0032895 k( 74) = ( 0.3200000 0.5542563 -0.0000000), wk = 0.0032895 k( 75) = ( 0.3133333 0.5427092 -0.0000000), wk = 0.0032895 k( 76) = ( 0.3066667 0.5311623 -0.0000000), wk = 0.0032895 k( 77) = ( 0.3000000 0.5196152 -0.0000000), wk = 0.0032895 k( 78) = ( 0.2933333 0.5080682 -0.0000000), wk = 0.0032895 k( 79) = ( 0.2866667 0.4965212 -0.0000000), wk = 0.0032895 k( 80) = ( 0.2800000 0.4849742 -0.0000000), wk = 0.0032895 k( 81) = ( 0.2733333 0.4734272 -0.0000000), wk = 0.0032895 k( 82) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0032895 k( 83) = ( 0.2600000 0.4503332 -0.0000000), wk = 0.0032895 k( 84) = ( 0.2533333 0.4387862 -0.0000000), wk = 0.0032895 k( 85) = ( 0.2466667 0.4272392 -0.0000000), wk = 0.0032895 k( 86) = ( 0.2400000 0.4156922 -0.0000000), wk = 0.0032895 k( 87) = ( 0.2333333 0.4041452 -0.0000000), wk = 0.0032895 k( 88) = ( 0.2266667 0.3925982 -0.0000000), wk = 0.0032895 k( 89) = ( 0.2200000 0.3810512 -0.0000000), wk = 0.0032895 k( 90) = ( 0.2133333 0.3695042 -0.0000000), wk = 0.0032895 k( 91) = ( 0.2066667 0.3579572 -0.0000000), wk = 0.0032895 k( 92) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0032895 k( 93) = ( 0.1933333 0.3348632 -0.0000000), wk = 0.0032895 k( 94) = ( 0.1866667 0.3233162 -0.0000000), wk = 0.0032895 k( 95) = ( 0.1800000 0.3117691 -0.0000000), wk = 0.0032895 k( 96) = ( 0.1733333 0.3002221 -0.0000000), wk = 0.0032895 k( 97) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0032895 k( 98) = ( 0.1600000 0.2771281 -0.0000000), wk = 0.0032895 k( 99) = ( 0.1533333 0.2655811 -0.0000000), wk = 0.0032895 k( 100) = ( 0.1466667 0.2540341 -0.0000000), wk = 0.0032895 k( 101) = ( 0.1400000 0.2424871 -0.0000000), wk = 0.0032895 k( 102) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0032895 k( 103) = ( 0.1266667 0.2193931 -0.0000000), wk = 0.0032895 k( 104) = ( 0.1200000 0.2078461 -0.0000000), wk = 0.0032895 k( 105) = ( 0.1133333 0.1962991 -0.0000000), wk = 0.0032895 k( 106) = ( 0.1066667 0.1847521 -0.0000000), wk = 0.0032895 k( 107) = ( 0.1000000 0.1732051 -0.0000000), wk = 0.0032895 k( 108) = ( 0.0933333 0.1616581 -0.0000000), wk = 0.0032895 k( 109) = ( 0.0866667 0.1501111 -0.0000000), wk = 0.0032895 k( 110) = ( 0.0800000 0.1385641 -0.0000000), wk = 0.0032895 k( 111) = ( 0.0733333 0.1270171 -0.0000000), wk = 0.0032895 k( 112) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0032895 k( 113) = ( 0.0600000 0.1039230 -0.0000000), wk = 0.0032895 k( 114) = ( 0.0533333 0.0923760 -0.0000000), wk = 0.0032895 k( 115) = ( 0.0466667 0.0808290 -0.0000000), wk = 0.0032895 k( 116) = ( 0.0400000 0.0692820 -0.0000000), wk = 0.0032895 k( 117) = ( 0.0333333 0.0577350 -0.0000000), wk = 0.0032895 k( 118) = ( 0.0266667 0.0461880 -0.0000000), wk = 0.0032895 k( 119) = ( 0.0200000 0.0346410 -0.0000000), wk = 0.0032895 k( 120) = ( 0.0133333 0.0230940 -0.0000000), wk = 0.0032895 k( 121) = ( 0.0066667 0.0115470 -0.0000000), wk = 0.0032895 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 124) = ( 0.0000000 0.0000000 0.0133515), wk = 0.0032895 k( 125) = ( 0.0000000 0.0000000 0.0267030), wk = 0.0032895 k( 126) = ( 0.0000000 0.0000000 0.0400544), wk = 0.0032895 k( 127) = ( 0.0000000 0.0000000 0.0534059), wk = 0.0032895 k( 128) = ( 0.0000000 0.0000000 0.0667574), wk = 0.0032895 k( 129) = ( 0.0000000 0.0000000 0.0801089), wk = 0.0032895 k( 130) = ( 0.0000000 0.0000000 0.0934604), wk = 0.0032895 k( 131) = ( 0.0000000 0.0000000 0.1068118), wk = 0.0032895 k( 132) = ( 0.0000000 0.0000000 0.1201633), wk = 0.0032895 k( 133) = ( 0.0000000 0.0000000 0.1335148), wk = 0.0032895 k( 134) = ( 0.0000000 0.0000000 0.1468663), wk = 0.0032895 k( 135) = ( 0.0000000 0.0000000 0.1602178), wk = 0.0032895 k( 136) = ( 0.0000000 0.0000000 0.1735692), wk = 0.0032895 k( 137) = ( 0.0000000 0.0000000 0.1869207), wk = 0.0032895 k( 138) = ( 0.0000000 0.0000000 0.2002722), wk = 0.0032895 k( 139) = ( 0.0000000 0.0000000 0.2136237), wk = 0.0032895 k( 140) = ( 0.0000000 0.0000000 0.2269752), wk = 0.0032895 k( 141) = ( 0.0000000 0.0000000 0.2403266), wk = 0.0032895 k( 142) = ( 0.0000000 0.0000000 0.2536781), wk = 0.0032895 k( 143) = ( 0.0000000 0.0000000 0.2536781), wk = 0.0032895 k( 144) = ( 0.0113636 0.0065608 0.2536781), wk = 0.0032895 k( 145) = ( 0.0227273 0.0131216 0.2536781), wk = 0.0032895 k( 146) = ( 0.0340909 0.0196824 0.2536781), wk = 0.0032895 k( 147) = ( 0.0454546 0.0262432 0.2536781), wk = 0.0032895 k( 148) = ( 0.0568182 0.0328040 0.2536781), wk = 0.0032895 k( 149) = ( 0.0681818 0.0393648 0.2536781), wk = 0.0032895 k( 150) = ( 0.0795455 0.0459256 0.2536781), wk = 0.0032895 k( 151) = ( 0.0909091 0.0524864 0.2536781), wk = 0.0032895 k( 152) = ( 0.1022727 0.0590472 0.2536781), wk = 0.0032895 k( 153) = ( 0.1136364 0.0656080 0.2536781), wk = 0.0032895 k( 154) = ( 0.1250000 0.0721688 0.2536781), wk = 0.0032895 k( 155) = ( 0.1363636 0.0787296 0.2536781), wk = 0.0032895 k( 156) = ( 0.1477273 0.0852904 0.2536781), wk = 0.0032895 k( 157) = ( 0.1590909 0.0918512 0.2536781), wk = 0.0032895 k( 158) = ( 0.1704546 0.0984120 0.2536781), wk = 0.0032895 k( 159) = ( 0.1818182 0.1049728 0.2536781), wk = 0.0032895 k( 160) = ( 0.1931818 0.1115336 0.2536781), wk = 0.0032895 k( 161) = ( 0.2045454 0.1180944 0.2536781), wk = 0.0032895 k( 162) = ( 0.2159091 0.1246552 0.2536781), wk = 0.0032895 k( 163) = ( 0.2272727 0.1312160 0.2536781), wk = 0.0032895 k( 164) = ( 0.2386364 0.1377768 0.2536781), wk = 0.0032895 k( 165) = ( 0.2500000 0.1443376 0.2536781), wk = 0.0032895 k( 166) = ( 0.2613636 0.1508984 0.2536781), wk = 0.0032895 k( 167) = ( 0.2727273 0.1574592 0.2536781), wk = 0.0032895 k( 168) = ( 0.2840909 0.1640200 0.2536781), wk = 0.0032895 k( 169) = ( 0.2954545 0.1705808 0.2536781), wk = 0.0032895 k( 170) = ( 0.3068182 0.1771416 0.2536781), wk = 0.0032895 k( 171) = ( 0.3181818 0.1837024 0.2536781), wk = 0.0032895 k( 172) = ( 0.3295455 0.1902632 0.2536781), wk = 0.0032895 k( 173) = ( 0.3409091 0.1968240 0.2536781), wk = 0.0032895 k( 174) = ( 0.3522727 0.2033848 0.2536781), wk = 0.0032895 k( 175) = ( 0.3636364 0.2099456 0.2536781), wk = 0.0032895 k( 176) = ( 0.3750000 0.2165064 0.2536781), wk = 0.0032895 k( 177) = ( 0.3863636 0.2230672 0.2536781), wk = 0.0032895 k( 178) = ( 0.3977273 0.2296279 0.2536781), wk = 0.0032895 k( 179) = ( 0.4090909 0.2361887 0.2536781), wk = 0.0032895 k( 180) = ( 0.4204545 0.2427495 0.2536781), wk = 0.0032895 k( 181) = ( 0.4318182 0.2493103 0.2536781), wk = 0.0032895 k( 182) = ( 0.4431818 0.2558711 0.2536781), wk = 0.0032895 k( 183) = ( 0.4545455 0.2624319 0.2536781), wk = 0.0032895 k( 184) = ( 0.4659091 0.2689927 0.2536781), wk = 0.0032895 k( 185) = ( 0.4772727 0.2755535 0.2536781), wk = 0.0032895 k( 186) = ( 0.4886364 0.2821143 0.2536781), wk = 0.0032895 k( 187) = ( 0.5000000 0.2886751 0.2536781), wk = 0.0032895 k( 188) = ( 0.5000000 0.2886751 0.2536781), wk = 0.0032895 k( 189) = ( 0.4933333 0.3002221 0.2536781), wk = 0.0032895 k( 190) = ( 0.4866667 0.3117692 0.2536781), wk = 0.0032895 k( 191) = ( 0.4800000 0.3233162 0.2536781), wk = 0.0032895 k( 192) = ( 0.4733333 0.3348632 0.2536781), wk = 0.0032895 k( 193) = ( 0.4666667 0.3464102 0.2536781), wk = 0.0032895 k( 194) = ( 0.4600000 0.3579572 0.2536781), wk = 0.0032895 k( 195) = ( 0.4533333 0.3695042 0.2536781), wk = 0.0032895 k( 196) = ( 0.4466667 0.3810512 0.2536781), wk = 0.0032895 k( 197) = ( 0.4400000 0.3925982 0.2536781), wk = 0.0032895 k( 198) = ( 0.4333333 0.4041452 0.2536781), wk = 0.0032895 k( 199) = ( 0.4266667 0.4156922 0.2536781), wk = 0.0032895 k( 200) = ( 0.4200000 0.4272392 0.2536781), wk = 0.0032895 k( 201) = ( 0.4133333 0.4387862 0.2536781), wk = 0.0032895 k( 202) = ( 0.4066667 0.4503332 0.2536781), wk = 0.0032895 k( 203) = ( 0.4000000 0.4618802 0.2536781), wk = 0.0032895 k( 204) = ( 0.3933333 0.4734272 0.2536781), wk = 0.0032895 k( 205) = ( 0.3866667 0.4849742 0.2536781), wk = 0.0032895 k( 206) = ( 0.3800000 0.4965212 0.2536781), wk = 0.0032895 k( 207) = ( 0.3733333 0.5080682 0.2536781), wk = 0.0032895 k( 208) = ( 0.3666667 0.5196152 0.2536781), wk = 0.0032895 k( 209) = ( 0.3600000 0.5311622 0.2536781), wk = 0.0032895 k( 210) = ( 0.3533333 0.5427092 0.2536781), wk = 0.0032895 k( 211) = ( 0.3466667 0.5542563 0.2536781), wk = 0.0032895 k( 212) = ( 0.3400000 0.5658033 0.2536781), wk = 0.0032895 k( 213) = ( 0.3333333 0.5773503 0.2536781), wk = 0.0032895 k( 214) = ( 0.3333333 0.5773503 0.2536781), wk = 0.0032895 k( 215) = ( 0.3266667 0.5658033 0.2536781), wk = 0.0032895 k( 216) = ( 0.3200000 0.5542563 0.2536781), wk = 0.0032895 k( 217) = ( 0.3133333 0.5427092 0.2536781), wk = 0.0032895 k( 218) = ( 0.3066667 0.5311623 0.2536781), wk = 0.0032895 k( 219) = ( 0.3000000 0.5196152 0.2536781), wk = 0.0032895 k( 220) = ( 0.2933333 0.5080682 0.2536781), wk = 0.0032895 k( 221) = ( 0.2866667 0.4965212 0.2536781), wk = 0.0032895 k( 222) = ( 0.2800000 0.4849742 0.2536781), wk = 0.0032895 k( 223) = ( 0.2733333 0.4734272 0.2536781), wk = 0.0032895 k( 224) = ( 0.2666667 0.4618802 0.2536781), wk = 0.0032895 k( 225) = ( 0.2600000 0.4503332 0.2536781), wk = 0.0032895 k( 226) = ( 0.2533333 0.4387862 0.2536781), wk = 0.0032895 k( 227) = ( 0.2466667 0.4272392 0.2536781), wk = 0.0032895 k( 228) = ( 0.2400000 0.4156922 0.2536781), wk = 0.0032895 k( 229) = ( 0.2333333 0.4041452 0.2536781), wk = 0.0032895 k( 230) = ( 0.2266667 0.3925982 0.2536781), wk = 0.0032895 k( 231) = ( 0.2200000 0.3810512 0.2536781), wk = 0.0032895 k( 232) = ( 0.2133333 0.3695042 0.2536781), wk = 0.0032895 k( 233) = ( 0.2066667 0.3579572 0.2536781), wk = 0.0032895 k( 234) = ( 0.2000000 0.3464102 0.2536781), wk = 0.0032895 k( 235) = ( 0.1933333 0.3348632 0.2536781), wk = 0.0032895 k( 236) = ( 0.1866667 0.3233162 0.2536781), wk = 0.0032895 k( 237) = ( 0.1800000 0.3117691 0.2536781), wk = 0.0032895 k( 238) = ( 0.1733333 0.3002221 0.2536781), wk = 0.0032895 k( 239) = ( 0.1666667 0.2886751 0.2536781), wk = 0.0032895 k( 240) = ( 0.1600000 0.2771281 0.2536781), wk = 0.0032895 k( 241) = ( 0.1533333 0.2655811 0.2536781), wk = 0.0032895 k( 242) = ( 0.1466667 0.2540341 0.2536781), wk = 0.0032895 k( 243) = ( 0.1400000 0.2424871 0.2536781), wk = 0.0032895 k( 244) = ( 0.1333333 0.2309401 0.2536781), wk = 0.0032895 k( 245) = ( 0.1266667 0.2193931 0.2536781), wk = 0.0032895 k( 246) = ( 0.1200000 0.2078461 0.2536781), wk = 0.0032895 k( 247) = ( 0.1133333 0.1962991 0.2536781), wk = 0.0032895 k( 248) = ( 0.1066667 0.1847521 0.2536781), wk = 0.0032895 k( 249) = ( 0.1000000 0.1732051 0.2536781), wk = 0.0032895 k( 250) = ( 0.0933333 0.1616581 0.2536781), wk = 0.0032895 k( 251) = ( 0.0866667 0.1501111 0.2536781), wk = 0.0032895 k( 252) = ( 0.0800000 0.1385641 0.2536781), wk = 0.0032895 k( 253) = ( 0.0733333 0.1270171 0.2536781), wk = 0.0032895 k( 254) = ( 0.0666667 0.1154701 0.2536781), wk = 0.0032895 k( 255) = ( 0.0600000 0.1039230 0.2536781), wk = 0.0032895 k( 256) = ( 0.0533333 0.0923760 0.2536781), wk = 0.0032895 k( 257) = ( 0.0466667 0.0808290 0.2536781), wk = 0.0032895 k( 258) = ( 0.0400000 0.0692820 0.2536781), wk = 0.0032895 k( 259) = ( 0.0333333 0.0577350 0.2536781), wk = 0.0032895 k( 260) = ( 0.0266667 0.0461880 0.2536781), wk = 0.0032895 k( 261) = ( 0.0200000 0.0346410 0.2536781), wk = 0.0032895 k( 262) = ( 0.0133333 0.0230940 0.2536781), wk = 0.0032895 k( 263) = ( 0.0066667 0.0115470 0.2536781), wk = 0.0032895 k( 264) = ( 0.0000000 0.0000000 0.2536781), wk = 0.0032895 k( 265) = ( 0.5000000 0.2886751 0.2536781), wk = 0.0032895 k( 266) = ( 0.5000000 0.2886751 0.2403266), wk = 0.0032895 k( 267) = ( 0.5000000 0.2886751 0.2269752), wk = 0.0032895 k( 268) = ( 0.5000000 0.2886751 0.2136237), wk = 0.0032895 k( 269) = ( 0.5000000 0.2886751 0.2002722), wk = 0.0032895 k( 270) = ( 0.5000000 0.2886751 0.1869207), wk = 0.0032895 k( 271) = ( 0.5000000 0.2886751 0.1735692), wk = 0.0032895 k( 272) = ( 0.5000000 0.2886751 0.1602178), wk = 0.0032895 k( 273) = ( 0.5000000 0.2886751 0.1468663), wk = 0.0032895 k( 274) = ( 0.5000000 0.2886751 0.1335148), wk = 0.0032895 k( 275) = ( 0.5000000 0.2886751 0.1201633), wk = 0.0032895 k( 276) = ( 0.5000000 0.2886751 0.1068118), wk = 0.0032895 k( 277) = ( 0.5000000 0.2886751 0.0934604), wk = 0.0032895 k( 278) = ( 0.5000000 0.2886751 0.0801089), wk = 0.0032895 k( 279) = ( 0.5000000 0.2886751 0.0667574), wk = 0.0032895 k( 280) = ( 0.5000000 0.2886751 0.0534059), wk = 0.0032895 k( 281) = ( 0.5000000 0.2886751 0.0400544), wk = 0.0032895 k( 282) = ( 0.5000000 0.2886751 0.0267030), wk = 0.0032895 k( 283) = ( 0.5000000 0.2886751 0.0133515), wk = 0.0032895 k( 284) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0032895 k( 285) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0032895 k( 286) = ( 0.3333333 0.5773503 0.0133515), wk = 0.0032895 k( 287) = ( 0.3333333 0.5773503 0.0267030), wk = 0.0032895 k( 288) = ( 0.3333333 0.5773503 0.0400544), wk = 0.0032895 k( 289) = ( 0.3333333 0.5773503 0.0534059), wk = 0.0032895 k( 290) = ( 0.3333333 0.5773503 0.0667574), wk = 0.0032895 k( 291) = ( 0.3333333 0.5773503 0.0801089), wk = 0.0032895 k( 292) = ( 0.3333333 0.5773503 0.0934604), wk = 0.0032895 k( 293) = ( 0.3333333 0.5773503 0.1068118), wk = 0.0032895 k( 294) = ( 0.3333333 0.5773503 0.1201633), wk = 0.0032895 k( 295) = ( 0.3333333 0.5773503 0.1335148), wk = 0.0032895 k( 296) = ( 0.3333333 0.5773503 0.1468663), wk = 0.0032895 k( 297) = ( 0.3333333 0.5773503 0.1602178), wk = 0.0032895 k( 298) = ( 0.3333333 0.5773503 0.1735692), wk = 0.0032895 k( 299) = ( 0.3333333 0.5773503 0.1869207), wk = 0.0032895 k( 300) = ( 0.3333333 0.5773503 0.2002722), wk = 0.0032895 k( 301) = ( 0.3333333 0.5773503 0.2136237), wk = 0.0032895 k( 302) = ( 0.3333333 0.5773503 0.2269752), wk = 0.0032895 k( 303) = ( 0.3333333 0.5773503 0.2403266), wk = 0.0032895 k( 304) = ( 0.3333333 0.5773503 0.2536781), wk = 0.0032895 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 2) = ( 0.0113636 -0.0000000 0.0000000), wk = 0.0032895 k( 3) = ( 0.0227273 -0.0000000 0.0000000), wk = 0.0032895 k( 4) = ( 0.0340909 -0.0000000 -0.0000000), wk = 0.0032895 k( 5) = ( 0.0454546 -0.0000000 -0.0000000), wk = 0.0032895 k( 6) = ( 0.0568182 -0.0000000 -0.0000000), wk = 0.0032895 k( 7) = ( 0.0681818 -0.0000000 -0.0000000), wk = 0.0032895 k( 8) = ( 0.0795455 -0.0000000 0.0000000), wk = 0.0032895 k( 9) = ( 0.0909091 -0.0000000 0.0000000), wk = 0.0032895 k( 10) = ( 0.1022727 -0.0000000 -0.0000000), wk = 0.0032895 k( 11) = ( 0.1136364 -0.0000000 -0.0000000), wk = 0.0032895 k( 12) = ( 0.1250000 -0.0000000 0.0000000), wk = 0.0032895 k( 13) = ( 0.1363636 -0.0000000 -0.0000000), wk = 0.0032895 k( 14) = ( 0.1477273 -0.0000000 0.0000000), wk = 0.0032895 k( 15) = ( 0.1590909 -0.0000000 -0.0000000), wk = 0.0032895 k( 16) = ( 0.1704546 0.0000000 -0.0000000), wk = 0.0032895 k( 17) = ( 0.1818182 -0.0000000 0.0000000), wk = 0.0032895 k( 18) = ( 0.1931818 -0.0000000 -0.0000000), wk = 0.0032895 k( 19) = ( 0.2045454 -0.0000000 -0.0000000), wk = 0.0032895 k( 20) = ( 0.2159091 -0.0000000 -0.0000000), wk = 0.0032895 k( 21) = ( 0.2272727 -0.0000000 0.0000000), wk = 0.0032895 k( 22) = ( 0.2386364 -0.0000000 -0.0000000), wk = 0.0032895 k( 23) = ( 0.2500000 -0.0000000 0.0000000), wk = 0.0032895 k( 24) = ( 0.2613636 -0.0000000 -0.0000000), wk = 0.0032895 k( 25) = ( 0.2727273 -0.0000000 -0.0000000), wk = 0.0032895 k( 26) = ( 0.2840909 -0.0000000 -0.0000000), wk = 0.0032895 k( 27) = ( 0.2954545 -0.0000000 0.0000000), wk = 0.0032895 k( 28) = ( 0.3068182 -0.0000000 -0.0000000), wk = 0.0032895 k( 29) = ( 0.3181818 -0.0000000 -0.0000000), wk = 0.0032895 k( 30) = ( 0.3295455 -0.0000000 0.0000000), wk = 0.0032895 k( 31) = ( 0.3409091 -0.0000000 -0.0000000), wk = 0.0032895 k( 32) = ( 0.3522727 -0.0000000 -0.0000000), wk = 0.0032895 k( 33) = ( 0.3636364 -0.0000000 0.0000000), wk = 0.0032895 k( 34) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0032895 k( 35) = ( 0.3863636 -0.0000000 -0.0000000), wk = 0.0032895 k( 36) = ( 0.3977273 -0.0000000 -0.0000000), wk = 0.0032895 k( 37) = ( 0.4090909 -0.0000000 -0.0000000), wk = 0.0032895 k( 38) = ( 0.4204545 -0.0000000 -0.0000000), wk = 0.0032895 k( 39) = ( 0.4318182 -0.0000000 -0.0000000), wk = 0.0032895 k( 40) = ( 0.4431818 -0.0000000 -0.0000000), wk = 0.0032895 k( 41) = ( 0.4545455 -0.0000000 -0.0000000), wk = 0.0032895 k( 42) = ( 0.4659091 -0.0000000 -0.0000000), wk = 0.0032895 k( 43) = ( 0.4772727 -0.0000000 -0.0000000), wk = 0.0032895 k( 44) = ( 0.4886364 -0.0000000 -0.0000000), wk = 0.0032895 k( 45) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0032895 k( 46) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0032895 k( 47) = ( 0.4933333 0.0133333 -0.0000000), wk = 0.0032895 k( 48) = ( 0.4866667 0.0266667 -0.0000000), wk = 0.0032895 k( 49) = ( 0.4800000 0.0400000 -0.0000000), wk = 0.0032895 k( 50) = ( 0.4733333 0.0533333 -0.0000000), wk = 0.0032895 k( 51) = ( 0.4666667 0.0666667 -0.0000000), wk = 0.0032895 k( 52) = ( 0.4600000 0.0800000 -0.0000000), wk = 0.0032895 k( 53) = ( 0.4533333 0.0933333 -0.0000000), wk = 0.0032895 k( 54) = ( 0.4466667 0.1066667 0.0000000), wk = 0.0032895 k( 55) = ( 0.4400000 0.1200000 -0.0000000), wk = 0.0032895 k( 56) = ( 0.4333333 0.1333333 -0.0000000), wk = 0.0032895 k( 57) = ( 0.4266667 0.1466667 -0.0000000), wk = 0.0032895 k( 58) = ( 0.4200000 0.1600000 -0.0000000), wk = 0.0032895 k( 59) = ( 0.4133333 0.1733333 -0.0000000), wk = 0.0032895 k( 60) = ( 0.4066667 0.1866667 -0.0000000), wk = 0.0032895 k( 61) = ( 0.4000000 0.2000000 0.0000000), wk = 0.0032895 k( 62) = ( 0.3933333 0.2133333 -0.0000000), wk = 0.0032895 k( 63) = ( 0.3866667 0.2266667 0.0000000), wk = 0.0032895 k( 64) = ( 0.3800000 0.2400000 0.0000000), wk = 0.0032895 k( 65) = ( 0.3733333 0.2533333 -0.0000000), wk = 0.0032895 k( 66) = ( 0.3666667 0.2666667 0.0000000), wk = 0.0032895 k( 67) = ( 0.3600000 0.2800000 -0.0000000), wk = 0.0032895 k( 68) = ( 0.3533333 0.2933333 -0.0000000), wk = 0.0032895 k( 69) = ( 0.3466667 0.3066667 -0.0000000), wk = 0.0032895 k( 70) = ( 0.3400000 0.3200000 -0.0000000), wk = 0.0032895 k( 71) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0032895 k( 72) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0032895 k( 73) = ( 0.3266667 0.3266667 -0.0000000), wk = 0.0032895 k( 74) = ( 0.3200000 0.3200000 -0.0000000), wk = 0.0032895 k( 75) = ( 0.3133333 0.3133333 -0.0000000), wk = 0.0032895 k( 76) = ( 0.3066667 0.3066667 -0.0000000), wk = 0.0032895 k( 77) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0032895 k( 78) = ( 0.2933333 0.2933333 -0.0000000), wk = 0.0032895 k( 79) = ( 0.2866667 0.2866667 -0.0000000), wk = 0.0032895 k( 80) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0032895 k( 81) = ( 0.2733333 0.2733333 -0.0000000), wk = 0.0032895 k( 82) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0032895 k( 83) = ( 0.2600000 0.2600000 -0.0000000), wk = 0.0032895 k( 84) = ( 0.2533333 0.2533333 -0.0000000), wk = 0.0032895 k( 85) = ( 0.2466667 0.2466667 -0.0000000), wk = 0.0032895 k( 86) = ( 0.2400000 0.2400000 0.0000000), wk = 0.0032895 k( 87) = ( 0.2333333 0.2333333 -0.0000000), wk = 0.0032895 k( 88) = ( 0.2266667 0.2266667 0.0000000), wk = 0.0032895 k( 89) = ( 0.2200000 0.2200000 0.0000000), wk = 0.0032895 k( 90) = ( 0.2133333 0.2133333 -0.0000000), wk = 0.0032895 k( 91) = ( 0.2066667 0.2066667 0.0000000), wk = 0.0032895 k( 92) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0032895 k( 93) = ( 0.1933333 0.1933333 -0.0000000), wk = 0.0032895 k( 94) = ( 0.1866667 0.1866667 -0.0000000), wk = 0.0032895 k( 95) = ( 0.1800000 0.1800000 -0.0000000), wk = 0.0032895 k( 96) = ( 0.1733333 0.1733333 -0.0000000), wk = 0.0032895 k( 97) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0032895 k( 98) = ( 0.1600000 0.1600000 -0.0000000), wk = 0.0032895 k( 99) = ( 0.1533333 0.1533333 -0.0000000), wk = 0.0032895 k( 100) = ( 0.1466667 0.1466667 -0.0000000), wk = 0.0032895 k( 101) = ( 0.1400000 0.1400000 -0.0000000), wk = 0.0032895 k( 102) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0032895 k( 103) = ( 0.1266667 0.1266667 -0.0000000), wk = 0.0032895 k( 104) = ( 0.1200000 0.1200000 0.0000000), wk = 0.0032895 k( 105) = ( 0.1133333 0.1133333 -0.0000000), wk = 0.0032895 k( 106) = ( 0.1066667 0.1066667 -0.0000000), wk = 0.0032895 k( 107) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0032895 k( 108) = ( 0.0933333 0.0933333 0.0000000), wk = 0.0032895 k( 109) = ( 0.0866667 0.0866667 -0.0000000), wk = 0.0032895 k( 110) = ( 0.0800000 0.0800000 -0.0000000), wk = 0.0032895 k( 111) = ( 0.0733333 0.0733333 -0.0000000), wk = 0.0032895 k( 112) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0032895 k( 113) = ( 0.0600000 0.0600000 0.0000000), wk = 0.0032895 k( 114) = ( 0.0533333 0.0533333 -0.0000000), wk = 0.0032895 k( 115) = ( 0.0466667 0.0466667 -0.0000000), wk = 0.0032895 k( 116) = ( 0.0400000 0.0400000 -0.0000000), wk = 0.0032895 k( 117) = ( 0.0333333 0.0333333 -0.0000000), wk = 0.0032895 k( 118) = ( 0.0266667 0.0266667 -0.0000000), wk = 0.0032895 k( 119) = ( 0.0200000 0.0200000 -0.0000000), wk = 0.0032895 k( 120) = ( 0.0133333 0.0133333 -0.0000000), wk = 0.0032895 k( 121) = ( 0.0066667 0.0066667 -0.0000000), wk = 0.0032895 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 124) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0032895 k( 125) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0032895 k( 126) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0032895 k( 127) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0032895 k( 128) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0032895 k( 129) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0032895 k( 130) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0032895 k( 131) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0032895 k( 132) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0032895 k( 133) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0032895 k( 134) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0032895 k( 135) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0032895 k( 136) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0032895 k( 137) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0032895 k( 138) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0032895 k( 139) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0032895 k( 140) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0032895 k( 141) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0032895 k( 142) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032895 k( 143) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032895 k( 144) = ( 0.0113636 -0.0000000 0.5000000), wk = 0.0032895 k( 145) = ( 0.0227273 -0.0000000 0.5000000), wk = 0.0032895 k( 146) = ( 0.0340909 -0.0000000 0.5000000), wk = 0.0032895 k( 147) = ( 0.0454546 -0.0000000 0.5000000), wk = 0.0032895 k( 148) = ( 0.0568182 -0.0000000 0.5000000), wk = 0.0032895 k( 149) = ( 0.0681818 -0.0000000 0.5000000), wk = 0.0032895 k( 150) = ( 0.0795455 -0.0000000 0.5000000), wk = 0.0032895 k( 151) = ( 0.0909091 -0.0000000 0.5000000), wk = 0.0032895 k( 152) = ( 0.1022727 -0.0000000 0.5000000), wk = 0.0032895 k( 153) = ( 0.1136364 -0.0000000 0.5000000), wk = 0.0032895 k( 154) = ( 0.1250000 -0.0000000 0.5000000), wk = 0.0032895 k( 155) = ( 0.1363636 -0.0000000 0.5000000), wk = 0.0032895 k( 156) = ( 0.1477273 -0.0000000 0.5000000), wk = 0.0032895 k( 157) = ( 0.1590909 -0.0000000 0.5000000), wk = 0.0032895 k( 158) = ( 0.1704546 0.0000000 0.5000000), wk = 0.0032895 k( 159) = ( 0.1818182 -0.0000000 0.5000000), wk = 0.0032895 k( 160) = ( 0.1931818 -0.0000000 0.5000000), wk = 0.0032895 k( 161) = ( 0.2045454 -0.0000000 0.5000000), wk = 0.0032895 k( 162) = ( 0.2159091 -0.0000000 0.5000000), wk = 0.0032895 k( 163) = ( 0.2272727 -0.0000000 0.5000000), wk = 0.0032895 k( 164) = ( 0.2386364 -0.0000000 0.5000000), wk = 0.0032895 k( 165) = ( 0.2500000 -0.0000000 0.5000000), wk = 0.0032895 k( 166) = ( 0.2613636 -0.0000000 0.5000000), wk = 0.0032895 k( 167) = ( 0.2727273 -0.0000000 0.5000000), wk = 0.0032895 k( 168) = ( 0.2840909 -0.0000000 0.5000000), wk = 0.0032895 k( 169) = ( 0.2954545 -0.0000000 0.5000000), wk = 0.0032895 k( 170) = ( 0.3068182 -0.0000000 0.5000000), wk = 0.0032895 k( 171) = ( 0.3181818 -0.0000000 0.5000000), wk = 0.0032895 k( 172) = ( 0.3295455 -0.0000000 0.5000000), wk = 0.0032895 k( 173) = ( 0.3409091 -0.0000000 0.5000000), wk = 0.0032895 k( 174) = ( 0.3522727 -0.0000000 0.5000000), wk = 0.0032895 k( 175) = ( 0.3636364 -0.0000000 0.5000000), wk = 0.0032895 k( 176) = ( 0.3750000 -0.0000000 0.5000000), wk = 0.0032895 k( 177) = ( 0.3863636 -0.0000000 0.5000000), wk = 0.0032895 k( 178) = ( 0.3977273 -0.0000000 0.5000000), wk = 0.0032895 k( 179) = ( 0.4090909 -0.0000000 0.5000000), wk = 0.0032895 k( 180) = ( 0.4204545 -0.0000000 0.5000000), wk = 0.0032895 k( 181) = ( 0.4318182 -0.0000000 0.5000000), wk = 0.0032895 k( 182) = ( 0.4431818 -0.0000000 0.5000000), wk = 0.0032895 k( 183) = ( 0.4545455 -0.0000000 0.5000000), wk = 0.0032895 k( 184) = ( 0.4659091 -0.0000000 0.5000000), wk = 0.0032895 k( 185) = ( 0.4772727 -0.0000000 0.5000000), wk = 0.0032895 k( 186) = ( 0.4886364 -0.0000000 0.5000000), wk = 0.0032895 k( 187) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0032895 k( 188) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0032895 k( 189) = ( 0.4933333 0.0133333 0.5000000), wk = 0.0032895 k( 190) = ( 0.4866667 0.0266667 0.5000000), wk = 0.0032895 k( 191) = ( 0.4800000 0.0400000 0.5000000), wk = 0.0032895 k( 192) = ( 0.4733333 0.0533333 0.5000000), wk = 0.0032895 k( 193) = ( 0.4666667 0.0666667 0.5000000), wk = 0.0032895 k( 194) = ( 0.4600000 0.0800000 0.5000000), wk = 0.0032895 k( 195) = ( 0.4533333 0.0933333 0.5000000), wk = 0.0032895 k( 196) = ( 0.4466667 0.1066667 0.5000000), wk = 0.0032895 k( 197) = ( 0.4400000 0.1200000 0.5000000), wk = 0.0032895 k( 198) = ( 0.4333333 0.1333333 0.5000000), wk = 0.0032895 k( 199) = ( 0.4266667 0.1466667 0.5000000), wk = 0.0032895 k( 200) = ( 0.4200000 0.1600000 0.5000000), wk = 0.0032895 k( 201) = ( 0.4133333 0.1733333 0.5000000), wk = 0.0032895 k( 202) = ( 0.4066667 0.1866667 0.5000000), wk = 0.0032895 k( 203) = ( 0.4000000 0.2000000 0.5000000), wk = 0.0032895 k( 204) = ( 0.3933333 0.2133333 0.5000000), wk = 0.0032895 k( 205) = ( 0.3866667 0.2266667 0.5000000), wk = 0.0032895 k( 206) = ( 0.3800000 0.2400000 0.5000000), wk = 0.0032895 k( 207) = ( 0.3733333 0.2533333 0.5000000), wk = 0.0032895 k( 208) = ( 0.3666667 0.2666667 0.5000000), wk = 0.0032895 k( 209) = ( 0.3600000 0.2800000 0.5000000), wk = 0.0032895 k( 210) = ( 0.3533333 0.2933333 0.5000000), wk = 0.0032895 k( 211) = ( 0.3466667 0.3066667 0.5000000), wk = 0.0032895 k( 212) = ( 0.3400000 0.3200000 0.5000000), wk = 0.0032895 k( 213) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0032895 k( 214) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0032895 k( 215) = ( 0.3266667 0.3266667 0.5000000), wk = 0.0032895 k( 216) = ( 0.3200000 0.3200000 0.5000000), wk = 0.0032895 k( 217) = ( 0.3133333 0.3133333 0.5000000), wk = 0.0032895 k( 218) = ( 0.3066667 0.3066667 0.5000000), wk = 0.0032895 k( 219) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0032895 k( 220) = ( 0.2933333 0.2933333 0.5000000), wk = 0.0032895 k( 221) = ( 0.2866667 0.2866667 0.5000000), wk = 0.0032895 k( 222) = ( 0.2800000 0.2800000 0.5000000), wk = 0.0032895 k( 223) = ( 0.2733333 0.2733333 0.5000000), wk = 0.0032895 k( 224) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0032895 k( 225) = ( 0.2600000 0.2600000 0.5000000), wk = 0.0032895 k( 226) = ( 0.2533333 0.2533333 0.5000000), wk = 0.0032895 k( 227) = ( 0.2466667 0.2466667 0.5000000), wk = 0.0032895 k( 228) = ( 0.2400000 0.2400000 0.5000000), wk = 0.0032895 k( 229) = ( 0.2333333 0.2333333 0.5000000), wk = 0.0032895 k( 230) = ( 0.2266667 0.2266667 0.5000000), wk = 0.0032895 k( 231) = ( 0.2200000 0.2200000 0.5000000), wk = 0.0032895 k( 232) = ( 0.2133333 0.2133333 0.5000000), wk = 0.0032895 k( 233) = ( 0.2066667 0.2066667 0.5000000), wk = 0.0032895 k( 234) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0032895 k( 235) = ( 0.1933333 0.1933333 0.5000000), wk = 0.0032895 k( 236) = ( 0.1866667 0.1866667 0.5000000), wk = 0.0032895 k( 237) = ( 0.1800000 0.1800000 0.5000000), wk = 0.0032895 k( 238) = ( 0.1733333 0.1733333 0.5000000), wk = 0.0032895 k( 239) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0032895 k( 240) = ( 0.1600000 0.1600000 0.5000000), wk = 0.0032895 k( 241) = ( 0.1533333 0.1533333 0.5000000), wk = 0.0032895 k( 242) = ( 0.1466667 0.1466667 0.5000000), wk = 0.0032895 k( 243) = ( 0.1400000 0.1400000 0.5000000), wk = 0.0032895 k( 244) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0032895 k( 245) = ( 0.1266667 0.1266667 0.5000000), wk = 0.0032895 k( 246) = ( 0.1200000 0.1200000 0.5000000), wk = 0.0032895 k( 247) = ( 0.1133333 0.1133333 0.5000000), wk = 0.0032895 k( 248) = ( 0.1066667 0.1066667 0.5000000), wk = 0.0032895 k( 249) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0032895 k( 250) = ( 0.0933333 0.0933333 0.5000000), wk = 0.0032895 k( 251) = ( 0.0866667 0.0866667 0.5000000), wk = 0.0032895 k( 252) = ( 0.0800000 0.0800000 0.5000000), wk = 0.0032895 k( 253) = ( 0.0733333 0.0733333 0.5000000), wk = 0.0032895 k( 254) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0032895 k( 255) = ( 0.0600000 0.0600000 0.5000000), wk = 0.0032895 k( 256) = ( 0.0533333 0.0533333 0.5000000), wk = 0.0032895 k( 257) = ( 0.0466667 0.0466667 0.5000000), wk = 0.0032895 k( 258) = ( 0.0400000 0.0400000 0.5000000), wk = 0.0032895 k( 259) = ( 0.0333333 0.0333333 0.5000000), wk = 0.0032895 k( 260) = ( 0.0266667 0.0266667 0.5000000), wk = 0.0032895 k( 261) = ( 0.0200000 0.0200000 0.5000000), wk = 0.0032895 k( 262) = ( 0.0133333 0.0133333 0.5000000), wk = 0.0032895 k( 263) = ( 0.0066667 0.0066667 0.5000000), wk = 0.0032895 k( 264) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032895 k( 265) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0032895 k( 266) = ( 0.5000000 -0.0000000 0.4736842), wk = 0.0032895 k( 267) = ( 0.5000000 -0.0000000 0.4473684), wk = 0.0032895 k( 268) = ( 0.5000000 -0.0000000 0.4210526), wk = 0.0032895 k( 269) = ( 0.5000000 -0.0000000 0.3947368), wk = 0.0032895 k( 270) = ( 0.5000000 -0.0000000 0.3684211), wk = 0.0032895 k( 271) = ( 0.5000000 -0.0000000 0.3421053), wk = 0.0032895 k( 272) = ( 0.5000000 -0.0000000 0.3157895), wk = 0.0032895 k( 273) = ( 0.5000000 -0.0000000 0.2894737), wk = 0.0032895 k( 274) = ( 0.5000000 -0.0000000 0.2631579), wk = 0.0032895 k( 275) = ( 0.5000000 -0.0000000 0.2368421), wk = 0.0032895 k( 276) = ( 0.5000000 -0.0000000 0.2105263), wk = 0.0032895 k( 277) = ( 0.5000000 -0.0000000 0.1842105), wk = 0.0032895 k( 278) = ( 0.5000000 -0.0000000 0.1578947), wk = 0.0032895 k( 279) = ( 0.5000000 -0.0000000 0.1315790), wk = 0.0032895 k( 280) = ( 0.5000000 -0.0000000 0.1052632), wk = 0.0032895 k( 281) = ( 0.5000000 -0.0000000 0.0789474), wk = 0.0032895 k( 282) = ( 0.5000000 -0.0000000 0.0526316), wk = 0.0032895 k( 283) = ( 0.5000000 -0.0000000 0.0263158), wk = 0.0032895 k( 284) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0032895 k( 285) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0032895 k( 286) = ( 0.3333333 0.3333333 0.0263158), wk = 0.0032895 k( 287) = ( 0.3333333 0.3333333 0.0526316), wk = 0.0032895 k( 288) = ( 0.3333333 0.3333333 0.0789474), wk = 0.0032895 k( 289) = ( 0.3333333 0.3333333 0.1052632), wk = 0.0032895 k( 290) = ( 0.3333333 0.3333333 0.1315790), wk = 0.0032895 k( 291) = ( 0.3333333 0.3333333 0.1578947), wk = 0.0032895 k( 292) = ( 0.3333333 0.3333333 0.1842105), wk = 0.0032895 k( 293) = ( 0.3333333 0.3333333 0.2105263), wk = 0.0032895 k( 294) = ( 0.3333333 0.3333333 0.2368421), wk = 0.0032895 k( 295) = ( 0.3333333 0.3333333 0.2631579), wk = 0.0032895 k( 296) = ( 0.3333333 0.3333333 0.2894737), wk = 0.0032895 k( 297) = ( 0.3333333 0.3333333 0.3157895), wk = 0.0032895 k( 298) = ( 0.3333333 0.3333333 0.3421053), wk = 0.0032895 k( 299) = ( 0.3333333 0.3333333 0.3684211), wk = 0.0032895 k( 300) = ( 0.3333333 0.3333333 0.3947368), wk = 0.0032895 k( 301) = ( 0.3333333 0.3333333 0.4210526), wk = 0.0032895 k( 302) = ( 0.3333333 0.3333333 0.4473684), wk = 0.0032895 k( 303) = ( 0.3333333 0.3333333 0.4736842), wk = 0.0032895 k( 304) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0032895 Dense grid: 54617 G-vectors FFT dimensions: ( 40, 40, 80) Smooth grid: 40973 G-vectors FFT dimensions: ( 36, 36, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.32 Mb ( 296, 70) NL pseudopotentials 0.53 Mb ( 148, 236) Each V/rho on FFT grid 0.07 Mb ( 4800) Each G-vector array 0.01 Mb ( 1519) G-vector shells 0.01 Mb ( 738) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.26 Mb ( 296, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.50 Mb ( 236, 2, 70) The potential is recalculated from file : ./ZrNi2Sb.save/charge-density.dat Starting wfc are 124 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.0 secs Computing kpt #: 2 total cpu time spent up to now is 3.8 secs Computing kpt #: 3 total cpu time spent up to now is 4.7 secs Computing kpt #: 4 total cpu time spent up to now is 5.7 secs Computing kpt #: 5 total cpu time spent up to now is 6.5 secs Computing kpt #: 6 total cpu time spent up to now is 7.5 secs Computing kpt #: 7 total cpu time spent up to now is 8.4 secs Computing kpt #: 8 total cpu time spent up to now is 9.4 secs Computing kpt #: 9 total cpu time spent up to now is 10.4 secs Computing kpt #: 10 total cpu time spent up to now is 11.4 secs Computing kpt #: 11 total cpu time spent up to now is 12.4 secs Computing kpt #: 12 total cpu time spent up to now is 13.4 secs Computing kpt #: 13 total cpu time spent up to now is 14.4 secs Computing kpt #: 14 total cpu time spent up to now is 15.4 secs Computing kpt #: 15 total cpu time spent up to now is 16.3 secs Computing kpt #: 16 total cpu time spent up to now is 17.2 secs Computing kpt #: 17 total cpu time spent up to now is 18.1 secs Computing kpt #: 18 total cpu time spent up to now is 19.0 secs Computing kpt #: 19 total cpu time spent up to now is 19.9 secs Computing kpt #: 20 total cpu time spent up to now is 20.9 secs Computing kpt #: 21 total cpu time spent up to now is 21.9 secs Computing kpt #: 22 total cpu time spent up to now is 22.8 secs Computing kpt #: 23 total cpu time spent up to now is 23.8 secs Computing kpt #: 24 total cpu time spent up to now is 24.7 secs Computing kpt #: 25 total cpu time spent up to now is 25.6 secs Computing kpt #: 26 total cpu time spent up to now is 26.4 secs Computing kpt #: 27 total cpu time spent up to now is 27.3 secs Computing kpt #: 28 total cpu time spent up to now is 28.2 secs Computing kpt #: 29 total cpu time spent up to now is 29.0 secs Computing kpt #: 30 total cpu time spent up to now is 30.2 secs Computing kpt #: 31 total cpu time spent up to now is 31.2 secs Computing kpt #: 32 total cpu time spent up to now is 32.1 secs Computing kpt #: 33 total cpu time spent up to now is 33.0 secs Computing kpt #: 34 total cpu time spent up to now is 33.9 secs Computing kpt #: 35 total cpu time spent up to now is 34.8 secs Computing kpt #: 36 total cpu time spent up to now is 35.8 secs Computing kpt #: 37 total cpu time spent up to now is 36.8 secs Computing kpt #: 38 total cpu time spent up to now is 37.7 secs Computing kpt #: 39 total cpu time spent up to now is 38.6 secs Computing kpt #: 40 total cpu time spent up to now is 39.6 secs Computing kpt #: 41 total cpu time spent up to now is 40.5 secs Computing kpt #: 42 total cpu time spent up to now is 41.5 secs Computing kpt #: 43 total cpu time spent up to now is 42.4 secs Computing kpt #: 44 total cpu time spent up to now is 43.4 secs Computing kpt #: 45 total cpu time spent up to now is 44.3 secs Computing kpt #: 46 total cpu time spent up to now is 45.2 secs Computing kpt #: 47 total cpu time spent up to now is 46.1 secs Computing kpt #: 48 total cpu time spent up to now is 47.0 secs Computing kpt #: 49 total cpu time spent up to now is 47.9 secs Computing kpt #: 50 total cpu time spent up to now is 48.9 secs Computing kpt #: 51 total cpu time spent up to now is 49.8 secs Computing kpt #: 52 total cpu time spent up to now is 50.7 secs Computing kpt #: 53 total cpu time spent up to now is 51.6 secs Computing kpt #: 54 total cpu time spent up to now is 52.5 secs Computing kpt #: 55 total cpu time spent up to now is 53.3 secs Computing kpt #: 56 total cpu time spent up to now is 54.1 secs Computing kpt #: 57 total cpu time spent up to now is 55.0 secs Computing kpt #: 58 total cpu time spent up to now is 55.8 secs Computing kpt #: 59 total cpu time spent up to now is 56.6 secs Computing kpt #: 60 total cpu time spent up to now is 57.4 secs Computing kpt #: 61 total cpu time spent up to now is 58.2 secs Computing kpt #: 62 total cpu time spent up to now is 59.0 secs Computing kpt #: 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71.4 secs Computing kpt #: 79 total cpu time spent up to now is 72.2 secs Computing kpt #: 80 total cpu time spent up to now is 73.1 secs Computing kpt #: 81 total cpu time spent up to now is 74.0 secs Computing kpt #: 82 total cpu time spent up to now is 74.9 secs Computing kpt #: 83 total cpu time spent up to now is 75.8 secs Computing kpt #: 84 total cpu time spent up to now is 76.7 secs Computing kpt #: 85 total cpu time spent up to now is 77.8 secs Computing kpt #: 86 total cpu time spent up to now is 78.8 secs Computing kpt #: 87 total cpu time spent up to now is 79.7 secs Computing kpt #: 88 total cpu time spent up to now is 80.7 secs Computing kpt #: 89 total cpu time spent up to now is 81.7 secs Computing kpt #: 90 total cpu time spent up to now is 82.6 secs Computing kpt #: 91 total cpu time spent up to now is 83.6 secs Computing kpt #: 92 total cpu time spent up to now is 84.6 secs Computing kpt #: 93 total cpu time spent up to now is 85.6 secs Computing kpt #: 94 total cpu 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secs Computing kpt #: 110 total cpu time spent up to now is 100.7 secs Computing kpt #: 111 total cpu time spent up to now is 101.7 secs Computing kpt #: 112 total cpu time spent up to now is 102.7 secs Computing kpt #: 113 total cpu time spent up to now is 103.7 secs Computing kpt #: 114 total cpu time spent up to now is 104.8 secs Computing kpt #: 115 total cpu time spent up to now is 105.8 secs Computing kpt #: 116 total cpu time spent up to now is 106.8 secs Computing kpt #: 117 total cpu time spent up to now is 107.8 secs Computing kpt #: 118 total cpu time spent up to now is 108.8 secs Computing kpt #: 119 total cpu time spent up to now is 109.7 secs Computing kpt #: 120 total cpu time spent up to now is 110.6 secs Computing kpt #: 121 total cpu time spent up to now is 111.6 secs Computing kpt #: 122 total cpu time spent up to now is 112.4 secs Computing kpt #: 123 total cpu time spent up to now is 113.3 secs Computing kpt #: 124 total cpu time spent up to now is 114.1 secs Computing kpt #: 125 total cpu time spent up to now is 115.0 secs Computing kpt #: 126 total cpu time spent up to now is 115.9 secs Computing kpt #: 127 total cpu time spent up to now is 116.8 secs Computing kpt #: 128 total cpu time spent up to now is 117.8 secs Computing kpt #: 129 total cpu time spent up to now is 118.8 secs Computing kpt #: 130 total cpu time spent up to now is 119.8 secs Computing kpt #: 131 total cpu time spent up to now is 120.8 secs Computing kpt #: 132 total cpu time spent up to now is 121.8 secs Computing kpt #: 133 total cpu time spent up to now is 122.8 secs Computing kpt #: 134 total cpu time spent up to now is 123.8 secs Computing kpt #: 135 total cpu time spent up to now is 124.8 secs Computing kpt #: 136 total cpu time spent up to now is 125.8 secs Computing kpt #: 137 total cpu time spent up to now is 126.8 secs Computing kpt #: 138 total cpu time spent up to now is 127.8 secs Computing kpt #: 139 total cpu time spent up to now is 128.8 secs Computing kpt #: 140 total cpu time spent up to now is 129.8 secs Computing kpt #: 141 total cpu time spent up to now is 130.9 secs Computing kpt #: 142 total cpu time spent up to now is 131.9 secs Computing kpt #: 143 total cpu time spent up to now is 132.9 secs Computing kpt #: 144 total cpu time spent up to now is 133.8 secs Computing kpt #: 145 total cpu time spent up to now is 134.9 secs Computing kpt #: 146 total cpu time spent up to now is 135.9 secs Computing kpt #: 147 total cpu time spent up to now is 136.9 secs Computing kpt #: 148 total cpu time spent up to now is 137.9 secs Computing kpt #: 149 total cpu time spent up to now is 138.9 secs Computing kpt #: 150 total cpu time spent up to now is 139.9 secs Computing kpt #: 151 total cpu time spent up to now is 140.9 secs Computing kpt #: 152 total cpu time spent up to now is 141.9 secs Computing kpt #: 153 total cpu time spent up to now is 142.9 secs Computing kpt #: 154 total cpu time spent up to now is 143.9 secs Computing kpt #: 155 total cpu time spent up to now is 144.9 secs Computing kpt #: 156 total cpu time spent up to now is 145.8 secs Computing kpt #: 157 total cpu time spent up to now is 146.7 secs Computing kpt #: 158 total cpu time spent up to now is 147.5 secs Computing kpt #: 159 total cpu time spent up to now is 148.4 secs Computing kpt #: 160 total cpu time spent up to now is 149.3 secs Computing kpt #: 161 total cpu time spent up to now is 150.1 secs Computing kpt #: 162 total cpu time spent up to now is 151.0 secs Computing kpt #: 163 total cpu time spent up to now is 151.8 secs Computing kpt #: 164 total cpu time spent up to now is 152.6 secs Computing kpt #: 165 total cpu time spent up to now is 153.5 secs Computing kpt #: 166 total cpu time spent up to now is 154.3 secs Computing kpt #: 167 total cpu time spent up to now is 155.1 secs Computing kpt #: 168 total cpu time spent up to now is 156.0 secs Computing kpt #: 169 total cpu time spent up to now is 156.8 secs Computing kpt #: 170 total cpu time spent up to now is 157.7 secs Computing kpt #: 171 total cpu time spent up to now is 158.5 secs Computing kpt #: 172 total cpu time spent up to now is 159.3 secs Computing kpt #: 173 total cpu time spent up to now is 160.2 secs Computing kpt #: 174 total cpu time spent up to now is 161.1 secs Computing kpt #: 175 total cpu time spent up to now is 161.9 secs Computing kpt #: 176 total cpu time spent up to now is 162.8 secs Computing kpt #: 177 total cpu time spent up to now is 163.6 secs Computing kpt #: 178 total cpu time spent up to now is 164.5 secs Computing kpt #: 179 total cpu time spent up to now is 165.4 secs Computing kpt #: 180 total cpu time spent up to now is 166.2 secs Computing kpt #: 181 total cpu time spent up to now is 167.1 secs Computing kpt #: 182 total cpu time spent up to now is 168.0 secs Computing kpt #: 183 total cpu time spent up to now is 168.9 secs Computing kpt #: 184 total cpu time spent up to now is 169.9 secs Computing kpt #: 185 total cpu time spent up to now is 170.8 secs Computing kpt #: 186 total cpu time spent up to now is 171.8 secs Computing kpt #: 187 total cpu time spent up to now is 172.7 secs Computing kpt #: 188 total cpu time spent up to now is 173.7 secs Computing kpt #: 189 total cpu time spent up to now is 174.6 secs Computing kpt #: 190 total cpu time spent up to now is 175.6 secs Computing kpt #: 191 total cpu time spent up to now is 176.6 secs Computing kpt #: 192 total cpu time spent up to now is 177.5 secs Computing kpt #: 193 total cpu time spent up to now is 178.5 secs Computing kpt #: 194 total cpu time spent up to now is 179.4 secs Computing kpt #: 195 total cpu time spent up to now is 180.3 secs Computing kpt #: 196 total cpu time spent up to now is 181.2 secs Computing kpt #: 197 total cpu time spent up to now is 182.2 secs Computing kpt #: 198 total cpu time spent up to now is 183.0 secs Computing kpt #: 199 total cpu time spent up to now is 183.9 secs Computing kpt #: 200 total cpu time spent up to now is 184.8 secs Computing kpt #: 201 total cpu time spent up to now is 185.7 secs Computing kpt #: 202 total cpu time spent up to now is 186.6 secs Computing kpt #: 203 total cpu time spent up to now is 187.5 secs Computing kpt #: 204 total cpu time spent up to now is 188.3 secs Computing kpt #: 205 total cpu time spent up to now is 189.2 secs Computing kpt #: 206 total cpu time spent up to now is 190.1 secs Computing kpt #: 207 total cpu time spent up to now is 191.0 secs Computing kpt #: 208 total cpu time spent up to now is 191.8 secs Computing kpt #: 209 total cpu time spent up to now is 192.7 secs Computing kpt #: 210 total cpu time spent up to now is 193.7 secs Computing kpt #: 211 total cpu time spent up to now is 194.6 secs Computing kpt #: 212 total cpu time spent up to now is 195.5 secs Computing kpt #: 213 total cpu time spent up to now is 196.3 secs Computing kpt #: 214 total cpu time spent up to now is 197.2 secs Computing kpt #: 215 total cpu time spent up to now is 198.1 secs Computing kpt #: 216 total cpu time spent up to now is 199.0 secs Computing kpt #: 217 total cpu time spent up to now is 199.9 secs Computing kpt #: 218 total cpu time spent up to now is 200.8 secs Computing kpt #: 219 total cpu time spent up to now is 201.7 secs Computing kpt #: 220 total cpu time spent up to now is 202.6 secs Computing kpt #: 221 total cpu time spent up to now is 203.4 secs Computing kpt #: 222 total cpu time spent up to now is 204.3 secs Computing kpt #: 223 total cpu time spent up to now is 205.2 secs Computing kpt #: 224 total cpu time spent up to now is 206.1 secs Computing kpt #: 225 total cpu time spent up to now is 207.0 secs Computing kpt #: 226 total cpu time spent up to now is 207.9 secs Computing kpt #: 227 total cpu time spent up to now is 208.9 secs Computing kpt #: 228 total cpu time spent up to now is 209.9 secs Computing kpt #: 229 total cpu time spent up to now is 210.9 secs Computing kpt #: 230 total cpu time spent up to now is 211.8 secs Computing kpt #: 231 total cpu time spent up to now is 212.8 secs Computing kpt #: 232 total cpu time spent up to now is 213.7 secs Computing kpt #: 233 total cpu time spent up to now is 214.7 secs Computing kpt #: 234 total cpu time spent up to now is 215.7 secs Computing kpt #: 235 total cpu time spent up to now is 216.7 secs Computing kpt #: 236 total cpu time spent up to now is 217.8 secs Computing kpt #: 237 total cpu time spent up to now is 218.8 secs Computing kpt #: 238 total cpu time spent up to now is 219.9 secs Computing kpt #: 239 total cpu time spent up to now is 220.9 secs Computing kpt #: 240 total cpu time spent up to now is 222.0 secs Computing kpt #: 241 total cpu time spent up to now is 223.0 secs Computing kpt #: 242 total cpu time spent up to now is 223.9 secs Computing kpt #: 243 total cpu time spent up to now is 224.9 secs Computing kpt #: 244 total cpu time spent up to now is 225.8 secs Computing kpt #: 245 total cpu time spent up to now is 226.8 secs Computing kpt #: 246 total cpu time spent up to now is 227.7 secs Computing kpt #: 247 total cpu time spent up to now is 228.7 secs Computing kpt #: 248 total cpu time spent up to now is 229.7 secs Computing kpt #: 249 total cpu time spent up to now is 230.7 secs Computing kpt #: 250 total cpu time spent up to now is 231.7 secs Computing kpt #: 251 total cpu time spent up to now is 232.6 secs Computing kpt #: 252 total cpu time spent up to now is 233.6 secs Computing kpt #: 253 total cpu time spent up to now is 234.6 secs Computing kpt #: 254 total cpu time spent up to now is 235.6 secs Computing kpt #: 255 total cpu time spent up to now is 236.6 secs Computing kpt #: 256 total cpu time spent up to now is 237.7 secs Computing kpt #: 257 total cpu time spent up to now is 238.7 secs Computing kpt #: 258 total cpu time spent up to now is 239.7 secs Computing kpt #: 259 total cpu time spent up to now is 240.8 secs Computing kpt #: 260 total cpu time spent up to now is 241.9 secs Computing kpt #: 261 total cpu time spent up to now is 242.9 secs Computing kpt #: 262 total cpu time spent up to now is 243.9 secs Computing kpt #: 263 total cpu time spent up to now is 245.0 secs Computing kpt #: 264 total cpu time spent up to now is 246.0 secs Computing kpt #: 265 total cpu time spent up to now is 246.9 secs Computing kpt #: 266 total cpu time spent up to now is 247.9 secs Computing kpt #: 267 total cpu time spent up to now is 248.8 secs Computing kpt #: 268 total cpu time spent up to now is 249.8 secs Computing kpt #: 269 total cpu time spent up to now is 250.8 secs Computing kpt #: 270 total cpu time spent up to now is 251.7 secs Computing kpt #: 271 total cpu time spent up to now is 252.6 secs Computing kpt #: 272 total cpu time spent up to now is 253.4 secs Computing kpt #: 273 total cpu time spent up to now is 254.3 secs Computing kpt #: 274 total cpu time spent up to now is 255.2 secs Computing kpt #: 275 total cpu time spent up to now is 256.0 secs Computing kpt #: 276 total cpu time spent up to now is 256.9 secs Computing kpt #: 277 total cpu time spent up to now is 257.8 secs Computing kpt #: 278 total cpu time spent up to now is 258.6 secs Computing kpt #: 279 total cpu time spent up to now is 259.6 secs Computing kpt #: 280 total cpu time spent up to now is 260.4 secs Computing kpt #: 281 total cpu time spent up to now is 261.3 secs Computing kpt #: 282 total cpu time spent up to now is 262.3 secs Computing kpt #: 283 total cpu time spent up to now is 263.2 secs Computing kpt #: 284 total cpu time spent up to now is 264.1 secs Computing kpt #: 285 total cpu time spent up to now is 264.8 secs Computing kpt #: 286 total cpu time spent up to now is 265.6 secs Computing kpt #: 287 total cpu time spent up to now is 266.4 secs Computing kpt #: 288 total cpu time spent up to now is 267.1 secs Computing kpt #: 289 total cpu time spent up to now is 267.9 secs Computing kpt #: 290 total cpu time spent up to now is 268.6 secs Computing kpt #: 291 total cpu time spent up to now is 269.4 secs Computing kpt #: 292 total cpu time spent up to now is 270.2 secs Computing kpt #: 293 total cpu time spent up to now is 270.9 secs Computing kpt #: 294 total cpu time spent up to now is 271.7 secs Computing kpt #: 295 total cpu time spent up to now is 272.5 secs Computing kpt #: 296 total cpu time spent up to now is 273.3 secs Computing kpt #: 297 total cpu time spent up to now is 274.1 secs Computing kpt #: 298 total cpu time spent up to now is 274.8 secs Computing kpt #: 299 total cpu time spent up to now is 275.6 secs Computing kpt #: 300 total cpu time spent up to now is 276.4 secs Computing kpt #: 301 total cpu time spent up to now is 277.2 secs Computing kpt #: 302 total cpu time spent up to now is 278.0 secs Computing kpt #: 303 total cpu time spent up to now is 278.9 secs Computing kpt #: 304 total cpu time spent up to now is 279.8 secs ethr = 1.72E-08, avg # of iterations = 20.9 total cpu time spent up to now is 279.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5117 PWs) bands (ev): -0.4222 -0.4222 0.4395 0.4395 5.1231 5.1231 7.2325 7.2325 7.3256 7.3256 7.3633 7.3633 7.5207 7.5207 8.1227 8.1227 8.2547 8.2547 8.6128 8.6128 8.6160 8.6160 8.6714 8.6714 8.7079 8.7079 8.8184 8.8184 8.9924 8.9924 9.0472 9.0472 9.6039 9.6039 9.7070 9.7070 9.8593 9.8593 10.0518 10.0518 10.0624 10.0624 10.4741 10.4741 10.5194 10.5194 10.6118 10.6118 11.5015 11.5015 11.5046 11.5046 11.6866 11.6866 11.7020 11.7020 12.1212 12.1212 12.5841 12.5841 12.5954 12.5954 12.6866 12.6866 13.2882 13.2882 13.4243 13.4243 13.4330 13.4330 k = 0.0114 0.0066-0.0000 ( 5105 PWs) bands (ev): -0.4208 -0.4208 0.4403 0.4403 5.1246 5.1246 7.2320 7.2320 7.3234 7.3234 7.3629 7.3629 7.5184 7.5184 8.1211 8.1211 8.2545 8.2545 8.6137 8.6137 8.6166 8.6166 8.6723 8.6723 8.7089 8.7089 8.8198 8.8198 8.9920 8.9920 9.0469 9.0469 9.6041 9.6041 9.7071 9.7071 9.8613 9.8613 10.0518 10.0518 10.0620 10.0620 10.4737 10.4737 10.5189 10.5189 10.6115 10.6115 11.4844 11.4844 11.4905 11.4905 11.6970 11.6970 11.7125 11.7125 12.1201 12.1201 12.5715 12.5715 12.5854 12.5854 12.6964 12.6964 13.2951 13.2951 13.4235 13.4235 13.4359 13.4359 k = 0.0227 0.0131-0.0000 ( 5117 PWs) bands (ev): -0.4169 -0.4169 0.4429 0.4429 5.1293 5.1293 7.2302 7.2302 7.3165 7.3165 7.3616 7.3616 7.5121 7.5121 8.1166 8.1166 8.2541 8.2541 8.6163 8.6163 8.6186 8.6186 8.6748 8.6748 8.7120 8.7120 8.8238 8.8238 8.9908 8.9908 9.0459 9.0459 9.6042 9.6042 9.7070 9.7070 9.8672 9.8672 10.0518 10.0518 10.0610 10.0610 10.4722 10.4722 10.5176 10.5176 10.6105 10.6105 11.4380 11.4380 11.4582 11.4582 11.7171 11.7171 11.7407 11.7407 12.1168 12.1168 12.5357 12.5357 12.5562 12.5562 12.7249 12.7249 13.3121 13.3121 13.4207 13.4207 13.4453 13.4453 k = 0.0341 0.0197-0.0000 ( 5117 PWs) bands (ev): -0.4103 -0.4103 0.4471 0.4471 5.1369 5.1369 7.2272 7.2272 7.3039 7.3039 7.3596 7.3596 7.5030 7.5030 8.1094 8.1094 8.2535 8.2535 8.6203 8.6203 8.6218 8.6218 8.6788 8.6788 8.7174 8.7174 8.8303 8.8303 8.9886 8.9886 9.0450 9.0450 9.6045 9.6045 9.7069 9.7069 9.8767 9.8767 10.0519 10.0519 10.0594 10.0594 10.4697 10.4697 10.5156 10.5156 10.6089 10.6089 11.3743 11.3743 11.4169 11.4169 11.7344 11.7344 11.7796 11.7796 12.1112 12.1112 12.4818 12.4818 12.5102 12.5102 12.7703 12.7703 13.3310 13.3310 13.4161 13.4161 13.4619 13.4619 k = 0.0455 0.0262-0.0000 ( 5117 PWs) bands (ev): -0.4012 -0.4012 0.4530 0.4530 5.1477 5.1477 7.2225 7.2225 7.2841 7.2841 7.3569 7.3569 7.4930 7.4930 8.1000 8.1000 8.2525 8.2525 8.6250 8.6250 8.6269 8.6269 8.6837 8.6837 8.7254 8.7254 8.8388 8.8388 8.9854 8.9854 9.0448 9.0448 9.6048 9.6048 9.7067 9.7067 9.8893 9.8893 10.0521 10.0521 10.0572 10.0572 10.4660 10.4660 10.5128 10.5128 10.6065 10.6065 11.2999 11.2999 11.3714 11.3714 11.7460 11.7460 11.8231 11.8231 12.1031 12.1031 12.4156 12.4156 12.4506 12.4506 12.8302 12.8302 13.3453 13.3453 13.4099 13.4099 13.4826 13.4826 k = 0.0568 0.0328-0.0000 ( 5117 PWs) bands (ev): -0.3894 -0.3894 0.4606 0.4606 5.1614 5.1614 7.2158 7.2158 7.2558 7.2558 7.3537 7.3537 7.4840 7.4840 8.0889 8.0889 8.2512 8.2512 8.6300 8.6300 8.6335 8.6335 8.6893 8.6893 8.7359 8.7359 8.8488 8.8488 8.9812 8.9812 9.0459 9.0459 9.6050 9.6050 9.7062 9.7062 9.9043 9.9043 10.0524 10.0524 10.0545 10.0545 10.4612 10.4612 10.5096 10.5096 10.6033 10.6033 11.2184 11.2184 11.3239 11.3239 11.7516 11.7516 11.8677 11.8677 12.0912 12.0912 12.3425 12.3425 12.3814 12.3814 12.9019 12.9019 13.3521 13.3521 13.4029 13.4029 13.5007 13.5007 k = 0.0682 0.0394-0.0000 ( 5123 PWs) bands (ev): -0.3751 -0.3751 0.4698 0.4698 5.1782 5.1782 7.2055 7.2055 7.2195 7.2195 7.3504 7.3504 7.4773 7.4773 8.0768 8.0768 8.2496 8.2496 8.6355 8.6355 8.6413 8.6413 8.6953 8.6953 8.7489 8.7489 8.8593 8.8593 8.9772 8.9772 9.0487 9.0487 9.6051 9.6051 9.7057 9.7057 9.9207 9.9207 10.0501 10.0501 10.0547 10.0547 10.4551 10.4551 10.5058 10.5058 10.5991 10.5991 11.1321 11.1321 11.2753 11.2753 11.7518 11.7518 11.9109 11.9109 12.0730 12.0730 12.2694 12.2694 12.3069 12.3069 12.9828 12.9828 13.3495 13.3495 13.3964 13.3964 13.5107 13.5107 k = 0.0795 0.0459-0.0000 ( 5127 PWs) bands (ev): -0.3582 -0.3582 0.4806 0.4806 5.1978 5.1978 7.1698 7.1698 7.1965 7.1965 7.3470 7.3470 7.4733 7.4733 8.0643 8.0643 8.2476 8.2476 8.6415 8.6415 8.6502 8.6502 8.7018 8.7018 8.7639 8.7639 8.8691 8.8691 8.9748 8.9748 9.0529 9.0529 9.6050 9.6050 9.7049 9.7049 9.9374 9.9374 10.0458 10.0458 10.0576 10.0576 10.4476 10.4476 10.5017 10.5017 10.5940 10.5940 11.0426 11.0426 11.2262 11.2262 11.7473 11.7473 11.9453 11.9453 12.0471 12.0471 12.2043 12.2043 12.2323 12.2323 13.0706 13.0706 13.3372 13.3372 13.3899 13.3899 13.5116 13.5116 k = 0.0909 0.0525-0.0000 ( 5125 PWs) bands (ev): -0.3387 -0.3387 0.4931 0.4931 5.2204 5.2204 7.1153 7.1153 7.1806 7.1806 7.3441 7.3441 7.4719 7.4719 8.0519 8.0519 8.2451 8.2451 8.6479 8.6479 8.6601 8.6601 8.7089 8.7089 8.7803 8.7803 8.8765 8.8765 8.9760 8.9760 9.0585 9.0585 9.6047 9.6047 9.7042 9.7042 9.9528 9.9528 10.0409 10.0409 10.0629 10.0629 10.4386 10.4386 10.4973 10.4973 10.5877 10.5877 10.9513 10.9513 11.1769 11.1769 11.7392 11.7392 11.9383 11.9383 12.0368 12.0368 12.1394 12.1394 12.1790 12.1790 13.1626 13.1626 13.3172 13.3172 13.3811 13.3811 13.5080 13.5080 k = 0.1023 0.0590-0.0000 ( 5129 PWs) bands (ev): -0.3168 -0.3168 0.5072 0.5072 5.2459 5.2459 7.0531 7.0531 7.1612 7.1612 7.3417 7.3417 7.4728 7.4728 8.0402 8.0402 8.2422 8.2422 8.6547 8.6547 8.6710 8.6710 8.7165 8.7165 8.7974 8.7974 8.8806 8.8806 8.9821 8.9821 9.0653 9.0653 9.6042 9.6042 9.7034 9.7034 9.9652 9.9652 10.0351 10.0351 10.0716 10.0716 10.4282 10.4282 10.4926 10.4926 10.5801 10.5801 10.8592 10.8592 11.1276 11.1276 11.7281 11.7281 11.8754 11.8754 12.0450 12.0450 12.0735 12.0735 12.1623 12.1623 13.2520 13.2520 13.2947 13.2947 13.3714 13.3714 13.4994 13.4994 k = 0.1136 0.0656-0.0000 ( 5137 PWs) bands (ev): -0.2925 -0.2925 0.5229 0.5229 5.2741 5.2741 6.9845 6.9845 7.1375 7.1375 7.3400 7.3400 7.4754 7.4754 8.0296 8.0296 8.2386 8.2386 8.6618 8.6618 8.6828 8.6828 8.7247 8.7247 8.8140 8.8140 8.8822 8.8822 8.9934 8.9934 9.0732 9.0732 9.6033 9.6033 9.7026 9.7026 9.9735 9.9735 10.0287 10.0287 10.0843 10.0843 10.4161 10.4161 10.4876 10.4876 10.5710 10.5710 10.7678 10.7678 11.0785 11.0785 11.7143 11.7143 11.7945 11.7945 11.9783 11.9783 12.0715 12.0715 12.1757 12.1757 13.2589 13.2589 13.3195 13.3195 13.3913 13.3913 13.4867 13.4867 k = 0.1250 0.0722-0.0000 ( 5127 PWs) bands (ev): -0.2657 -0.2657 0.5401 0.5401 5.3050 5.3050 6.9106 6.9106 7.1091 7.1091 7.3391 7.3391 7.4795 7.4795 8.0206 8.0206 8.2345 8.2345 8.6694 8.6694 8.6955 8.6955 8.7337 8.7337 8.8279 8.8279 8.8843 8.8843 9.0086 9.0086 9.0821 9.0821 9.6021 9.6021 9.7021 9.7021 9.9776 9.9776 10.0216 10.0216 10.1004 10.1004 10.4023 10.4023 10.4823 10.4823 10.5594 10.5594 10.6793 10.6793 11.0298 11.0298 11.6931 11.6931 11.7151 11.7151 11.9003 11.9003 12.0655 12.0655 12.2108 12.2108 13.2288 13.2288 13.3109 13.3109 13.4619 13.4619 13.4861 13.4861 k = 0.1364 0.0787-0.0000 ( 5127 PWs) bands (ev): -0.2366 -0.2366 0.5588 0.5588 5.3386 5.3386 6.8322 6.8322 7.0760 7.0760 7.3389 7.3389 7.4847 7.4847 8.0134 8.0134 8.2295 8.2295 8.6774 8.6774 8.7089 8.7089 8.7435 8.7435 8.8357 8.8357 8.8913 8.8913 9.0262 9.0262 9.0918 9.0918 9.6005 9.6005 9.7019 9.7019 9.9781 9.9781 10.0138 10.0138 10.1184 10.1184 10.3864 10.3864 10.4762 10.4762 10.5394 10.5394 10.6012 10.6012 10.9815 10.9815 11.6202 11.6202 11.6866 11.6866 11.8226 11.8226 12.0526 12.0526 12.2553 12.2553 13.1966 13.1966 13.2875 13.2875 13.4490 13.4490 13.5779 13.5779 k = 0.1477 0.0853-0.0000 ( 5123 PWs) bands (ev): -0.2052 -0.2052 0.5790 0.5790 5.3747 5.3747 6.7499 6.7499 7.0381 7.0381 7.3395 7.3395 7.4910 7.4910 8.0083 8.0083 8.2237 8.2237 8.6859 8.6859 8.7230 8.7230 8.7541 8.7541 8.8366 8.8366 8.9048 8.9048 9.0452 9.0452 9.1023 9.1023 9.5984 9.5984 9.7021 9.7021 9.9757 9.9757 10.0054 10.0054 10.1362 10.1362 10.3674 10.3674 10.4661 10.4661 10.4912 10.4912 10.5594 10.5594 10.9338 10.9338 11.5383 11.5383 11.6688 11.6688 11.7465 11.7465 12.0361 12.0361 12.3035 12.3035 13.1639 13.1639 13.2592 13.2592 13.4286 13.4286 13.6552 13.6552 k = 0.1591 0.0919-0.0000 ( 5107 PWs) bands (ev): -0.1715 -0.1715 0.6006 0.6006 5.4131 5.4131 6.6643 6.6643 6.9955 6.9955 7.3408 7.3408 7.4982 7.4982 8.0055 8.0055 8.2170 8.2170 8.6948 8.6948 8.7377 8.7377 8.7655 8.7655 8.8336 8.8336 8.9224 8.9224 9.0649 9.0649 9.1135 9.1135 9.5959 9.5959 9.7027 9.7027 9.9710 9.9710 9.9964 9.9964 10.1504 10.1504 10.3426 10.3426 10.4170 10.4170 10.4679 10.4679 10.5421 10.5421 10.8868 10.8868 11.4593 11.4593 11.6495 11.6495 11.6736 11.6736 12.0169 12.0169 12.3536 12.3536 13.1315 13.1315 13.2275 13.2275 13.4063 13.4063 13.6996 13.6996 k = 0.1705 0.0984-0.0000 ( 5103 PWs) bands (ev): -0.1357 -0.1357 0.6236 0.6236 5.4539 5.4539 6.5760 6.5760 6.9482 6.9482 7.3426 7.3426 7.5060 7.5060 8.0051 8.0051 8.2092 8.2092 8.7041 8.7041 8.7527 8.7527 8.7777 8.7777 8.8292 8.8292 8.9417 8.9417 9.0845 9.0845 9.1254 9.1254 9.5927 9.5927 9.7039 9.7039 9.9642 9.9642 9.9869 9.9869 10.1530 10.1530 10.3087 10.3087 10.3693 10.3693 10.4602 10.4602 10.5290 10.5290 10.8407 10.8407 11.3840 11.3840 11.5967 11.5967 11.6361 11.6361 11.9954 11.9954 12.4048 12.4048 13.1000 13.1000 13.1929 13.1929 13.3828 13.3828 13.7444 13.7444 k = 0.1818 0.1050-0.0000 ( 5107 PWs) bands (ev): -0.0977 -0.0977 0.6479 0.6479 5.4967 5.4967 6.4856 6.4856 6.8965 6.8965 7.3449 7.3449 7.5145 7.5145 8.0071 8.0071 8.2003 8.2003 8.7137 8.7137 8.7679 8.7679 8.7904 8.7904 8.8251 8.8251 8.9617 8.9617 9.1039 9.1039 9.1378 9.1378 9.5891 9.5891 9.7057 9.7057 9.9552 9.9552 9.9769 9.9769 10.1292 10.1292 10.2831 10.2831 10.3398 10.3398 10.4529 10.4529 10.5169 10.5169 10.7956 10.7956 11.3127 11.3127 11.5267 11.5267 11.6180 11.6180 11.9716 11.9716 12.4569 12.4569 13.0699 13.0699 13.1559 13.1559 13.3583 13.3583 13.7918 13.7918 k = 0.1932 0.1115-0.0000 ( 5111 PWs) bands (ev): -0.0578 -0.0578 0.6735 0.6735 5.5415 5.5415 6.3935 6.3935 6.8406 6.8406 7.3477 7.3477 7.5236 7.5236 8.0116 8.0116 8.1901 8.1901 8.7232 8.7232 8.7831 8.7831 8.8022 8.8022 8.8238 8.8238 8.9818 8.9818 9.1224 9.1224 9.1509 9.1509 9.5848 9.5848 9.7081 9.7081 9.9440 9.9440 9.9664 9.9664 10.0775 10.0775 10.2790 10.2790 10.3184 10.3184 10.4454 10.4454 10.5054 10.5054 10.7515 10.7515 11.2451 11.2451 11.4584 11.4584 11.6009 11.6009 11.9458 11.9458 12.5096 12.5096 13.0416 13.0416 13.1167 13.1167 13.3332 13.3332 13.8418 13.8418 k = 0.2045 0.1181-0.0000 ( 5109 PWs) bands (ev): -0.0160 -0.0160 0.7003 0.7003 5.5879 5.5879 6.3002 6.3002 6.7810 6.7810 7.3509 7.3509 7.5331 7.5331 8.0186 8.0186 8.1785 8.1785 8.7320 8.7320 8.7984 8.7984 8.8089 8.8089 8.8302 8.8302 9.0018 9.0018 9.1400 9.1400 9.1644 9.1644 9.5801 9.5801 9.7112 9.7112 9.9296 9.9296 9.9546 9.9546 10.0160 10.0160 10.2785 10.2785 10.3077 10.3077 10.4375 10.4375 10.4944 10.4944 10.7087 10.7087 11.1807 11.1807 11.3922 11.3922 11.5844 11.5844 11.9183 11.9183 12.5630 12.5630 13.0154 13.0154 13.0761 13.0761 13.3075 13.3075 13.8939 13.8939 k = 0.2159 0.1247-0.0000 ( 5107 PWs) bands (ev): 0.0277 0.0277 0.7282 0.7282 5.6354 5.6354 6.2064 6.2064 6.7179 6.7179 7.3543 7.3543 7.5431 7.5431 8.0280 8.0280 8.1654 8.1654 8.7389 8.7389 8.8107 8.8107 8.8148 8.8148 8.8441 8.8441 9.0213 9.0213 9.1565 9.1565 9.1784 9.1784 9.5750 9.5750 9.7149 9.7149 9.9064 9.9064 9.9374 9.9374 9.9644 9.9644 10.2644 10.2644 10.3150 10.3150 10.4293 10.4293 10.4838 10.4838 10.6673 10.6673 11.1191 11.1191 11.3285 11.3285 11.5688 11.5688 11.8894 11.8894 12.6169 12.6169 12.9910 12.9910 13.0349 13.0349 13.2816 13.2816 13.9481 13.9481 k = 0.2273 0.1312-0.0000 ( 5103 PWs) bands (ev): 0.0730 0.0730 0.7572 0.7572 5.6834 5.6834 6.1130 6.1130 6.6520 6.6520 7.3581 7.3581 7.5535 7.5535 8.0398 8.0398 8.1509 8.1509 8.7427 8.7427 8.8161 8.8161 8.8299 8.8299 8.8605 8.8605 9.0402 9.0402 9.1718 9.1718 9.1925 9.1925 9.5695 9.5695 9.7190 9.7190 9.8598 9.8598 9.9148 9.9148 9.9418 9.9418 10.2454 10.2454 10.3283 10.3283 10.4207 10.4207 10.4737 10.4737 10.6275 10.6275 11.0597 11.0597 11.2672 11.2672 11.5541 11.5541 11.8596 11.8596 12.6714 12.6714 12.9672 12.9672 12.9951 12.9951 13.2556 13.2556 14.0038 14.0038 k = 0.2386 0.1378-0.0000 ( 5095 PWs) bands (ev): 0.1199 0.1199 0.7871 0.7871 5.7299 5.7299 6.0220 6.0220 6.5835 6.5835 7.3621 7.3621 7.5641 7.5641 8.0539 8.0539 8.1347 8.1347 8.7427 8.7427 8.8252 8.8252 8.8458 8.8458 8.8780 8.8780 9.0584 9.0584 9.1861 9.1861 9.2064 9.2064 9.5637 9.5637 9.7229 9.7229 9.8027 9.8027 9.8963 9.8963 9.9282 9.9282 10.2255 10.2255 10.3416 10.3416 10.4118 10.4118 10.4641 10.4641 10.5895 10.5895 11.0019 11.0019 11.2085 11.2085 11.5406 11.5406 11.8293 11.8293 12.7263 12.7263 12.9380 12.9380 12.9633 12.9633 13.2296 13.2296 14.0533 14.0533 k = 0.2500 0.1443-0.0000 ( 5100 PWs) bands (ev): 0.1681 0.1681 0.8178 0.8178 5.7672 5.7672 5.9408 5.9408 6.5133 6.5133 7.3663 7.3663 7.5750 7.5750 8.0701 8.0701 8.1172 8.1172 8.7393 8.7393 8.8384 8.8384 8.8620 8.8620 8.8960 8.8960 9.0759 9.0759 9.1993 9.1993 9.2197 9.2197 9.5576 9.5576 9.7206 9.7206 9.7530 9.7530 9.8789 9.8789 9.9157 9.9157 10.2055 10.2055 10.3531 10.3531 10.4028 10.4028 10.4549 10.4549 10.5536 10.5536 10.9454 10.9454 11.1524 11.1524 11.5284 11.5284 11.7991 11.7991 12.7814 12.7814 12.9004 12.9004 12.9432 12.9432 13.2039 13.2039 14.0316 14.0316 k = 0.2614 0.1509-0.0000 ( 5110 PWs) bands (ev): 0.2177 0.2177 0.8493 0.8493 5.7619 5.7619 5.9031 5.9031 6.4420 6.4420 7.3708 7.3708 7.5860 7.5860 8.0856 8.0856 8.1009 8.1009 8.7333 8.7333 8.8546 8.8546 8.8786 8.8786 8.9143 8.9143 9.0925 9.0925 9.2117 9.2117 9.2323 9.2323 9.5513 9.5513 9.6833 9.6833 9.7425 9.7425 9.8615 9.8615 9.9030 9.9030 10.1854 10.1854 10.3617 10.3617 10.3940 10.3940 10.4461 10.4461 10.5200 10.5200 10.8899 10.8899 11.0989 11.0989 11.5178 11.5178 11.7695 11.7695 12.8340 12.8340 12.8639 12.8639 12.9284 12.9284 13.1785 13.1785 14.0017 14.0017 k = 0.2727 0.1575-0.0000 ( 5110 PWs) bands (ev): 0.2683 0.2683 0.8814 0.8814 5.6942 5.6942 5.9278 5.9278 6.3706 6.3706 7.3753 7.3753 7.5971 7.5971 8.0736 8.0736 8.1126 8.1126 8.7255 8.7255 8.8734 8.8734 8.8956 8.8956 8.9326 8.9326 9.1082 9.1082 9.2232 9.2232 9.2439 9.2439 9.5450 9.5450 9.6360 9.6360 9.7470 9.7470 9.8439 9.8439 9.8904 9.8904 10.1651 10.1651 10.3653 10.3653 10.3867 10.3867 10.4374 10.4374 10.4894 10.4894 10.8353 10.8353 11.0480 11.0480 11.5087 11.5087 11.7410 11.7410 12.8191 12.8191 12.8960 12.8960 12.9171 12.9171 13.1536 13.1536 13.9716 13.9716 k = 0.2841 0.1640-0.0000 ( 5110 PWs) bands (ev): 0.3199 0.3199 0.9139 0.9139 5.6073 5.6073 5.9706 5.9706 6.3012 6.3012 7.3799 7.3799 7.6083 7.6083 8.0513 8.0513 8.1354 8.1354 8.7164 8.7164 8.8940 8.8940 8.9130 8.9130 8.9511 8.9511 9.1228 9.1228 9.2336 9.2336 9.2544 9.2544 9.5387 9.5387 9.5922 9.5922 9.7530 9.7530 9.8263 9.8263 9.8777 9.8777 10.1444 10.1444 10.3611 10.3611 10.3831 10.3831 10.4285 10.4285 10.4625 10.4625 10.7817 10.7817 10.9996 10.9996 11.5014 11.5014 11.7139 11.7139 12.7828 12.7828 12.9066 12.9066 12.9531 12.9531 13.1294 13.1294 13.9426 13.9426 k = 0.2955 0.1706-0.0000 ( 5114 PWs) bands (ev): 0.3721 0.3721 0.9468 0.9468 5.5166 5.5166 6.0117 6.0117 6.2386 6.2386 7.3846 7.3846 7.6195 7.6195 8.0270 8.0270 8.1609 8.1609 8.7061 8.7061 8.9160 8.9160 8.9308 8.9308 8.9697 8.9697 9.1364 9.1364 9.2428 9.2428 9.2639 9.2639 9.5322 9.5322 9.5536 9.5536 9.7585 9.7585 9.8093 9.8093 9.8650 9.8650 10.1227 10.1227 10.3512 10.3512 10.3806 10.3806 10.4183 10.4183 10.4408 10.4408 10.7293 10.7293 10.9537 10.9537 11.4959 11.4959 11.6885 11.6885 12.7484 12.7484 12.8991 12.8991 13.0100 13.0100 13.1058 13.1058 13.9154 13.9154 k = 0.3068 0.1771-0.0000 ( 5126 PWs) bands (ev): 0.4248 0.4248 0.9798 0.9798 5.4257 5.4257 6.0328 6.0328 6.1981 6.1981 7.3894 7.3894 7.6306 7.6306 8.0011 8.0011 8.1886 8.1886 8.6950 8.6950 8.9389 8.9389 8.9489 8.9489 8.9887 8.9887 9.1487 9.1487 9.2505 9.2505 9.2722 9.2722 9.5180 9.5180 9.5281 9.5281 9.7605 9.7605 9.7956 9.7956 9.8526 9.8526 10.0997 10.0997 10.3382 10.3382 10.3758 10.3758 10.4054 10.4054 10.4262 10.4262 10.6788 10.6788 10.9103 10.9103 11.4919 11.4919 11.6651 11.6651 12.7168 12.7168 12.8931 12.8931 13.0673 13.0673 13.0833 13.0833 13.8902 13.8902 k = 0.3182 0.1837-0.0000 ( 5132 PWs) bands (ev): 0.4777 0.4777 1.0128 1.0128 5.3357 5.3357 6.0092 6.0092 6.2038 6.2038 7.3941 7.3941 7.6415 7.6415 7.9741 7.9741 8.2185 8.2185 8.6831 8.6831 8.9619 8.9619 8.9673 8.9673 9.0087 9.0087 9.1599 9.1599 9.2564 9.2564 9.2797 9.2797 9.4903 9.4903 9.5216 9.5216 9.7528 9.7528 9.7911 9.7911 9.8406 9.8406 10.0749 10.0749 10.3235 10.3235 10.3681 10.3681 10.3913 10.3913 10.4167 10.4167 10.6308 10.6308 10.8693 10.8693 11.4895 11.4895 11.6439 11.6439 12.6884 12.6884 12.8884 12.8884 13.0613 13.0613 13.1252 13.1252 13.8673 13.8673 k = 0.3295 0.1903-0.0000 ( 5138 PWs) bands (ev): 0.5305 0.5305 1.0456 1.0456 5.2475 5.2475 5.9545 5.9545 6.2419 6.2419 7.3989 7.3989 7.6523 7.6523 7.9460 7.9460 8.2505 8.2505 8.6707 8.6707 8.9837 8.9837 8.9862 8.9862 9.0304 9.0304 9.1697 9.1697 9.2603 9.2603 9.2863 9.2863 9.4669 9.4669 9.5163 9.5163 9.7364 9.7364 9.7948 9.7948 9.8292 9.8292 10.0477 10.0477 10.3078 10.3078 10.3581 10.3581 10.3773 10.3773 10.4094 10.4094 10.5862 10.5862 10.8307 10.8307 11.4883 11.4883 11.6249 11.6249 12.6636 12.6636 12.8848 12.8848 13.0405 13.0405 13.1828 13.1828 13.8467 13.8467 k = 0.3409 0.1968-0.0000 ( 5132 PWs) bands (ev): 0.5829 0.5829 1.0779 1.0779 5.1614 5.1614 5.8907 5.8907 6.2906 6.2906 7.4036 7.4036 7.6627 7.6627 7.9174 7.9174 8.2846 8.2846 8.6578 8.6578 9.0026 9.0026 9.0062 9.0062 9.0547 9.0547 9.1783 9.1783 9.2620 9.2620 9.2921 9.2921 9.4483 9.4483 9.5116 9.5116 9.7166 9.7166 9.8010 9.8010 9.8185 9.8185 10.0179 10.0179 10.2917 10.2917 10.3468 10.3468 10.3632 10.3632 10.4031 10.4031 10.5459 10.5459 10.7944 10.7944 11.4881 11.4881 11.6082 11.6082 12.6424 12.6424 12.8822 12.8822 13.0209 13.0209 13.2403 13.2403 13.8286 13.8286 k = 0.3523 0.2034-0.0000 ( 5136 PWs) bands (ev): 0.6346 0.6346 1.1096 1.1096 5.0780 5.0780 5.8253 5.8253 6.3422 6.3422 7.4082 7.4082 7.6728 7.6728 7.8883 7.8883 8.3207 8.3207 8.6447 8.6447 9.0193 9.0193 9.0262 9.0262 9.0817 9.0817 9.1855 9.1855 9.2619 9.2619 9.2969 9.2969 9.4339 9.4339 9.5075 9.5075 9.6954 9.6954 9.8062 9.8062 9.8101 9.8101 9.9850 9.9850 10.2756 10.2756 10.3340 10.3340 10.3490 10.3490 10.3973 10.3973 10.5108 10.5108 10.7604 10.7604 11.4885 11.4885 11.5938 11.5938 12.6249 12.6249 12.8804 12.8804 13.0025 13.0025 13.2972 13.2972 13.8130 13.8130 k = 0.3636 0.2099-0.0000 ( 5142 PWs) bands (ev): 0.6851 0.6851 1.1405 1.1405 4.9978 4.9978 5.7609 5.7609 6.3944 6.3944 7.4127 7.4127 7.6825 7.6825 7.8592 7.8592 8.3586 8.3586 8.6315 8.6315 9.0339 9.0339 9.0460 9.0460 9.1108 9.1108 9.1913 9.1913 9.2603 9.2603 9.3005 9.3005 9.4233 9.4233 9.5042 9.5042 9.6735 9.6735 9.7986 9.7986 9.8150 9.8150 9.9495 9.9495 10.2592 10.2592 10.3190 10.3190 10.3358 10.3358 10.3920 10.3920 10.4812 10.4812 10.7285 10.7285 11.4890 11.4890 11.5817 11.5817 12.6111 12.6111 12.8791 12.8791 12.9853 12.9853 13.3534 13.3534 13.8000 13.8000 k = 0.3750 0.2165-0.0000 ( 5130 PWs) bands (ev): 0.7342 0.7342 1.1702 1.1702 4.9213 4.9213 5.6989 5.6989 6.4458 6.4458 7.4170 7.4170 7.6917 7.6917 7.8304 7.8304 8.3983 8.3983 8.6186 8.6186 9.0467 9.0467 9.0658 9.0658 9.1410 9.1410 9.1960 9.1960 9.2576 9.2576 9.3028 9.3028 9.4157 9.4157 9.5017 9.5017 9.6512 9.6512 9.7900 9.7900 9.8210 9.8210 9.9121 9.9121 10.2417 10.2417 10.3028 10.3028 10.3240 10.3240 10.3872 10.3872 10.4575 10.4575 10.6989 10.6989 11.4893 11.4893 11.5719 11.5719 12.6009 12.6009 12.8782 12.8782 12.9696 12.9696 13.4084 13.4084 13.7897 13.7897 k = 0.3864 0.2231-0.0000 ( 5126 PWs) bands (ev): 0.7814 0.7814 1.1986 1.1986 4.8489 4.8489 5.6400 5.6400 6.4956 6.4956 7.4212 7.4212 7.7002 7.7002 7.8022 7.8022 8.4396 8.4396 8.6060 8.6060 9.0578 9.0578 9.0856 9.0856 9.1704 9.1704 9.2004 9.2004 9.2544 9.2544 9.3037 9.3037 9.4104 9.4104 9.5001 9.5001 9.6290 9.6290 9.7820 9.7820 9.8255 9.8255 9.8743 9.8743 10.2214 10.2214 10.2875 10.2875 10.3132 10.3132 10.3830 10.3830 10.4390 10.4390 10.6714 10.6714 11.4890 11.4890 11.5645 11.5645 12.5940 12.5940 12.8774 12.8774 12.9554 12.9554 13.4617 13.4617 13.7818 13.7818 k = 0.3977 0.2296-0.0000 ( 5120 PWs) bands (ev): 0.8262 0.8262 1.2253 1.2253 4.7811 4.7811 5.5849 5.5849 6.5433 6.5433 7.4252 7.4252 7.7081 7.7081 7.7751 7.7751 8.4818 8.4818 8.5944 8.5944 9.0674 9.0674 9.1051 9.1051 9.1909 9.1909 9.2109 9.2109 9.2516 9.2516 9.3031 9.3031 9.4068 9.4068 9.4993 9.4993 9.6073 9.6073 9.7743 9.7743 9.8215 9.8215 9.8448 9.8448 10.1974 10.1974 10.2749 10.2749 10.3032 10.3032 10.3794 10.3794 10.4252 10.4252 10.6460 10.6460 11.4880 11.4880 11.5591 11.5591 12.5901 12.5901 12.8767 12.8767 12.9428 12.9428 13.5127 13.5127 13.7745 13.7745 k = 0.4091 0.2362-0.0000 ( 5124 PWs) bands (ev): 0.8681 0.8681 1.2501 1.2501 4.7185 4.7185 5.5341 5.5341 6.5882 6.5882 7.4290 7.4290 7.7148 7.7148 7.7496 7.7496 8.5235 8.5235 8.5854 8.5854 9.0756 9.0756 9.1239 9.1239 9.1947 9.1947 9.2300 9.2300 9.2530 9.2530 9.3018 9.3018 9.4043 9.4043 9.4990 9.4990 9.5871 9.5871 9.7658 9.7658 9.7935 9.7935 9.8415 9.8415 10.1695 10.1695 10.2656 10.2656 10.2941 10.2941 10.3767 10.3767 10.4149 10.4149 10.6227 10.6227 11.4863 11.4863 11.5556 11.5556 12.5887 12.5887 12.8757 12.8757 12.9321 12.9321 13.5605 13.5605 13.7605 13.7605 k = 0.4205 0.2427-0.0000 ( 5120 PWs) bands (ev): 0.9067 0.9067 1.2728 1.2728 4.6616 4.6616 5.4882 5.4882 6.6299 6.6299 7.4325 7.4325 7.7162 7.7162 7.7304 7.7304 8.5528 8.5528 8.5908 8.5908 9.0824 9.0824 9.1404 9.1404 9.1938 9.1938 9.2348 9.2348 9.2667 9.2667 9.3026 9.3026 9.4026 9.4026 9.4978 9.4978 9.5704 9.5704 9.7492 9.7492 9.7705 9.7705 9.8442 9.8442 10.1387 10.1387 10.2591 10.2591 10.2860 10.2860 10.3750 10.3750 10.4072 10.4072 10.6016 10.6016 11.4842 11.4842 11.5534 11.5534 12.5894 12.5894 12.8743 12.8743 12.9232 12.9232 13.6038 13.6038 13.7398 13.7398 k = 0.4318 0.2493-0.0000 ( 5124 PWs) bands (ev): 0.9414 0.9414 1.2931 1.2931 4.6109 4.6109 5.4474 5.4474 6.6677 6.6677 7.4357 7.4357 7.6993 7.6993 7.7306 7.7306 8.5527 8.5527 8.6274 8.6274 9.0879 9.0879 9.1507 9.1507 9.1936 9.1936 9.2324 9.2324 9.2759 9.2759 9.3126 9.3126 9.4014 9.4014 9.4928 9.4928 9.5605 9.5605 9.7232 9.7232 9.7613 9.7613 9.8471 9.8471 10.1060 10.1060 10.2549 10.2549 10.2790 10.2790 10.3741 10.3741 10.4014 10.4014 10.5828 10.5828 11.4818 11.4818 11.5521 11.5521 12.5916 12.5916 12.8723 12.8723 12.9164 12.9164 13.6399 13.6399 13.7225 13.7225 k = 0.4432 0.2559-0.0000 ( 5132 PWs) bands (ev): 0.9718 0.9718 1.3107 1.3107 4.5670 4.5670 5.4122 5.4122 6.7010 6.7010 7.4386 7.4386 7.6799 7.6799 7.7350 7.7350 8.5458 8.5458 8.6723 8.6723 9.0917 9.0917 9.1476 9.1476 9.2000 9.2000 9.2301 9.2301 9.2758 9.2758 9.3296 9.3296 9.4004 9.4004 9.4817 9.4817 9.5599 9.5599 9.7003 9.7003 9.7555 9.7555 9.8496 9.8496 10.0727 10.0727 10.2522 10.2522 10.2731 10.2731 10.3741 10.3741 10.3971 10.3971 10.5662 10.5662 11.4794 11.4794 11.5515 11.5515 12.5948 12.5948 12.8699 12.8699 12.9115 12.9115 13.6609 13.6609 13.7179 13.7179 k = 0.4545 0.2624-0.0000 ( 5138 PWs) bands (ev): 0.9974 0.9974 1.3254 1.3254 4.5303 4.5303 5.3830 5.3830 6.7294 6.7294 7.4411 7.4411 7.6627 7.6627 7.7389 7.7389 8.5389 8.5389 8.7180 8.7180 9.0929 9.0929 9.1327 9.1327 9.2105 9.2105 9.2305 9.2305 9.2733 9.2733 9.3458 9.3458 9.3996 9.3996 9.4665 9.4665 9.5660 9.5660 9.6845 9.6845 9.7504 9.7504 9.8517 9.8517 10.0404 10.0404 10.2508 10.2508 10.2683 10.2683 10.3746 10.3746 10.3938 10.3938 10.5522 10.5522 11.4773 11.4773 11.5512 11.5512 12.5983 12.5983 12.8672 12.8672 12.9082 12.9082 13.6606 13.6606 13.7322 13.7322 k = 0.4659 0.2690-0.0000 ( 5130 PWs) bands (ev): 1.0178 1.0178 1.3371 1.3371 4.5012 4.5012 5.3600 5.3600 6.7521 6.7521 7.4432 7.4432 7.6487 7.6487 7.7422 7.7422 8.5331 8.5331 8.7625 8.7625 9.0863 9.0863 9.1170 9.1170 9.2165 9.2165 9.2373 9.2373 9.2709 9.2709 9.3588 9.3588 9.3989 9.3989 9.4504 9.4504 9.5737 9.5737 9.6773 9.6773 9.7456 9.7456 9.8532 9.8532 10.0107 10.0107 10.2502 10.2502 10.2645 10.2645 10.3756 10.3756 10.3913 10.3913 10.5409 10.5409 11.4756 11.4756 11.5511 11.5511 12.6016 12.6016 12.8647 12.8647 12.9061 12.9061 13.6526 13.6526 13.7520 13.7520 k = 0.4773 0.2756-0.0000 ( 5126 PWs) bands (ev): 1.0326 1.0326 1.3456 1.3456 4.4802 4.4802 5.3433 5.3433 6.7688 6.7688 7.4447 7.4447 7.6382 7.6382 7.7445 7.7445 8.5288 8.5288 8.8028 8.8028 9.0664 9.0664 9.1111 9.1111 9.2178 9.2178 9.2477 9.2477 9.2691 9.2691 9.3685 9.3685 9.3980 9.3980 9.4360 9.4360 9.5793 9.5793 9.6784 9.6784 9.7407 9.7407 9.8543 9.8543 9.9861 9.9861 10.2502 10.2502 10.2616 10.2616 10.3767 10.3767 10.3896 10.3896 10.5325 10.5325 11.4743 11.4743 11.5511 11.5511 12.6043 12.6043 12.8626 12.8626 12.9049 12.9049 13.6452 13.6452 13.7686 13.7686 k = 0.4886 0.2821-0.0000 ( 5124 PWs) bands (ev): 1.0416 1.0416 1.3507 1.3507 4.4674 4.4674 5.3333 5.3333 6.7790 6.7790 7.4457 7.4457 7.6318 7.6318 7.7459 7.7459 8.5262 8.5262 8.8336 8.8336 9.0447 9.0447 9.1102 9.1102 9.2180 9.2180 9.2560 9.2560 9.2678 9.2678 9.3750 9.3750 9.3969 9.3969 9.4257 9.4257 9.5820 9.5820 9.6839 9.6839 9.7362 9.7362 9.8550 9.8550 9.9695 9.9695 10.2504 10.2504 10.2598 10.2598 10.3776 10.3776 10.3885 10.3885 10.5274 10.5274 11.4735 11.4735 11.5511 11.5511 12.6061 12.6061 12.8612 12.8612 12.9043 12.9043 13.6404 13.6404 13.7795 13.7795 k = 0.5000 0.2887-0.0000 ( 5128 PWs) bands (ev): 1.0446 1.0446 1.3524 1.3524 4.4632 4.4632 5.3299 5.3299 6.7825 6.7825 7.4460 7.4460 7.6296 7.6296 7.7464 7.7464 8.5253 8.5253 8.8460 8.8460 9.0351 9.0351 9.1101 9.1101 9.2180 9.2180 9.2592 9.2592 9.2673 9.2673 9.3775 9.3775 9.3962 9.3962 9.4219 9.4219 9.5826 9.5826 9.6870 9.6870 9.7340 9.7340 9.8552 9.8552 9.9636 9.9636 10.2505 10.2505 10.2591 10.2591 10.3779 10.3779 10.3881 10.3881 10.5256 10.5256 11.4732 11.4732 11.5511 11.5511 12.6068 12.6068 12.8608 12.8608 12.9041 12.9041 13.6387 13.6387 13.7832 13.7832 k = 0.5000 0.2887-0.0000 ( 5128 PWs) bands (ev): 1.0446 1.0446 1.3524 1.3524 4.4632 4.4632 5.3299 5.3299 6.7825 6.7825 7.4460 7.4460 7.6296 7.6296 7.7464 7.7464 8.5253 8.5253 8.8460 8.8460 9.0351 9.0351 9.1101 9.1101 9.2180 9.2180 9.2592 9.2592 9.2673 9.2673 9.3775 9.3775 9.3962 9.3962 9.4219 9.4219 9.5826 9.5826 9.6870 9.6870 9.7340 9.7340 9.8552 9.8552 9.9636 9.9636 10.2505 10.2505 10.2591 10.2591 10.3779 10.3779 10.3881 10.3881 10.5256 10.5256 11.4732 11.4732 11.5511 11.5511 12.6068 12.6068 12.8608 12.8608 12.9041 12.9041 13.6387 13.6387 13.7832 13.7832 k = 0.4933 0.3002-0.0000 ( 5128 PWs) bands (ev): 1.0452 1.0452 1.3529 1.3529 4.4648 4.4648 5.3310 5.3310 6.7830 6.7830 7.4404 7.4404 7.5920 7.5920 7.7818 7.7818 8.5260 8.5260 8.8451 8.8451 9.0368 9.0368 9.1097 9.1097 9.2160 9.2160 9.2588 9.2588 9.2691 9.2691 9.3775 9.3775 9.3963 9.3963 9.4224 9.4224 9.5835 9.5835 9.6875 9.6875 9.7337 9.7337 9.8489 9.8489 9.9707 9.9707 10.2462 10.2462 10.2589 10.2589 10.3765 10.3765 10.3896 10.3896 10.5266 10.5266 11.4722 11.4722 11.5500 11.5500 12.6111 12.6111 12.8627 12.8627 12.9068 12.9068 13.6378 13.6378 13.7799 13.7799 k = 0.4867 0.3118-0.0000 ( 5128 PWs) bands (ev): 1.0469 1.0469 1.3546 1.3546 4.4697 4.4697 5.3342 5.3342 6.7847 6.7847 7.4235 7.4235 7.5229 7.5229 7.8442 7.8442 8.5281 8.5281 8.8426 8.8426 9.0418 9.0418 9.1086 9.1086 9.2107 9.2107 9.2583 9.2583 9.2733 9.2733 9.3772 9.3772 9.3968 9.3968 9.4240 9.4240 9.5860 9.5860 9.6890 9.6890 9.7328 9.7328 9.8339 9.8339 9.9883 9.9883 10.2348 10.2348 10.2575 10.2575 10.3732 10.3732 10.3930 10.3930 10.5295 10.5295 11.4693 11.4693 11.5468 11.5468 12.6237 12.6237 12.8678 12.8678 12.9155 12.9155 13.6352 13.6352 13.7701 13.7701 k = 0.4800 0.3233-0.0000 ( 5128 PWs) bands (ev): 1.0498 1.0498 1.3573 1.3573 4.4778 4.4778 5.3395 5.3395 6.7873 6.7873 7.3960 7.3960 7.4458 7.4458 7.9101 7.9101 8.5315 8.5315 8.8385 8.8385 9.0496 9.0496 9.1068 9.1068 9.2028 9.2028 9.2584 9.2584 9.2784 9.2784 9.3769 9.3769 9.3976 9.3976 9.4266 9.4266 9.5901 9.5901 9.6914 9.6914 9.7314 9.7314 9.8158 9.8158 10.0107 10.0107 10.2174 10.2174 10.2545 10.2545 10.3690 10.3690 10.3975 10.3975 10.5340 10.5340 11.4645 11.4645 11.5415 11.5415 12.6440 12.6440 12.8751 12.8751 12.9309 12.9309 13.6307 13.6307 13.7553 13.7553 k = 0.4733 0.3349-0.0000 ( 5125 PWs) bands (ev): 1.0537 1.0537 1.3611 1.3611 4.4891 4.4891 5.3469 5.3469 6.7910 6.7910 7.3583 7.3583 7.3650 7.3650 7.9758 7.9758 8.5364 8.5364 8.8331 8.8331 9.0596 9.0596 9.1043 9.1043 9.1931 9.1931 9.2590 9.2590 9.2838 9.2838 9.3765 9.3765 9.3987 9.3987 9.4300 9.4300 9.5956 9.5956 9.6939 9.6939 9.7293 9.7293 9.7981 9.7981 10.0342 10.0342 10.1958 10.1958 10.2503 10.2503 10.3639 10.3639 10.4029 10.4029 10.5398 10.5398 11.4579 11.4579 11.5340 11.5340 12.6707 12.6707 12.8838 12.8838 12.9536 12.9536 13.6240 13.6240 13.7367 13.7367 k = 0.4667 0.3464-0.0000 ( 5127 PWs) bands (ev): 1.0588 1.0588 1.3658 1.3658 4.5036 4.5036 5.3565 5.3565 6.7954 6.7954 7.2798 7.2798 7.3134 7.3134 8.0402 8.0402 8.5428 8.5428 8.8264 8.8264 9.0712 9.0712 9.1009 9.1009 9.1822 9.1822 9.2602 9.2602 9.2892 9.2892 9.3760 9.3760 9.4000 9.4000 9.4341 9.4341 9.6024 9.6024 9.6953 9.6953 9.7276 9.7276 9.7828 9.7828 10.0552 10.0552 10.1730 10.1730 10.2452 10.2452 10.3580 10.3580 10.4090 10.4090 10.5466 10.5466 11.4496 11.4496 11.5243 11.5243 12.7024 12.7024 12.8935 12.8935 12.9836 12.9836 13.6148 13.6148 13.7156 13.7156 k = 0.4600 0.3580-0.0000 ( 5127 PWs) bands (ev): 1.0648 1.0648 1.3716 1.3716 4.5213 4.5213 5.3680 5.3680 6.8004 6.8004 7.1926 7.1926 7.2606 7.2606 8.1031 8.1031 8.5507 8.5507 8.8187 8.8187 9.0830 9.0830 9.0968 9.0968 9.1706 9.1706 9.2617 9.2617 9.2944 9.2944 9.3754 9.3754 9.4015 9.4015 9.4387 9.4387 9.6102 9.6102 9.6930 9.6930 9.7285 9.7285 9.7710 9.7710 10.0664 10.0664 10.1563 10.1563 10.2397 10.2397 10.3514 10.3514 10.4158 10.4158 10.5540 10.5540 11.4396 11.4396 11.5124 11.5124 12.7375 12.7375 12.9046 12.9046 13.0201 13.0201 13.6030 13.6030 13.6930 13.6930 k = 0.4533 0.3695-0.0000 ( 5131 PWs) bands (ev): 1.0719 1.0719 1.3782 1.3782 4.5422 4.5422 5.3817 5.3817 6.8055 6.8055 7.1027 7.1027 7.2023 7.2023 8.1640 8.1640 8.5603 8.5603 8.8103 8.8103 9.0873 9.0873 9.0988 9.0988 9.1593 9.1593 9.2636 9.2636 9.2991 9.2991 9.3749 9.3749 9.4033 9.4033 9.4436 9.4436 9.6184 9.6184 9.6864 9.6864 9.7334 9.7334 9.7629 9.7629 10.0570 10.0570 10.1570 10.1570 10.2342 10.2342 10.3438 10.3438 10.4234 10.4234 10.5615 10.5615 11.4281 11.4281 11.4983 11.4983 12.7743 12.7743 12.9172 12.9172 13.0622 13.0622 13.5882 13.5882 13.6697 13.6697 k = 0.4467 0.3811-0.0000 ( 5141 PWs) bands (ev): 1.0799 1.0799 1.3857 1.3857 4.5663 4.5663 5.3973 5.3973 6.8099 6.8099 7.0105 7.0105 7.1403 7.1403 8.2228 8.2228 8.5718 8.5718 8.8014 8.8014 9.0795 9.0795 9.1101 9.1101 9.1492 9.1492 9.2658 9.2658 9.3034 9.3034 9.3746 9.3746 9.4052 9.4052 9.4486 9.4486 9.6260 9.6260 9.6781 9.6781 9.7413 9.7413 9.7577 9.7577 10.0307 10.0307 10.1714 10.1714 10.2295 10.2295 10.3354 10.3354 10.4315 10.4315 10.5691 10.5691 11.4152 11.4152 11.4820 11.4820 12.8114 12.8114 12.9315 12.9315 13.1090 13.1090 13.5706 13.5706 13.6462 13.6462 k = 0.4400 0.3926-0.0000 ( 5145 PWs) bands (ev): 1.0887 1.0887 1.3939 1.3939 4.5934 4.5934 5.4148 5.4148 6.8119 6.8119 6.9164 6.9164 7.0770 7.0770 8.2790 8.2790 8.5855 8.5855 8.7922 8.7922 9.0680 9.0680 9.1200 9.1200 9.1425 9.1425 9.2683 9.2683 9.3070 9.3070 9.3746 9.3746 9.4074 9.4074 9.4536 9.4536 9.6304 9.6304 9.6726 9.6726 9.7491 9.7491 9.7567 9.7567 9.9977 9.9977 10.1876 10.1876 10.2283 10.2283 10.3260 10.3260 10.4402 10.4402 10.5764 10.5764 11.4008 11.4008 11.4637 11.4637 12.8475 12.8475 12.9477 12.9477 13.1596 13.1596 13.5502 13.5502 13.6228 13.6228 k = 0.4333 0.4041-0.0000 ( 5139 PWs) bands (ev): 1.0983 1.0983 1.4028 1.4028 4.6237 4.6237 5.4343 5.4343 6.8043 6.8043 6.8245 6.8245 7.0171 7.0171 8.3321 8.3321 8.6016 8.6016 8.7830 8.7830 9.0533 9.0533 9.1237 9.1237 9.1437 9.1437 9.2710 9.2710 9.3098 9.3098 9.3750 9.3750 9.4098 9.4098 9.4584 9.4584 9.6287 9.6287 9.6741 9.6741 9.7490 9.7490 9.7662 9.7662 9.9628 9.9628 10.1957 10.1957 10.2361 10.2361 10.3157 10.3157 10.4495 10.4495 10.5832 10.5832 11.3851 11.3851 11.4436 11.4436 12.8817 12.8817 12.9659 12.9659 13.2127 13.2127 13.5275 13.5275 13.5998 13.5998 k = 0.4267 0.4157-0.0000 ( 5143 PWs) bands (ev): 1.1086 1.1086 1.4123 1.4123 4.6570 4.6570 5.4557 5.4557 6.7204 6.7204 6.7943 6.7943 6.9684 6.9684 8.3814 8.3814 8.6204 8.6204 8.7741 8.7741 9.0358 9.0358 9.1218 9.1218 9.1517 9.1517 9.2740 9.2740 9.3116 9.3116 9.3760 9.3760 9.4125 9.4125 9.4629 9.4629 9.6220 9.6220 9.6820 9.6820 9.7473 9.7473 9.7791 9.7791 9.9282 9.9282 10.1948 10.1948 10.2522 10.2522 10.3045 10.3045 10.4590 10.4590 10.5894 10.5894 11.3677 11.3677 11.4223 11.4223 12.9131 12.9131 12.9861 12.9861 13.2673 13.2673 13.5031 13.5031 13.5774 13.5774 k = 0.4200 0.4272-0.0000 ( 5149 PWs) bands (ev): 1.1194 1.1194 1.4222 1.4222 4.6933 4.6933 5.4788 5.4788 6.6218 6.6218 6.7564 6.7564 6.9403 6.9403 8.4262 8.4262 8.6421 8.6421 8.7659 8.7659 9.0161 9.0161 9.1196 9.1196 9.1610 9.1610 9.2772 9.2772 9.3123 9.3123 9.3776 9.3776 9.4154 9.4154 9.4669 9.4669 9.6136 9.6136 9.6931 9.6931 9.7458 9.7458 9.7925 9.7925 9.8958 9.8958 10.1903 10.1903 10.2694 10.2694 10.2932 10.2932 10.4689 10.4689 10.5948 10.5948 11.3480 11.3480 11.4006 11.4006 12.9417 12.9417 13.0084 13.0084 13.3219 13.3219 13.4774 13.4774 13.5557 13.5557 k = 0.4133 0.4388-0.0000 ( 5149 PWs) bands (ev): 1.1306 1.1306 1.4325 1.4325 4.7325 4.7325 5.5036 5.5036 6.5220 6.5220 6.6995 6.6995 6.9313 6.9313 8.4660 8.4660 8.6665 8.6665 8.7587 8.7587 8.9948 8.9948 9.1186 9.1186 9.1700 9.1700 9.2806 9.2806 9.3121 9.3121 9.3799 9.3799 9.4186 9.4186 9.4704 9.4704 9.6053 9.6053 9.7053 9.7053 9.7450 9.7450 9.8039 9.8039 9.8686 9.8686 10.1850 10.1850 10.2738 10.2738 10.2928 10.2928 10.4789 10.4789 10.5994 10.5994 11.3254 11.3254 11.3799 11.3799 12.9675 12.9675 13.0325 13.0325 13.3748 13.3748 13.4512 13.4512 13.5349 13.5349 k = 0.4067 0.4503-0.0000 ( 5155 PWs) bands (ev): 1.1422 1.1422 1.4429 1.4429 4.7747 4.7747 5.5301 5.5301 6.4217 6.4217 6.6325 6.6325 6.9330 6.9330 8.5007 8.5007 8.6916 8.6916 8.7542 8.7542 8.9723 8.9723 9.1190 9.1190 9.1783 9.1783 9.2842 9.2842 9.3108 9.3108 9.3828 9.3828 9.4221 9.4221 9.4733 9.4733 9.5977 9.5977 9.7168 9.7168 9.7455 9.7455 9.8054 9.8054 9.8554 9.8554 10.1793 10.1793 10.2609 10.2609 10.3061 10.3061 10.4888 10.4888 10.6032 10.6032 11.2993 11.2993 11.3610 11.3610 12.9908 12.9908 13.0583 13.0583 13.4224 13.4224 13.4258 13.4258 13.5165 13.5165 k = 0.4000 0.4619-0.0000 ( 5151 PWs) bands (ev): 1.1539 1.1539 1.4533 1.4533 4.8197 4.8197 5.5581 5.5581 6.3214 6.3214 6.5614 6.5614 6.9396 6.9396 8.5309 8.5309 8.7120 8.7120 8.7567 8.7567 8.9492 8.9492 9.1211 9.1211 9.1858 9.1858 9.2878 9.2878 9.3088 9.3088 9.3862 9.3862 9.4259 9.4259 9.4756 9.4756 9.5911 9.5911 9.7240 9.7240 9.7479 9.7479 9.7947 9.7947 9.8618 9.8618 10.1736 10.1736 10.2453 10.2453 10.3180 10.3180 10.4986 10.4986 10.6061 10.6061 11.2702 11.2702 11.3444 11.3444 13.0120 13.0120 13.0858 13.0858 13.3997 13.3997 13.4561 13.4561 13.5092 13.5092 k = 0.3933 0.4734-0.0000 ( 5159 PWs) bands (ev): 1.1655 1.1655 1.4637 1.4637 4.8674 4.8674 5.5875 5.5875 6.2215 6.2215 6.4895 6.4895 6.9486 6.9486 8.5574 8.5574 8.7194 8.7194 8.7728 8.7728 8.9257 8.9257 9.1249 9.1249 9.1925 9.1925 9.2912 9.2912 9.3062 9.3062 9.3900 9.3900 9.4300 9.4300 9.4773 9.4773 9.5856 9.5856 9.7238 9.7238 9.7464 9.7464 9.7917 9.7917 9.8768 9.8768 10.1680 10.1680 10.2286 10.2286 10.3262 10.3262 10.5081 10.5081 10.6081 10.6081 11.2391 11.2391 11.3298 11.3298 13.0317 13.0317 13.1149 13.1149 13.3756 13.3756 13.4538 13.4538 13.5313 13.5313 k = 0.3867 0.4850-0.0000 ( 5159 PWs) bands (ev): 1.1770 1.1770 1.4737 1.4737 4.9179 4.9179 5.6182 5.6182 6.1228 6.1228 6.4184 6.4184 6.9585 6.9585 8.5811 8.5811 8.7186 8.7186 8.7962 8.7962 8.9022 8.9022 9.1304 9.1304 9.1984 9.1984 9.2942 9.2942 9.3038 9.3038 9.3939 9.3939 9.4345 9.4345 9.4783 9.4783 9.5811 9.5811 9.7149 9.7149 9.7399 9.7399 9.8054 9.8054 9.8944 9.8944 10.1624 10.1624 10.2111 10.2111 10.3298 10.3298 10.5171 10.5171 10.6093 10.6093 11.2072 11.2072 11.3171 11.3171 13.0502 13.0502 13.1457 13.1457 13.3533 13.3533 13.4357 13.4357 13.5608 13.5608 k = 0.3800 0.4965-0.0000 ( 5151 PWs) bands (ev): 1.1880 1.1880 1.4833 1.4833 4.9709 4.9709 5.6499 5.6499 6.0255 6.0255 6.3492 6.3492 6.9688 6.9688 8.6030 8.6030 8.7158 8.7158 8.8193 8.8193 8.8790 8.8790 9.1376 9.1376 9.2035 9.2035 9.2954 9.2954 9.3029 9.3029 9.3978 9.3978 9.4392 9.4392 9.4787 9.4787 9.5778 9.5778 9.6993 9.6993 9.7362 9.7362 9.8278 9.8278 9.9132 9.9132 10.1563 10.1563 10.1935 10.1935 10.3279 10.3279 10.5254 10.5254 10.6097 10.6097 11.1759 11.1759 11.3060 11.3060 13.0681 13.0681 13.1781 13.1781 13.3332 13.3332 13.4142 13.4142 13.5834 13.5834 k = 0.3733 0.5081-0.0000 ( 5155 PWs) bands (ev): 1.1984 1.1984 1.4922 1.4922 5.0263 5.0263 5.6824 5.6824 5.9304 5.9304 6.2831 6.2831 6.9788 6.9788 8.6234 8.6234 8.7129 8.7129 8.8380 8.8380 8.8576 8.8576 9.1460 9.1460 9.2078 9.2078 9.2936 9.2936 9.3048 9.3048 9.4017 9.4017 9.4439 9.4439 9.4784 9.4784 9.5756 9.5756 9.6824 9.6824 9.7342 9.7342 9.8553 9.8553 9.9326 9.9326 10.1487 10.1487 10.1769 10.1769 10.3198 10.3198 10.5330 10.5330 10.6095 10.6095 11.1465 11.1465 11.2965 11.2965 13.0860 13.0860 13.2118 13.2118 13.3159 13.3159 13.3913 13.3913 13.5949 13.5949 k = 0.3667 0.5196-0.0000 ( 5155 PWs) bands (ev): 1.2079 1.2079 1.5003 1.5003 5.0840 5.0840 5.7152 5.7152 5.8380 5.8380 6.2208 6.2208 6.9881 6.9881 8.6429 8.6429 8.7105 8.7105 8.8314 8.8314 8.8582 8.8582 9.1549 9.1549 9.2113 9.2113 9.2909 9.2909 9.3075 9.3075 9.4054 9.4054 9.4485 9.4485 9.4776 9.4776 9.5745 9.5745 9.6668 9.6668 9.7328 9.7328 9.8869 9.8869 9.9525 9.9525 10.1374 10.1374 10.1640 10.1640 10.3047 10.3047 10.5397 10.5397 10.6088 10.6088 11.1203 11.1203 11.2885 11.2885 13.1044 13.1044 13.2458 13.2458 13.3025 13.3025 13.3675 13.3675 13.5940 13.5940 k = 0.3600 0.5312-0.0000 ( 5163 PWs) bands (ev): 1.2163 1.2163 1.5073 1.5073 5.1437 5.1437 5.7451 5.7451 5.7518 5.7518 6.1634 6.1634 6.9963 6.9963 8.6616 8.6616 8.7089 8.7089 8.8106 8.8106 8.8697 8.8697 9.1637 9.1637 9.2140 9.2140 9.2884 9.2884 9.3103 9.3103 9.4088 9.4088 9.4527 9.4527 9.4763 9.4763 9.5746 9.5746 9.6531 9.6531 9.7318 9.7318 9.9221 9.9221 9.9730 9.9730 10.1213 10.1213 10.1559 10.1559 10.2823 10.2823 10.5452 10.5452 10.6077 10.6077 11.0981 11.0981 11.2821 11.2821 13.1236 13.1236 13.2718 13.2718 13.3012 13.3012 13.3429 13.3429 13.5807 13.5807 k = 0.3533 0.5427-0.0000 ( 5161 PWs) bands (ev): 1.2234 1.2234 1.5131 1.5131 5.2047 5.2047 5.6645 5.6645 5.7792 5.7792 6.1125 6.1125 7.0033 7.0033 8.6795 8.6795 8.7081 8.7081 8.7902 8.7902 8.8782 8.8782 9.1714 9.1714 9.2159 9.2159 9.2864 9.2864 9.3127 9.3127 9.4118 9.4118 9.4563 9.4563 9.4745 9.4745 9.5756 9.5756 9.6418 9.6418 9.7310 9.7310 9.9593 9.9593 9.9950 9.9950 10.1031 10.1031 10.1506 10.1506 10.2529 10.2529 10.5497 10.5497 10.6065 10.6065 11.0809 11.0809 11.2772 11.2772 13.1440 13.1440 13.2718 13.2718 13.3179 13.3179 13.3298 13.3298 13.5568 13.5568 k = 0.3467 0.5543-0.0000 ( 5165 PWs) bands (ev): 1.2287 1.2287 1.5174 1.5174 5.2656 5.2656 5.5864 5.5864 5.8068 5.8068 6.0705 6.0705 7.0085 7.0085 8.6954 8.6954 8.7092 8.7092 8.7709 8.7709 8.8836 8.8836 9.1773 9.1773 9.2170 9.2170 9.2851 9.2851 9.3145 9.3145 9.4142 9.4142 9.4591 9.4591 9.4726 9.4726 9.5771 9.5771 9.6334 9.6334 9.7305 9.7305 9.9933 9.9933 10.0225 10.0225 10.0848 10.0848 10.1461 10.1461 10.2175 10.2175 10.5528 10.5528 10.6054 10.6054 11.0687 11.0687 11.2737 11.2737 13.1654 13.1654 13.2662 13.2662 13.2933 13.2933 13.3676 13.3676 13.5250 13.5250 k = 0.3400 0.5658-0.0000 ( 5171 PWs) bands (ev): 1.2322 1.2322 1.5202 1.5202 5.3216 5.3216 5.5198 5.5198 5.8269 5.8269 6.0416 6.0416 7.0119 7.0119 8.7032 8.7032 8.7180 8.7180 8.7531 8.7531 8.8865 8.8865 9.1810 9.1810 9.2176 9.2176 9.2844 9.2844 9.3157 9.3157 9.4159 9.4159 9.4610 9.4610 9.4709 9.4709 9.5786 9.5786 9.6280 9.6280 9.7301 9.7301 10.0168 10.0168 10.0558 10.0558 10.0727 10.0727 10.1390 10.1390 10.1812 10.1812 10.5547 10.5547 10.6046 10.6046 11.0617 11.0617 11.2717 11.2717 13.1858 13.1858 13.2614 13.2614 13.2718 13.2718 13.4072 13.4072 13.4880 13.4880 k = 0.3333 0.5774-0.0000 ( 5187 PWs) bands (ev): 1.2334 1.2334 1.5211 1.5211 5.3506 5.3506 5.4872 5.4872 5.8343 5.8343 6.0313 6.0313 7.0130 7.0130 8.7042 8.7042 8.7283 8.7283 8.7413 8.7413 8.8874 8.8874 9.1822 9.1822 9.2178 9.2178 9.2842 9.2842 9.3161 9.3161 9.4165 9.4165 9.4616 9.4616 9.4701 9.4701 9.5792 9.5792 9.6262 9.6262 9.7300 9.7300 10.0270 10.0270 10.0562 10.0562 10.0949 10.0949 10.1233 10.1233 10.1644 10.1644 10.5552 10.5552 10.6043 10.6043 11.0594 11.0594 11.2710 11.2710 13.1966 13.1966 13.2569 13.2569 13.2635 13.2635 13.4443 13.4443 13.4516 13.4516 k = 0.3333 0.5774-0.0000 ( 5187 PWs) bands (ev): 1.2334 1.2334 1.5211 1.5211 5.3506 5.3506 5.4872 5.4872 5.8343 5.8343 6.0313 6.0313 7.0130 7.0130 8.7042 8.7042 8.7283 8.7283 8.7413 8.7413 8.8874 8.8874 9.1822 9.1822 9.2178 9.2178 9.2842 9.2842 9.3161 9.3161 9.4165 9.4165 9.4616 9.4616 9.4701 9.4701 9.5792 9.5792 9.6262 9.6262 9.7300 9.7300 10.0270 10.0270 10.0562 10.0562 10.0949 10.0949 10.1233 10.1233 10.1644 10.1644 10.5552 10.5552 10.6043 10.6043 11.0594 11.0594 11.2710 11.2710 13.1966 13.1966 13.2569 13.2569 13.2635 13.2635 13.4443 13.4443 13.4516 13.4516 k = 0.3267 0.5658-0.0000 ( 5179 PWs) bands (ev): 1.2321 1.2321 1.5201 1.5201 5.3229 5.3229 5.5186 5.5186 5.8278 5.8278 6.0408 6.0408 7.0118 7.0118 8.7032 8.7032 8.7186 8.7186 8.7523 8.7523 8.8866 8.8866 9.1810 9.1810 9.2176 9.2176 9.2843 9.2843 9.3156 9.3156 9.4158 9.4158 9.4610 9.4610 9.4709 9.4709 9.5786 9.5786 9.6279 9.6279 9.7301 9.7301 10.0186 10.0186 10.0509 10.0509 10.0730 10.0730 10.1400 10.1400 10.1834 10.1834 10.5548 10.5548 10.6046 10.6046 11.0615 11.0615 11.2716 11.2716 13.1850 13.1850 13.2592 13.2592 13.2747 13.2747 13.4067 13.4067 13.4889 13.4889 k = 0.3200 0.5543-0.0000 ( 5181 PWs) bands (ev): 1.2280 1.2280 1.5170 1.5170 5.2724 5.2724 5.5804 5.5804 5.8128 5.8128 6.0648 6.0648 7.0080 7.0080 8.6974 8.6974 8.7096 8.7096 8.7674 8.7674 8.8847 8.8847 9.1776 9.1776 9.2170 9.2170 9.2845 9.2845 9.3144 9.3144 9.4138 9.4138 9.4597 9.4597 9.4732 9.4732 9.5769 9.5769 9.6324 9.6324 9.7304 9.7304 9.9971 9.9971 10.0108 10.0108 10.0806 10.0806 10.1488 10.1488 10.2296 10.2296 10.5535 10.5535 10.6054 10.6054 11.0673 11.0673 11.2736 11.2736 13.1609 13.1609 13.2604 13.2604 13.3031 13.3031 13.3662 13.3662 13.5296 13.5296 k = 0.3133 0.5427-0.0000 ( 5177 PWs) bands (ev): 1.2209 1.2209 1.5117 1.5117 5.2211 5.2211 5.6507 5.6507 5.7958 5.7958 6.0972 6.0972 7.0014 7.0014 8.6856 8.6856 8.7062 8.7062 8.7821 8.7821 8.8818 8.8818 9.1724 9.1724 9.2157 9.2157 9.2847 9.2847 9.3123 9.3123 9.4106 9.4106 9.4581 9.4581 9.4765 9.4765 9.5747 9.5747 9.6389 9.6389 9.7308 9.7308 9.9457 9.9457 9.9946 9.9946 10.0898 10.0898 10.1577 10.1577 10.2822 10.2822 10.5518 10.5518 10.6067 10.6067 11.0764 11.0764 11.2768 11.2768 13.1332 13.1332 13.2611 13.2611 13.3276 13.3276 13.3384 13.3384 13.5698 13.5698 k = 0.3067 0.5312-0.0000 ( 5171 PWs) bands (ev): 1.2107 1.2107 1.5041 1.5041 5.1742 5.1742 5.7244 5.7244 5.7807 5.7807 6.1340 6.1340 6.9920 6.9920 8.6728 8.6728 8.7035 8.7035 8.7960 8.7960 8.8785 8.8785 9.1654 9.1654 9.2136 9.2136 9.2849 9.2849 9.3095 9.3095 9.4065 9.4065 9.4563 9.4563 9.4807 9.4807 9.5724 9.5724 9.6467 9.6467 9.7312 9.7312 9.8912 9.8912 9.9835 9.9835 10.0956 10.0956 10.1700 10.1700 10.3360 10.3360 10.5503 10.5503 10.6083 10.6083 11.0883 11.0883 11.2811 11.2811 13.1042 13.1042 13.2565 13.2565 13.2968 13.2968 13.3771 13.3771 13.6090 13.6090 k = 0.3000 0.5196-0.0000 ( 5167 PWs) bands (ev): 1.1970 1.1970 1.4942 1.4942 5.1332 5.1332 5.7676 5.7676 5.8017 5.8017 6.1734 6.1734 6.9798 6.9798 8.6600 8.6600 8.6996 8.6996 8.8085 8.8085 8.8749 8.8749 9.1566 9.1566 9.2105 9.2105 9.2850 9.2850 9.3061 9.3061 9.4019 9.4019 9.4544 9.4544 9.4856 9.4856 9.5702 9.5702 9.6553 9.6553 9.7315 9.7315 9.8388 9.8388 9.9752 9.9752 10.0984 10.0984 10.1851 10.1851 10.3892 10.3892 10.5493 10.5493 10.6103 10.6103 11.1028 11.1028 11.2866 11.2866 13.0746 13.0746 13.2348 13.2348 13.2851 13.2851 13.4187 13.4187 13.6470 13.6470 k = 0.2933 0.5081-0.0000 ( 5169 PWs) bands (ev): 1.1798 1.1798 1.4819 1.4819 5.0989 5.0989 5.7609 5.7609 5.8784 5.8784 6.2143 6.2143 6.9648 6.9648 8.6471 8.6471 8.6940 8.6940 8.8191 8.8191 8.8720 8.8720 9.1460 9.1460 9.2063 9.2063 9.2849 9.2849 9.3026 9.3026 9.3970 9.3970 9.4521 9.4521 9.4909 9.4909 9.5684 9.5684 9.6644 9.6644 9.7305 9.7305 9.7915 9.7915 9.9699 9.9699 10.0994 10.0994 10.2020 10.2020 10.4404 10.4404 10.5496 10.5496 10.6128 10.6128 11.1195 11.1195 11.2931 11.2931 13.0450 13.0450 13.2034 13.2034 13.2849 13.2849 13.4622 13.4622 13.6830 13.6830 k = 0.2867 0.4965-0.0000 ( 5173 PWs) bands (ev): 1.1589 1.1589 1.4671 1.4671 5.0717 5.0717 5.7588 5.7588 5.9563 5.9563 6.2560 6.2560 6.9473 6.9473 8.6337 8.6337 8.6862 8.6862 8.8268 8.8268 8.8705 8.8705 9.1334 9.1334 9.2009 9.2009 9.2843 9.2843 9.2992 9.2992 9.3922 9.3922 9.4495 9.4495 9.4964 9.4964 9.5671 9.5671 9.6734 9.6734 9.7219 9.7219 9.7577 9.7577 9.9678 9.9678 10.0993 10.0993 10.2195 10.2195 10.4874 10.4874 10.5528 10.5528 10.6161 10.6161 11.1381 11.1381 11.3008 11.3008 13.0156 13.0156 13.1715 13.1715 13.2864 13.2864 13.5066 13.5066 13.7168 13.7168 k = 0.2800 0.4850-0.0000 ( 5171 PWs) bands (ev): 1.1344 1.1344 1.4500 1.4500 5.0517 5.0517 5.7619 5.7619 6.0343 6.0343 6.2982 6.2982 6.9276 6.9276 8.6195 8.6195 8.6761 8.6761 8.8305 8.8305 8.8716 8.8716 9.1187 9.1187 9.1944 9.1944 9.2829 9.2829 9.2968 9.2968 9.3876 9.3876 9.4463 9.4463 9.5017 9.5017 9.5663 9.5663 9.6790 9.6790 9.6991 9.6991 9.7488 9.7488 9.9691 9.9691 10.0987 10.0987 10.2371 10.2371 10.5237 10.5237 10.5639 10.5639 10.6210 10.6210 11.1587 11.1587 11.3096 11.3096 12.9867 12.9867 13.1413 13.1413 13.2871 13.2871 13.5506 13.5506 13.7479 13.7479 k = 0.2733 0.4734-0.0000 ( 5161 PWs) bands (ev): 1.1063 1.1063 1.4306 1.4306 5.0392 5.0392 5.7704 5.7704 6.1114 6.1114 6.3406 6.3406 6.9063 6.9063 8.6039 8.6039 8.6634 8.6634 8.8302 8.8302 8.8752 8.8752 9.1022 9.1022 9.1867 9.1867 9.2801 9.2801 9.2957 9.2957 9.3836 9.3836 9.4426 9.4426 9.5064 9.5064 9.5662 9.5662 9.6609 9.6609 9.6981 9.6981 9.7504 9.7504 9.9739 9.9739 10.0979 10.0979 10.2543 10.2543 10.5410 10.5410 10.5886 10.5886 10.6305 10.6305 11.1810 11.1810 11.3196 11.3196 12.9585 12.9585 13.1134 13.1134 13.2858 13.2858 13.5928 13.5928 13.7757 13.7757 k = 0.2667 0.4619-0.0000 ( 5157 PWs) bands (ev): 1.0747 1.0747 1.4091 1.4091 5.0341 5.0341 5.7841 5.7841 6.1867 6.1867 6.3830 6.3830 6.8844 6.8844 8.5864 8.5864 8.6481 8.6481 8.8272 8.8272 8.8802 8.8802 9.0841 9.0841 9.1781 9.1781 9.2761 9.2761 9.2959 9.2959 9.3803 9.3803 9.4380 9.4380 9.5099 9.5099 9.5669 9.5669 9.6386 9.6386 9.7073 9.7073 9.7554 9.7554 9.9821 9.9821 10.0971 10.0971 10.2708 10.2708 10.5499 10.5499 10.6088 10.6088 10.6516 10.6516 11.2051 11.2051 11.3308 11.3308 12.9310 12.9310 13.0879 13.0879 13.2817 13.2817 13.6318 13.6318 13.8000 13.8000 k = 0.2600 0.4503-0.0000 ( 5159 PWs) bands (ev): 1.0396 1.0396 1.3854 1.3854 5.0364 5.0364 5.8029 5.8029 6.2581 6.2581 6.4252 6.4252 6.8635 6.8635 8.5666 8.5666 8.6301 8.6301 8.8227 8.8227 8.8853 8.8853 9.0653 9.0653 9.1684 9.1684 9.2713 9.2713 9.2966 9.2966 9.3777 9.3777 9.4327 9.4327 9.5119 9.5119 9.5683 9.5683 9.6231 9.6231 9.7174 9.7174 9.7627 9.7627 9.9936 9.9936 10.0965 10.0965 10.2862 10.2862 10.5586 10.5586 10.6191 10.6191 10.6813 10.6813 11.2308 11.2308 11.3431 11.3431 12.9046 12.9046 13.0650 13.0650 13.2745 13.2745 13.6663 13.6663 13.8202 13.8202 k = 0.2533 0.4388-0.0000 ( 5175 PWs) bands (ev): 1.0014 1.0014 1.3598 1.3598 5.0459 5.0459 5.8267 5.8267 6.3228 6.3228 6.4676 6.4676 6.8461 6.8461 8.5443 8.5443 8.6094 8.6094 8.8174 8.8174 8.8897 8.8897 9.0464 9.0464 9.1576 9.1576 9.2660 9.2660 9.2976 9.2976 9.3760 9.3760 9.4266 9.4266 9.5123 9.5123 9.5701 9.5701 9.6151 9.6151 9.7277 9.7277 9.7724 9.7724 10.0083 10.0083 10.0964 10.0964 10.3004 10.3004 10.5687 10.5687 10.6269 10.6269 10.7109 10.7109 11.2580 11.2580 11.3568 11.3568 12.8791 12.8791 13.0446 13.0446 13.2639 13.2639 13.6954 13.6954 13.8362 13.8362 k = 0.2467 0.4272-0.0000 ( 5175 PWs) bands (ev): 0.9602 0.9602 1.3324 1.3324 5.0625 5.0625 5.8551 5.8551 6.3758 6.3758 6.5109 6.5109 6.8361 6.8361 8.5197 8.5197 8.5863 8.5863 8.8118 8.8118 8.8932 8.8932 9.0283 9.0283 9.1459 9.1459 9.2602 9.2602 9.2985 9.2985 9.3750 9.3750 9.4198 9.4198 9.5117 9.5117 9.5724 9.5724 9.6140 9.6140 9.7383 9.7383 9.7845 9.7845 10.0260 10.0260 10.0970 10.0970 10.3134 10.3134 10.5807 10.5807 10.6350 10.6350 10.7369 10.7369 11.2868 11.2868 11.3719 11.3719 12.8547 12.8547 13.0269 13.0269 13.2502 13.2502 13.7188 13.7188 13.8477 13.8477 k = 0.2400 0.4157-0.0000 ( 5159 PWs) bands (ev): 0.9163 0.9163 1.3033 1.3033 5.0860 5.0860 5.8878 5.8878 6.4112 6.4112 6.5560 6.5560 6.8384 6.8384 8.4930 8.4930 8.5609 8.5609 8.8061 8.8061 8.8956 8.8956 9.0116 9.0116 9.1331 9.1331 9.2539 9.2539 9.2992 9.2992 9.3747 9.3747 9.4124 9.4124 9.5113 9.5113 9.5750 9.5750 9.6180 9.6180 9.7492 9.7492 9.7987 9.7987 10.0460 10.0460 10.0989 10.0989 10.3252 10.3252 10.5946 10.5946 10.6443 10.6443 10.7583 10.7583 11.3170 11.3170 11.3886 11.3886 12.8311 12.8311 13.0118 13.0118 13.2339 13.2339 13.7372 13.7372 13.8546 13.8546 k = 0.2333 0.4041-0.0000 ( 5159 PWs) bands (ev): 0.8699 0.8699 1.2729 1.2729 5.1160 5.1160 5.9243 5.9243 6.4253 6.4253 6.6022 6.6022 6.8571 6.8571 8.4645 8.4645 8.5334 8.5334 8.8004 8.8004 8.8967 8.8967 8.9967 8.9967 9.1193 9.1193 9.2470 9.2470 9.2994 9.2994 9.3748 9.3748 9.4051 9.4051 9.5119 9.5119 9.5780 9.5780 9.6255 9.6255 9.7607 9.7607 9.8148 9.8148 10.0665 10.0665 10.1034 10.1034 10.3359 10.3359 10.6100 10.6100 10.6557 10.6557 10.7749 10.7749 11.3481 11.3481 11.4073 11.4073 12.8083 12.8083 12.9993 12.9993 13.2155 13.2155 13.7514 13.7514 13.8568 13.8568 k = 0.2267 0.3926-0.0000 ( 5155 PWs) bands (ev): 0.8215 0.8215 1.2412 1.2412 5.1523 5.1523 5.9642 5.9642 6.4198 6.4198 6.6478 6.6478 6.8924 6.8924 8.4348 8.4348 8.5042 8.5042 8.7949 8.7949 8.8967 8.8967 8.9836 8.9836 9.1045 9.1045 9.2394 9.2394 9.2991 9.2991 9.3738 9.3738 9.3994 9.3994 9.5139 9.5139 9.5815 9.5815 9.6356 9.6356 9.7728 9.7728 9.8328 9.8328 10.0833 10.0833 10.1146 10.1146 10.3456 10.3456 10.6268 10.6268 10.6695 10.6695 10.7864 10.7864 11.3799 11.3799 11.4284 11.4284 12.7859 12.7859 12.9892 12.9892 13.1958 13.1958 13.7629 13.7629 13.8540 13.8540 k = 0.2200 0.3811-0.0000 ( 5151 PWs) bands (ev): 0.7712 0.7712 1.2085 1.2085 5.1945 5.1945 6.0066 6.0066 6.3994 6.3994 6.6918 6.6918 6.9405 6.9405 8.4046 8.4046 8.4736 8.4736 8.7896 8.7896 8.8956 8.8956 8.9721 8.9721 9.0887 9.0887 9.2310 9.2310 9.2980 9.2980 9.3694 9.3694 9.3984 9.3984 9.5175 9.5175 9.5854 9.5854 9.6475 9.6475 9.7854 9.7854 9.8525 9.8525 10.0927 10.0927 10.1357 10.1357 10.3546 10.3546 10.6447 10.6447 10.6864 10.6864 10.7932 10.7932 11.4112 11.4112 11.4528 11.4528 12.7637 12.7637 12.9817 12.9817 13.1755 13.1755 13.7730 13.7730 13.8458 13.8458 k = 0.2133 0.3695-0.0000 ( 5147 PWs) bands (ev): 0.7195 0.7195 1.1749 1.1749 5.2423 5.2423 6.0503 6.0503 6.3698 6.3698 6.7342 6.7342 6.9964 6.9964 8.3744 8.3744 8.4420 8.4420 8.7845 8.7845 8.8933 8.8933 8.9619 8.9619 9.0721 9.0721 9.2217 9.2217 9.2962 9.2962 9.3610 9.3610 9.4030 9.4030 9.5225 9.5225 9.5897 9.5897 9.6608 9.6608 9.7986 9.7986 9.8738 9.8738 10.0987 10.0987 10.1622 10.1622 10.3632 10.3632 10.6635 10.6635 10.7063 10.7063 10.7954 10.7954 11.4412 11.4412 11.4815 11.4815 12.7411 12.7411 12.9766 12.9766 13.1554 13.1554 13.7831 13.7831 13.8322 13.8322 k = 0.2067 0.3580-0.0000 ( 5149 PWs) bands (ev): 0.6667 0.6667 1.1406 1.1406 5.2954 5.2954 6.0926 6.0926 6.3367 6.3367 6.7754 6.7754 7.0559 7.0559 8.3448 8.3448 8.4098 8.4098 8.7798 8.7798 8.8900 8.8900 8.9527 8.9527 9.0548 9.0548 9.2116 9.2116 9.2936 9.2936 9.3501 9.3501 9.4122 9.4122 9.5286 9.5286 9.5944 9.5944 9.6754 9.6754 9.8121 9.8121 9.8966 9.8966 10.1043 10.1043 10.1903 10.1903 10.3714 10.3714 10.6834 10.6834 10.7290 10.7290 10.7941 10.7941 11.4695 11.4695 11.5146 11.5146 12.7178 12.7178 12.9739 12.9739 13.1361 13.1361 13.7940 13.7940 13.8148 13.8148 k = 0.2000 0.3464-0.0000 ( 5147 PWs) bands (ev): 0.6130 0.6130 1.1059 1.1059 5.3534 5.3534 6.1268 6.1268 6.3090 6.3090 6.8155 6.8155 7.1158 7.1158 8.3165 8.3165 8.3775 8.3775 8.7753 8.7753 8.8857 8.8857 8.9439 8.9439 9.0368 9.0368 9.2006 9.2006 9.2900 9.2900 9.3381 9.3381 9.4257 9.4257 9.5355 9.5355 9.5994 9.5994 9.6910 9.6910 9.8258 9.8258 9.9211 9.9211 10.1105 10.1105 10.2186 10.2186 10.3794 10.3794 10.7036 10.7036 10.7539 10.7539 10.7914 10.7914 11.4972 11.4972 11.5510 11.5510 12.6933 12.6933 12.9734 12.9734 13.1182 13.1182 13.7912 13.7912 13.8098 13.8098 k = 0.1933 0.3349-0.0000 ( 5147 PWs) bands (ev): 0.5588 0.5588 1.0708 1.0708 5.4159 5.4159 6.1376 6.1376 6.3030 6.3030 6.8547 6.8547 7.1742 7.1742 8.2895 8.2895 8.3456 8.3456 8.7713 8.7713 8.8804 8.8804 8.9353 8.9353 9.0184 9.0184 9.1887 9.1887 9.2854 9.2854 9.3252 9.3252 9.4436 9.4436 9.5428 9.5428 9.6049 9.6049 9.7077 9.7077 9.8397 9.8397 9.9469 9.9469 10.1175 10.1175 10.2461 10.2461 10.3875 10.3875 10.7210 10.7210 10.7769 10.7769 10.7951 10.7951 11.5252 11.5252 11.5894 11.5894 12.6673 12.6673 12.9752 12.9752 13.1023 13.1023 13.7703 13.7703 13.8025 13.8025 k = 0.1867 0.3233-0.0000 ( 5139 PWs) bands (ev): 0.5043 0.5043 1.0357 1.0357 5.4826 5.4826 6.1160 6.1160 6.3286 6.3286 6.8929 6.8929 7.2296 7.2296 8.2642 8.2642 8.3148 8.3148 8.7677 8.7677 8.8743 8.8743 8.9264 8.9264 8.9997 8.9997 9.1759 9.1759 9.2796 9.2796 9.3120 9.3120 9.4663 9.4663 9.5504 9.5504 9.6108 9.6108 9.7253 9.7253 9.8534 9.8534 9.9741 9.9741 10.1257 10.1257 10.2722 10.2722 10.3956 10.3956 10.7272 10.7272 10.7929 10.7929 10.8195 10.8195 11.5541 11.5541 11.6290 11.6290 12.6395 12.6395 12.9791 12.9791 13.0887 13.0887 13.7482 13.7482 13.7819 13.7819 k = 0.1800 0.3118-0.0000 ( 5139 PWs) bands (ev): 0.4498 0.4498 1.0006 1.0006 5.5532 5.5532 6.0751 6.0751 6.3729 6.3729 6.9303 6.9303 7.2808 7.2808 8.2403 8.2403 8.2858 8.2858 8.7644 8.7644 8.8675 8.8675 8.9168 8.9168 8.9808 8.9808 9.1624 9.1624 9.2723 9.2723 9.2987 9.2987 9.4939 9.4939 9.5582 9.5582 9.6173 9.6173 9.7437 9.7437 9.8670 9.8670 10.0023 10.0023 10.1351 10.1351 10.2963 10.2963 10.4040 10.4040 10.7196 10.7196 10.8169 10.8169 10.8531 10.8531 11.5839 11.5839 11.6691 11.6691 12.6097 12.6097 12.9851 12.9851 13.0780 13.0780 13.7258 13.7258 13.7596 13.7596 k = 0.1733 0.3002-0.0000 ( 5139 PWs) bands (ev): 0.3956 0.3956 0.9656 0.9656 5.6274 5.6274 6.0262 6.0262 6.4248 6.4248 6.9666 6.9666 7.3269 7.3269 8.2171 8.2171 8.2600 8.2600 8.7615 8.7615 8.8603 8.8603 8.9064 8.9064 8.9618 8.9618 9.1480 9.1480 9.2634 9.2634 9.2855 9.2855 9.5258 9.5258 9.5668 9.5668 9.6245 9.6245 9.7628 9.7628 9.8803 9.8803 10.0315 10.0315 10.1458 10.1458 10.3184 10.3184 10.4125 10.4125 10.7048 10.7048 10.8477 10.8477 10.8913 10.8913 11.6149 11.6149 11.7092 11.7092 12.5778 12.5778 12.9930 12.9930 13.0705 13.0705 13.7033 13.7033 13.7366 13.7366 k = 0.1667 0.2887-0.0000 ( 5139 PWs) bands (ev): 0.3419 0.3419 0.9311 0.9311 5.7046 5.7046 5.9738 5.9738 6.4799 6.4799 7.0019 7.0019 7.3674 7.3674 8.1934 8.1934 8.2390 8.2390 8.7588 8.7588 8.8527 8.8527 8.8950 8.8950 8.9430 8.9430 9.1329 9.1329 9.2527 9.2527 9.2726 9.2726 9.5554 9.5554 9.5819 9.5819 9.6335 9.6335 9.7824 9.7824 9.8933 9.8933 10.0611 10.0611 10.1580 10.1580 10.3383 10.3383 10.4214 10.4214 10.6869 10.6869 10.8820 10.8820 10.9340 10.9340 11.6468 11.6468 11.7488 11.7488 12.5440 12.5440 13.0028 13.0028 13.0665 13.0665 13.6809 13.6809 13.7135 13.7135 k = 0.1600 0.2771-0.0000 ( 5135 PWs) bands (ev): 0.2890 0.2890 0.8969 0.8969 5.7846 5.7846 5.9199 5.9199 6.5362 6.5362 7.0360 7.0360 7.4020 7.4020 8.1689 8.1689 8.2234 8.2234 8.7565 8.7565 8.8450 8.8450 8.8826 8.8826 8.9245 8.9245 9.1171 9.1171 9.2404 9.2404 9.2598 9.2598 9.5691 9.5691 9.6120 9.6120 9.6492 9.6492 9.8024 9.8024 9.9057 9.9057 10.0906 10.0906 10.1716 10.1716 10.3561 10.3561 10.4305 10.4305 10.6682 10.6682 10.9185 10.9185 10.9809 10.9809 11.6794 11.6794 11.7872 11.7872 12.5083 12.5083 13.0143 13.0143 13.0664 13.0664 13.6587 13.6587 13.6908 13.6908 k = 0.1533 0.2656-0.0000 ( 5131 PWs) bands (ev): 0.2369 0.2369 0.8634 0.8634 5.8633 5.8633 5.8694 5.8694 6.5927 6.5927 7.0689 7.0689 7.4304 7.4304 8.1442 8.1442 8.2129 8.2129 8.7541 8.7541 8.8376 8.8376 8.8692 8.8692 8.9064 8.9064 9.1005 9.1005 9.2268 9.2268 9.2468 9.2468 9.5757 9.5757 9.6328 9.6328 9.6870 9.6870 9.8225 9.8225 9.9177 9.9177 10.1195 10.1195 10.1868 10.1868 10.3721 10.3721 10.4398 10.4398 10.6502 10.6502 10.9571 10.9571 11.0320 11.0320 11.7125 11.7125 11.8242 11.8242 12.4710 12.4710 13.0273 13.0273 13.0704 13.0704 13.6369 13.6369 13.6688 13.6688 k = 0.1467 0.2540-0.0000 ( 5121 PWs) bands (ev): 0.1860 0.1860 0.8307 0.8307 5.8112 5.8112 5.9519 5.9519 6.6486 6.6486 7.1004 7.1004 7.4530 7.4530 8.1203 8.1203 8.2064 8.2064 8.7517 8.7517 8.8306 8.8306 8.8549 8.8549 8.8890 8.8890 9.0832 9.0832 9.2125 9.2125 9.2332 9.2332 9.5806 9.5806 9.6432 9.6432 9.7426 9.7426 9.8426 9.8426 9.9291 9.9291 10.1466 10.1466 10.2034 10.2034 10.3864 10.3864 10.4494 10.4494 10.6345 10.6345 10.9980 10.9980 11.0866 11.0866 11.7455 11.7455 11.8594 11.8594 12.4323 12.4323 13.0416 13.0416 13.0786 13.0786 13.6158 13.6158 13.6480 13.6480 k = 0.1400 0.2425-0.0000 ( 5115 PWs) bands (ev): 0.1363 0.1363 0.7987 0.7987 5.7575 5.7575 6.0382 6.0382 6.7034 6.7034 7.1304 7.1304 7.4700 7.4700 8.0978 8.0978 8.2032 8.2032 8.7488 8.7488 8.8242 8.8242 8.8399 8.8399 8.8723 8.8723 9.0653 9.0653 9.1976 9.1976 9.2189 9.2189 9.5846 9.5846 9.6510 9.6510 9.8065 9.8065 9.8623 9.8623 9.9400 9.9400 10.1706 10.1706 10.2214 10.2214 10.3993 10.3993 10.4591 10.4591 10.6231 10.6231 11.0415 11.0415 11.1444 11.1444 11.7779 11.7779 11.8925 11.8925 12.3925 12.3925 13.0572 13.0572 13.0910 13.0910 13.5958 13.5958 13.6283 13.6283 k = 0.1333 0.2309-0.0000 ( 5119 PWs) bands (ev): 0.0881 0.0881 0.7677 0.7677 5.7048 5.7048 6.1258 6.1258 6.7567 6.7567 7.1587 7.1587 7.4821 7.4821 8.0773 8.0773 8.2026 8.2026 8.7452 8.7452 8.8181 8.8181 8.8250 8.8250 8.8568 8.8568 9.0467 9.0467 9.1822 9.1822 9.2039 9.2039 9.5879 9.5879 9.6578 9.6578 9.8736 9.8736 9.8841 9.8841 9.9505 9.9505 10.1901 10.1901 10.2407 10.2407 10.4109 10.4109 10.4689 10.4689 10.6179 10.6179 11.0882 11.0882 11.2048 11.2048 11.8091 11.8091 11.9233 11.9233 12.3520 12.3520 13.0739 13.0739 13.1073 13.1073 13.5773 13.5773 13.6098 13.6098 k = 0.1267 0.2194-0.0000 ( 5121 PWs) bands (ev): 0.0415 0.0415 0.7377 0.7377 5.6533 5.6533 6.2144 6.2144 6.8080 6.8080 7.1852 7.1852 7.4900 7.4900 8.0591 8.0591 8.2039 8.2039 8.7406 8.7406 8.8068 8.8068 8.8154 8.8154 8.8429 8.8429 9.0275 9.0275 9.1663 9.1663 9.1885 9.1885 9.5908 9.5908 9.6640 9.6640 9.8982 9.8982 9.9482 9.9482 9.9649 9.9649 10.2032 10.2032 10.2610 10.2610 10.4214 10.4214 10.4791 10.4791 10.6208 10.6208 11.1385 11.1385 11.2676 11.2676 11.8382 11.8382 11.9520 11.9520 12.3111 12.3111 13.0918 13.0918 13.1269 13.1269 13.5608 13.5608 13.5926 13.5926 k = 0.1200 0.2078-0.0000 ( 5121 PWs) bands (ev): -0.0034 -0.0034 0.7088 0.7088 5.6034 5.6034 6.3036 6.3036 6.8570 6.8570 7.2097 7.2097 7.4942 7.4942 8.0436 8.0436 8.2067 8.2067 8.7350 8.7350 8.7911 8.7911 8.8093 8.8093 8.8325 8.8325 9.0078 9.0078 9.1496 9.1496 9.1730 9.1730 9.5934 9.5934 9.6697 9.6697 9.9151 9.9151 9.9670 9.9670 10.0346 10.0346 10.2089 10.2089 10.2825 10.2825 10.4310 10.4310 10.4896 10.4896 10.6328 10.6328 11.1931 11.1931 11.3324 11.3324 11.8646 11.8646 11.9786 11.9786 12.2701 12.2701 13.1108 13.1108 13.1494 13.1494 13.5465 13.5465 13.5766 13.5766 k = 0.1133 0.1963-0.0000 ( 5121 PWs) bands (ev): -0.0465 -0.0465 0.6811 0.6811 5.5551 5.5551 6.3928 6.3928 6.9034 6.9034 7.2321 7.2321 7.4956 7.4956 8.0310 8.0310 8.2104 8.2104 8.7284 8.7284 8.7751 8.7751 8.8006 8.8006 8.8275 8.8275 8.9877 8.9877 9.1320 9.1320 9.1578 9.1578 9.5956 9.5956 9.6748 9.6748 9.9304 9.9304 9.9758 9.9758 10.1170 10.1170 10.2070 10.2070 10.3048 10.3048 10.4399 10.4399 10.5007 10.5007 10.6542 10.6542 11.2524 11.2524 11.3990 11.3990 11.8876 11.8876 12.0034 12.0034 12.2295 12.2295 13.1308 13.1308 13.1740 13.1740 13.5348 13.5348 13.5619 13.5619 k = 0.1067 0.1848-0.0000 ( 5119 PWs) bands (ev): -0.0876 -0.0876 0.6546 0.6546 5.5087 5.5087 6.4817 6.4817 6.9471 6.9471 7.2522 7.2522 7.4948 7.4948 8.0214 8.0214 8.2147 8.2147 8.7209 8.7209 8.7594 8.7594 8.7894 8.7894 8.8272 8.8272 8.9674 8.9674 9.1133 9.1133 9.1433 9.1433 9.5975 9.5975 9.6796 9.6796 9.9440 9.9440 9.9839 9.9839 10.1932 10.1932 10.2059 10.2059 10.3290 10.3290 10.4482 10.4482 10.5125 10.5125 10.6842 10.6842 11.3169 11.3169 11.4672 11.4672 11.9065 11.9065 12.0263 12.0263 12.1898 12.1898 13.1516 13.1516 13.2001 13.2001 13.5255 13.5255 13.5486 13.5486 k = 0.1000 0.1732-0.0000 ( 5119 PWs) bands (ev): -0.1266 -0.1266 0.6295 0.6295 5.4644 5.4644 6.5697 6.5697 6.9877 6.9877 7.2701 7.2701 7.4924 7.4924 8.0151 8.0151 8.2192 8.2192 8.7129 8.7129 8.7440 8.7440 8.7776 8.7776 8.8293 8.8293 8.9471 8.9471 9.0936 9.0936 9.1296 9.1296 9.5992 9.5992 9.6839 9.6839 9.9558 9.9558 9.9916 9.9916 10.1833 10.1833 10.2803 10.2803 10.3601 10.3601 10.4563 10.4563 10.5250 10.5250 10.7215 10.7215 11.3869 11.3869 11.5366 11.5366 11.9211 11.9211 12.0467 12.0467 12.1521 12.1521 13.1729 13.1729 13.2269 13.2269 13.5185 13.5185 13.5371 13.5371 k = 0.0933 0.1617-0.0000 ( 5119 PWs) bands (ev): -0.1636 -0.1636 0.6058 0.6058 5.4223 5.4223 6.6563 6.6563 7.0253 7.0253 7.2857 7.2857 7.4890 7.4890 8.0120 8.0120 8.2237 8.2237 8.7045 8.7045 8.7292 8.7292 8.7660 8.7660 8.8324 8.8324 8.9273 8.9273 9.0734 9.0734 9.1169 9.1169 9.6006 9.6006 9.6878 9.6878 9.9653 9.9653 9.9991 9.9991 10.1657 10.1657 10.3344 10.3344 10.4145 10.4145 10.4646 10.4646 10.5389 10.5389 10.7648 10.7648 11.4625 11.4625 11.6068 11.6068 11.9315 11.9315 12.0604 12.0604 12.1210 12.1210 13.1946 13.1946 13.2537 13.2537 13.5129 13.5129 13.5282 13.5282 k = 0.0867 0.1501-0.0000 ( 5119 PWs) bands (ev): -0.1983 -0.1983 0.5835 0.5835 5.3826 5.3826 6.7409 6.7409 7.0596 7.0596 7.2990 7.2990 7.4850 7.4850 8.0120 8.0120 8.2281 8.2281 8.6958 8.6958 8.7150 8.7150 8.7549 8.7549 8.8350 8.8350 8.9091 8.9091 9.0530 9.0530 9.1049 9.1049 9.6018 9.6018 9.6912 9.6912 9.9724 9.9724 10.0066 10.0066 10.1458 10.1458 10.3631 10.3631 10.4657 10.4657 10.4951 10.4951 10.5590 10.5590 10.8131 10.8131 11.5437 11.5437 11.6773 11.6773 11.9380 11.9380 12.0518 12.0518 12.1124 12.1124 13.2164 13.2164 13.2798 13.2798 13.5071 13.5071 13.5230 13.5230 k = 0.0800 0.1386-0.0000 ( 5119 PWs) bands (ev): -0.2307 -0.2307 0.5626 0.5626 5.3454 5.3454 6.8229 6.8229 7.0906 7.0906 7.3103 7.3103 7.4809 7.4809 8.0151 8.0151 8.2322 8.2322 8.6871 8.6871 8.7016 8.7016 8.7445 8.7445 8.8347 8.8347 8.8942 8.8942 9.0329 9.0329 9.0939 9.0939 9.6028 9.6028 9.6943 9.6943 9.9767 9.9767 10.0139 10.0139 10.1251 10.1251 10.3832 10.3832 10.4747 10.4747 10.5409 10.5409 10.6132 10.6132 10.8655 10.8655 11.6300 11.6300 11.7469 11.7469 11.9413 11.9413 12.0229 12.0229 12.1250 12.1250 13.2382 13.2382 13.3045 13.3045 13.5012 13.5012 13.5201 13.5201 k = 0.0733 0.1270-0.0000 ( 5123 PWs) bands (ev): -0.2607 -0.2607 0.5433 0.5433 5.3108 5.3108 6.9016 6.9016 7.1182 7.1182 7.3197 7.3197 7.4771 7.4771 8.0208 8.0208 8.2360 8.2360 8.6785 8.6785 8.6890 8.6890 8.7347 8.7347 8.8284 8.8284 8.8854 8.8854 9.0142 9.0142 9.0837 9.0837 9.6037 9.6037 9.6970 9.6970 9.9776 9.9776 10.0212 10.0212 10.1052 10.1052 10.3997 10.3997 10.4810 10.4810 10.5584 10.5584 10.6994 10.6994 10.9212 10.9212 11.7210 11.7210 11.8129 11.8129 11.9433 11.9433 11.9902 11.9902 12.1434 12.1434 13.2595 13.2595 13.3270 13.3270 13.4830 13.4830 13.4964 13.4964 k = 0.0667 0.1155-0.0000 ( 5121 PWs) bands (ev): -0.2883 -0.2883 0.5255 0.5255 5.2789 5.2789 6.9761 6.9761 7.1424 7.1424 7.3276 7.3276 7.4739 7.4739 8.0290 8.0290 8.2395 8.2395 8.6699 8.6699 8.6773 8.6773 8.7257 8.7257 8.8157 8.8157 8.8822 8.8822 8.9977 8.9977 9.0745 9.0745 9.6043 9.6043 9.6993 9.6993 9.9746 9.9746 10.0280 10.0280 10.0875 10.0875 10.4141 10.4141 10.4866 10.4866 10.5698 10.5698 10.7914 10.7914 10.9796 10.9796 11.8149 11.8149 11.8671 11.8671 11.9478 11.9478 11.9614 11.9614 12.1650 12.1650 13.2800 13.2800 13.3463 13.3463 13.3843 13.3843 13.4938 13.4938 k = 0.0600 0.1039-0.0000 ( 5125 PWs) bands (ev): -0.3134 -0.3134 0.5094 0.5094 5.2498 5.2498 7.0456 7.0456 7.1633 7.1633 7.3342 7.3342 7.4718 7.4718 8.0391 8.0391 8.2425 8.2425 8.6615 8.6615 8.6666 8.6666 8.7173 8.7173 8.7995 8.7995 8.8805 8.8805 8.9849 8.9849 9.0663 9.0663 9.6047 9.6047 9.7013 9.7013 9.9670 9.9670 10.0344 10.0344 10.0736 10.0736 10.4266 10.4266 10.4918 10.4918 10.5791 10.5791 10.8838 10.8838 11.0402 11.0402 11.8896 11.8896 11.9040 11.9040 11.9296 11.9296 11.9865 11.9865 12.1918 12.1918 13.2774 13.2774 13.3029 13.3029 13.3642 13.3642 13.4946 13.4946 k = 0.0533 0.0924-0.0000 ( 5131 PWs) bands (ev): -0.3361 -0.3361 0.4949 0.4949 5.2236 5.2236 7.1091 7.1091 7.1809 7.1809 7.3399 7.3399 7.4712 7.4712 8.0506 8.0506 8.2452 8.2452 8.6533 8.6533 8.6568 8.6568 8.7096 8.7096 8.7823 8.7823 8.8769 8.8769 8.9773 8.9773 9.0592 9.0592 9.6050 9.6050 9.7030 9.7030 9.9548 9.9548 10.0402 10.0402 10.0640 10.0640 10.4374 10.4374 10.4966 10.4966 10.5868 10.5868 10.9750 10.9750 11.1023 11.1023 11.8846 11.8846 11.8930 11.8930 11.9935 11.9935 12.0467 12.0467 12.2272 12.2272 13.1793 13.1793 13.3188 13.3188 13.3771 13.3771 13.4999 13.4999 k = 0.0467 0.0808-0.0000 ( 5131 PWs) bands (ev): -0.3561 -0.3561 0.4820 0.4820 5.2003 5.2003 7.1653 7.1653 7.1956 7.1956 7.3448 7.3448 7.4727 7.4727 8.0630 8.0630 8.2475 8.2475 8.6454 8.6454 8.6481 8.6481 8.7025 8.7025 8.7656 8.7656 8.8699 8.8699 8.9752 8.9752 9.0534 9.0534 9.6052 9.6052 9.7043 9.7043 9.9394 9.9394 10.0453 10.0453 10.0581 10.0581 10.4466 10.4466 10.5011 10.5011 10.5933 10.5933 11.0639 11.0639 11.1653 11.1653 11.8602 11.8602 11.8744 11.8744 12.0424 12.0424 12.1335 12.1335 12.2735 12.2735 13.0830 13.0830 13.3336 13.3336 13.3870 13.3870 13.5106 13.5106 k = 0.0400 0.0693-0.0000 ( 5131 PWs) bands (ev): -0.3735 -0.3735 0.4708 0.4708 5.1799 5.1799 7.2055 7.2055 7.2151 7.2151 7.3493 7.3493 7.4766 7.4766 8.0756 8.0756 8.2495 8.2495 8.6381 8.6381 8.6401 8.6401 8.6959 8.6959 8.7502 8.7502 8.8603 8.8603 8.9771 8.9771 9.0489 9.0489 9.6051 9.6051 9.7053 9.7053 9.9224 9.9224 10.0497 10.0497 10.0550 10.0550 10.4544 10.4544 10.5054 10.5054 10.5987 10.5987 11.1497 11.1497 11.2284 11.2284 11.8318 11.8318 11.8543 11.8543 12.0713 12.0713 12.2283 12.2283 12.3297 12.3297 12.9921 12.9921 13.3440 13.3440 13.3949 13.3949 13.5217 13.5217 k = 0.0333 0.0577-0.0000 ( 5127 PWs) bands (ev): -0.3883 -0.3883 0.4612 0.4612 5.1627 5.1627 7.2155 7.2155 7.2531 7.2531 7.3532 7.3532 7.4833 7.4833 8.0880 8.0880 8.2511 8.2511 8.6316 8.6316 8.6329 8.6329 8.6897 8.6897 8.7368 8.7368 8.8496 8.8496 8.9810 8.9810 9.0460 9.0460 9.6050 9.6050 9.7061 9.7061 9.9056 9.9056 10.0524 10.0524 10.0544 10.0544 10.4608 10.4608 10.5092 10.5092 10.6030 10.6030 11.2314 11.2314 11.2905 11.2905 11.8037 11.8037 11.8300 11.8300 12.0899 12.0899 12.3201 12.3201 12.3913 12.3913 12.9085 12.9085 13.3478 13.3478 13.4023 13.4023 13.5080 13.5080 k = 0.0267 0.0462-0.0000 ( 5123 PWs) bands (ev): -0.4005 -0.4005 0.4534 0.4534 5.1485 5.1485 7.2222 7.2222 7.2825 7.2825 7.3566 7.3566 7.4923 7.4923 8.0993 8.0993 8.2524 8.2524 8.6259 8.6259 8.6266 8.6266 8.6840 8.6840 8.7260 8.7260 8.8394 8.8394 8.9851 8.9851 9.0448 9.0448 9.6048 9.6048 9.7066 9.7066 9.8902 9.8902 10.0521 10.0521 10.0570 10.0570 10.4657 10.4657 10.5126 10.5126 10.6063 10.6063 11.3079 11.3079 11.3504 11.3504 11.7757 11.7757 11.8019 11.8019 12.1023 12.1023 12.4043 12.4043 12.4531 12.4531 12.8347 12.8347 13.3437 13.3437 13.4095 13.4095 13.4865 13.4865 k = 0.0200 0.0346-0.0000 ( 5119 PWs) bands (ev): -0.4100 -0.4100 0.4473 0.4473 5.1374 5.1374 7.2270 7.2270 7.3031 7.3031 7.3594 7.3594 7.5025 7.5025 8.1090 8.1090 8.2534 8.2534 8.6207 8.6207 8.6219 8.6219 8.6790 8.6790 8.7178 8.7178 8.8306 8.8306 8.9885 8.9885 9.0449 9.0449 9.6045 9.6045 9.7069 9.7069 9.8772 9.8772 10.0519 10.0519 10.0593 10.0593 10.4695 10.4695 10.5155 10.5155 10.6088 10.6088 11.3778 11.3778 11.4060 11.4060 11.7479 11.7479 11.7707 11.7707 12.1109 12.1109 12.4768 12.4768 12.5096 12.5096 12.7729 12.7729 13.3312 13.3312 13.4159 13.4159 13.4635 13.4635 k = 0.0133 0.0231-0.0000 ( 5115 PWs) bands (ev): -0.4167 -0.4167 0.4430 0.4430 5.1295 5.1295 7.2302 7.2302 7.3162 7.3162 7.3615 7.3615 7.5118 7.5118 8.1164 8.1164 8.2541 8.2541 8.6164 8.6164 8.6186 8.6186 8.6749 8.6749 8.7122 8.7122 8.8240 8.8240 8.9908 8.9908 9.0459 9.0459 9.6042 9.6042 9.7070 9.7070 9.8675 9.8675 10.0518 10.0518 10.0610 10.0610 10.4721 10.4721 10.5176 10.5176 10.6105 10.6105 11.4385 11.4385 11.4543 11.4543 11.7209 11.7209 11.7390 11.7390 12.1166 12.1166 12.5339 12.5339 12.5553 12.5553 12.7261 12.7261 13.3126 13.3126 13.4206 13.4206 13.4458 13.4458 k = 0.0067 0.0115-0.0000 ( 5109 PWs) bands (ev): -0.4208 -0.4208 0.4404 0.4404 5.1247 5.1247 7.2320 7.2320 7.3234 7.3234 7.3629 7.3629 7.5183 7.5183 8.1211 8.1211 8.2545 8.2545 8.6137 8.6137 8.6167 8.6167 8.6723 8.6723 8.7090 8.7090 8.8198 8.8198 8.9920 8.9920 9.0469 9.0469 9.6040 9.6040 9.7071 9.7071 9.8614 9.8614 10.0518 10.0518 10.0620 10.0620 10.4736 10.4736 10.5189 10.5189 10.6115 10.6115 11.4840 11.4840 11.4899 11.4899 11.6974 11.6974 11.7127 11.7127 12.1200 12.1200 12.5711 12.5711 12.5851 12.5851 12.6967 12.6967 13.2953 13.2953 13.4234 13.4234 13.4360 13.4360 k = 0.0000 0.0000 0.0000 ( 5117 PWs) bands (ev): -0.4222 -0.4222 0.4395 0.4395 5.1231 5.1231 7.2325 7.2325 7.3256 7.3256 7.3633 7.3633 7.5207 7.5207 8.1227 8.1227 8.2547 8.2547 8.6128 8.6128 8.6160 8.6160 8.6714 8.6714 8.7079 8.7079 8.8184 8.8184 8.9924 8.9924 9.0472 9.0472 9.6039 9.6039 9.7070 9.7070 9.8593 9.8593 10.0518 10.0518 10.0624 10.0624 10.4741 10.4741 10.5194 10.5194 10.6118 10.6118 11.5015 11.5015 11.5046 11.5046 11.6866 11.6866 11.7020 11.7020 12.1212 12.1212 12.5841 12.5841 12.5954 12.5954 12.6866 12.6866 13.2882 13.2882 13.4243 13.4243 13.4330 13.4330 k = 0.0000 0.0000 0.0000 ( 5117 PWs) bands (ev): -0.4222 -0.4222 0.4395 0.4395 5.1231 5.1231 7.2325 7.2325 7.3256 7.3256 7.3633 7.3633 7.5207 7.5207 8.1227 8.1227 8.2547 8.2547 8.6128 8.6128 8.6160 8.6160 8.6714 8.6714 8.7079 8.7079 8.8184 8.8184 8.9924 8.9924 9.0472 9.0472 9.6039 9.6039 9.7070 9.7070 9.8593 9.8593 10.0518 10.0518 10.0624 10.0624 10.4741 10.4741 10.5194 10.5194 10.6118 10.6118 11.5015 11.5015 11.5046 11.5046 11.6866 11.6866 11.7020 11.7020 12.1212 12.1212 12.5841 12.5841 12.5954 12.5954 12.6866 12.6866 13.2882 13.2882 13.4243 13.4243 13.4330 13.4330 k = 0.0000 0.0000 0.0134 ( 5117 PWs) bands (ev): -0.4210 -0.4210 0.4375 0.4375 5.1274 5.1274 7.2327 7.2327 7.3252 7.3252 7.3635 7.3635 7.5203 7.5203 8.1149 8.1149 8.2558 8.2558 8.6126 8.6126 8.6159 8.6159 8.6708 8.6708 8.7070 8.7070 8.8182 8.8182 8.9952 8.9952 9.0490 9.0490 9.6035 9.6035 9.7064 9.7064 9.8583 9.8583 10.0519 10.0519 10.0626 10.0626 10.4720 10.4720 10.5176 10.5176 10.6099 10.6099 11.5022 11.5022 11.5057 11.5057 11.6872 11.6872 11.7018 11.7018 12.1260 12.1260 12.5855 12.5855 12.5965 12.5965 12.6912 12.6912 13.2913 13.2913 13.4182 13.4182 13.4359 13.4359 k = 0.0000 0.0000 0.0267 ( 5111 PWs) bands (ev): -0.4175 -0.4175 0.4317 0.4317 5.1403 5.1403 7.2333 7.2333 7.3238 7.3238 7.3642 7.3642 7.5194 7.5194 8.0921 8.0921 8.2591 8.2591 8.6122 8.6122 8.6156 8.6156 8.6691 8.6691 8.7041 8.7041 8.8178 8.8178 9.0035 9.0035 9.0543 9.0543 9.6021 9.6021 9.7046 9.7046 9.8555 9.8555 10.0524 10.0524 10.0633 10.0633 10.4656 10.4656 10.5124 10.5124 10.6044 10.6044 11.5044 11.5044 11.5088 11.5088 11.6889 11.6889 11.7010 11.7010 12.1403 12.1403 12.5896 12.5896 12.5999 12.5999 12.7050 12.7050 13.3005 13.3005 13.4005 13.4005 13.4446 13.4446 k = 0.0000 0.0000 0.0401 ( 5117 PWs) bands (ev): -0.4118 -0.4118 0.4220 0.4220 5.1617 5.1617 7.2343 7.2343 7.3214 7.3214 7.3653 7.3653 7.5178 7.5178 8.0549 8.0549 8.2647 8.2647 8.6115 8.6115 8.6152 8.6152 8.6663 8.6663 8.6994 8.6994 8.8172 8.8172 9.0164 9.0164 9.0629 9.0629 9.5997 9.5997 9.7014 9.7014 9.8513 9.8513 10.0531 10.0531 10.0645 10.0645 10.4552 10.4552 10.5038 10.5038 10.5951 10.5951 11.5079 11.5079 11.5139 11.5139 11.6912 11.6912 11.6997 11.6997 12.1628 12.1628 12.5964 12.5964 12.6055 12.6055 12.7287 12.7287 13.3157 13.3157 13.3730 13.3730 13.4585 13.4585 k = 0.0000 0.0000 0.0534 ( 5123 PWs) bands (ev): -0.4037 -0.4037 0.4087 0.4087 5.1914 5.1914 7.2357 7.2357 7.3180 7.3180 7.3668 7.3668 7.5156 7.5156 8.0048 8.0048 8.2724 8.2724 8.6106 8.6106 8.6146 8.6146 8.6627 8.6627 8.6930 8.6930 8.8164 8.8164 9.0334 9.0334 9.0746 9.0746 9.5963 9.5963 9.6969 9.6969 9.8465 9.8465 10.0543 10.0543 10.0662 10.0662 10.4412 10.4412 10.4921 10.4921 10.5822 10.5822 11.5127 11.5127 11.5207 11.5207 11.6938 11.6938 11.6980 11.6980 12.1919 12.1919 12.6060 12.6060 12.6133 12.6133 12.7631 12.7631 13.3333 13.3333 13.3409 13.3409 13.4770 13.4770 k = 0.0000 0.0000 0.0668 ( 5117 PWs) bands (ev): -0.3934 -0.3934 0.3919 0.3919 5.2291 5.2291 7.2375 7.2375 7.3133 7.3133 7.3688 7.3688 7.5128 7.5128 7.9434 7.9434 8.2822 8.2822 8.6094 8.6094 8.6139 8.6139 8.6585 8.6585 8.6853 8.6853 8.8149 8.8149 9.0534 9.0534 9.0891 9.0891 9.5920 9.5920 9.6911 9.6911 9.8418 9.8418 10.0560 10.0560 10.0685 10.0685 10.4239 10.4239 10.4777 10.4777 10.5659 10.5659 11.5185 11.5185 11.5289 11.5289 11.6958 11.6958 11.6961 11.6961 12.2253 12.2253 12.6183 12.6183 12.6231 12.6231 12.8092 12.8092 13.2959 13.2959 13.3633 13.3633 13.4984 13.4984 k = 0.0000 0.0000 0.0801 ( 5117 PWs) bands (ev): -0.3809 -0.3809 0.3718 0.3718 5.2748 5.2748 7.2396 7.2396 7.3071 7.3071 7.3711 7.3711 7.5094 7.5094 7.8723 7.8723 8.2941 8.2941 8.6081 8.6081 8.6131 8.6131 8.6540 8.6540 8.6768 8.6768 8.8123 8.8123 9.0760 9.0760 9.1060 9.1060 9.5866 9.5866 9.6839 9.6839 9.8382 9.8382 10.0584 10.0584 10.0713 10.0713 10.4039 10.4039 10.4609 10.4609 10.5462 10.5462 11.5252 11.5252 11.5382 11.5382 11.6931 11.6931 11.6979 11.6979 12.2610 12.2610 12.6332 12.6332 12.6350 12.6350 12.8675 12.8675 13.2511 13.2511 13.3928 13.3928 13.5193 13.5193 k = 0.0000 0.0000 0.0935 ( 5111 PWs) bands (ev): -0.3662 -0.3662 0.3488 0.3488 5.3279 5.3279 7.2422 7.2422 7.2987 7.2987 7.3740 7.3740 7.5055 7.5055 7.7936 7.7936 8.3079 8.3079 8.6067 8.6067 8.6122 8.6122 8.6492 8.6492 8.6680 8.6680 8.8079 8.8079 9.1006 9.1006 9.1250 9.1250 9.5802 9.5802 9.6754 9.6754 9.8364 9.8364 10.0614 10.0614 10.0748 10.0748 10.3816 10.3816 10.4420 10.4420 10.5235 10.5235 11.5325 11.5325 11.5484 11.5484 11.6901 11.6901 11.6991 11.6991 12.2970 12.2970 12.6490 12.6490 12.6508 12.6508 12.9379 12.9379 13.2039 13.2039 13.4201 13.4201 13.5264 13.5264 k = 0.0000 0.0000 0.1068 ( 5111 PWs) bands (ev): -0.3493 -0.3493 0.3231 0.3231 5.3882 5.3882 7.2451 7.2451 7.2872 7.2872 7.3772 7.3772 7.5011 7.5011 7.7096 7.7096 8.3238 8.3238 8.6053 8.6053 8.6112 8.6112 8.6445 8.6445 8.6592 8.6592 8.8014 8.8014 9.1269 9.1269 9.1456 9.1456 9.5726 9.5726 9.6653 9.6653 9.8370 9.8370 10.0651 10.0651 10.0789 10.0789 10.3575 10.3575 10.4215 10.4215 10.4981 10.4981 11.5403 11.5403 11.5591 11.5591 11.6866 11.6866 11.6996 11.6996 12.3322 12.3322 12.6651 12.6651 12.6710 12.6710 13.0195 13.0195 13.1558 13.1558 13.4261 13.4261 13.5276 13.5276 k = 0.0000 0.0000 0.1202 ( 5111 PWs) bands (ev): -0.3304 -0.3304 0.2950 0.2950 5.4553 5.4553 7.2484 7.2484 7.2705 7.2705 7.3808 7.3808 7.4963 7.4963 7.6238 7.6238 8.3414 8.3414 8.6038 8.6038 8.6101 8.6101 8.6398 8.6398 8.6508 8.6508 8.7924 8.7924 9.1545 9.1545 9.1677 9.1677 9.5639 9.5639 9.6538 9.6538 9.8407 9.8407 10.0697 10.0697 10.0838 10.0838 10.3320 10.3320 10.3998 10.3998 10.4703 10.4703 11.5485 11.5485 11.5701 11.5701 11.6827 11.6827 11.6993 11.6993 12.3662 12.3662 12.6833 12.6833 12.6938 12.6938 13.1075 13.1075 13.1109 13.1109 13.4020 13.4020 13.5122 13.5122 k = 0.0000 0.0000 0.1335 ( 5099 PWs) bands (ev): -0.3095 -0.3095 0.2649 0.2649 5.5287 5.5287 7.2447 7.2447 7.2521 7.2521 7.3848 7.3848 7.4911 7.4911 7.5413 7.5413 8.3607 8.3607 8.6026 8.6026 8.6090 8.6090 8.6352 8.6352 8.6429 8.6429 8.7810 8.7810 9.1831 9.1831 9.1909 9.1909 9.5540 9.5540 9.6407 9.6407 9.8476 9.8476 10.0752 10.0752 10.0896 10.0896 10.3056 10.3056 10.3773 10.3773 10.4406 10.4406 11.5568 11.5568 11.5811 11.5811 11.6786 11.6786 11.6984 11.6984 12.3990 12.3990 12.7036 12.7036 12.7191 12.7191 13.0596 13.0596 13.2099 13.2099 13.3651 13.3651 13.4785 13.4785 k = 0.0000 0.0000 0.1469 ( 5081 PWs) bands (ev): -0.2866 -0.2866 0.2331 0.2331 5.6082 5.6082 7.2034 7.2034 7.2561 7.2561 7.3891 7.3891 7.4696 7.4696 7.4855 7.4855 8.3815 8.3815 8.6015 8.6015 8.6080 8.6080 8.6309 8.6309 8.6357 8.6357 8.7670 8.7670 9.2126 9.2126 9.2148 9.2148 9.5428 9.5428 9.6260 9.6260 9.8579 9.8579 10.0816 10.0816 10.0962 10.0962 10.2784 10.2784 10.3544 10.3544 10.4095 10.4095 11.5652 11.5652 11.5920 11.5920 11.6740 11.6740 11.6968 11.6968 12.4307 12.4307 12.7261 12.7261 12.7469 12.7469 13.0127 13.0127 13.3145 13.3145 13.3237 13.3237 13.4368 13.4368 k = 0.0000 0.0000 0.1602 ( 5081 PWs) bands (ev): -0.2619 -0.2619 0.1999 0.1999 5.6932 5.6932 7.1401 7.1401 7.2605 7.2605 7.3938 7.3938 7.4161 7.4161 7.4796 7.4796 8.4038 8.4038 8.6006 8.6006 8.6070 8.6070 8.6267 8.6267 8.6292 8.6292 8.7505 8.7505 9.2394 9.2394 9.2427 9.2427 9.5304 9.5304 9.6096 9.6096 9.8716 9.8716 10.0891 10.0891 10.1037 10.1037 10.2506 10.2506 10.3313 10.3313 10.3776 10.3776 11.5736 11.5736 11.6026 11.6026 11.6692 11.6692 11.6945 11.6945 12.4618 12.4618 12.7507 12.7507 12.7771 12.7771 12.9669 12.9669 13.2802 13.2802 13.3908 13.3908 13.4224 13.4224 k = 0.0000 0.0000 0.1736 ( 5081 PWs) bands (ev): -0.2355 -0.2355 0.1656 0.1656 5.7833 5.7833 7.0559 7.0559 7.2653 7.2653 7.3808 7.3808 7.3989 7.3989 7.4735 7.4735 8.4273 8.4273 8.6001 8.6001 8.6062 8.6062 8.6228 8.6228 8.6234 8.6234 8.7318 8.7318 9.2642 9.2642 9.2730 9.2730 9.5167 9.5167 9.5916 9.5916 9.8886 9.8886 10.0977 10.0977 10.1122 10.1122 10.2224 10.2224 10.3085 10.3085 10.3455 10.3455 11.5819 11.5819 11.6128 11.6128 11.6640 11.6640 11.6917 11.6917 12.4926 12.4926 12.7773 12.7773 12.8097 12.8097 12.9226 12.9226 13.2359 13.2359 13.3424 13.3424 13.5312 13.5312 k = 0.0000 0.0000 0.1869 ( 5082 PWs) bands (ev): -0.2074 -0.2074 0.1305 0.1305 5.8780 5.8780 6.9577 6.9577 7.2704 7.2704 7.3577 7.3577 7.4042 7.4042 7.4672 7.4672 8.4519 8.4519 8.6000 8.6000 8.6055 8.6055 8.6184 8.6184 8.6192 8.6192 8.7110 8.7110 9.2891 9.2891 9.3035 9.3035 9.5017 9.5017 9.5719 9.5719 9.9087 9.9087 10.1077 10.1077 10.1218 10.1218 10.1937 10.1937 10.2861 10.2861 10.3138 10.3138 11.5900 11.5900 11.6225 11.6225 11.6586 11.6586 11.6883 11.6883 12.5235 12.5235 12.8061 12.8061 12.8446 12.8446 12.8797 12.8797 13.1914 13.1914 13.2928 13.2928 13.6389 13.6389 k = 0.0000 0.0000 0.2003 ( 5094 PWs) bands (ev): -0.1778 -0.1778 0.0949 0.0949 5.9769 5.9769 6.8515 6.8515 7.2759 7.2759 7.3415 7.3415 7.4098 7.4098 7.4607 7.4607 8.4773 8.4773 8.6002 8.6002 8.6050 8.6050 8.6141 8.6141 8.6158 8.6158 8.6886 8.6886 9.3138 9.3138 9.3339 9.3339 9.4853 9.4853 9.5505 9.5505 9.9316 9.9316 10.1190 10.1190 10.1325 10.1325 10.1644 10.1644 10.2644 10.2644 10.2834 10.2834 11.5979 11.5979 11.6317 11.6317 11.6529 11.6529 11.6843 11.6843 12.5547 12.5547 12.8369 12.8369 12.8383 12.8383 12.8817 12.8817 13.1471 13.1471 13.2430 13.2430 13.7431 13.7431 k = 0.0000 0.0000 0.2136 ( 5136 PWs) bands (ev): -0.1468 -0.1468 0.0591 0.0591 6.0795 6.0795 6.7412 6.7412 7.2817 7.2817 7.3290 7.3290 7.4157 7.4157 7.4541 7.4541 8.5034 8.5034 8.6007 8.6007 8.6048 8.6048 8.6102 8.6102 8.6126 8.6126 8.6646 8.6646 9.3381 9.3381 9.3640 9.3640 9.4676 9.4676 9.5276 9.5276 9.9569 9.9569 10.1319 10.1319 10.1346 10.1346 10.1445 10.1445 10.2437 10.2437 10.2546 10.2546 11.6056 11.6056 11.6403 11.6403 11.6468 11.6468 11.6797 11.6797 12.5865 12.5865 12.7984 12.7984 12.8697 12.8697 12.9209 12.9209 13.1035 13.1035 13.1934 13.1934 13.8416 13.8416 k = 0.0000 0.0000 0.2270 ( 5124 PWs) bands (ev): -0.1146 -0.1146 0.0234 0.0234 6.1854 6.1854 6.6290 6.6290 7.2880 7.2880 7.3188 7.3188 7.4218 7.4218 7.4476 7.4476 8.5300 8.5300 8.6018 8.6018 8.6051 8.6051 8.6066 8.6066 8.6097 8.6097 8.6403 8.6403 9.3620 9.3620 9.3936 9.3936 9.4487 9.4487 9.5033 9.5033 9.9843 9.9843 10.1043 10.1043 10.1467 10.1467 10.1578 10.1578 10.2240 10.2240 10.2281 10.2281 11.6131 11.6131 11.6406 11.6406 11.6483 11.6483 11.6746 11.6746 12.6191 12.6191 12.7600 12.7600 12.9045 12.9045 12.9622 12.9622 13.0609 13.0609 13.1446 13.1446 13.9318 13.9318 k = 0.0000 0.0000 0.2403 ( 5112 PWs) bands (ev): -0.0812 -0.0812 -0.0121 -0.0121 6.2939 6.2939 6.5164 6.5164 7.2947 7.2947 7.3099 7.3099 7.4281 7.4281 7.4410 7.4410 8.5564 8.5564 8.6004 8.6004 8.6033 8.6033 8.6062 8.6062 8.6073 8.6073 8.6183 8.6183 9.3851 9.3851 9.4226 9.4226 9.4286 9.4286 9.4776 9.4776 10.0132 10.0132 10.0738 10.0738 10.1636 10.1636 10.1725 10.1725 10.2041 10.2041 10.2056 10.2056 11.6204 11.6204 11.6341 11.6341 11.6558 11.6558 11.6689 11.6689 12.6526 12.6526 12.7229 12.7229 12.9411 12.9411 13.0054 13.0054 13.0195 13.0195 13.0968 13.0968 14.0097 14.0097 k = 0.0000 0.0000 0.2537 ( 5100 PWs) bands (ev): -0.0470 -0.0470 -0.0470 -0.0470 6.4044 6.4044 6.4044 6.4044 7.3020 7.3020 7.3020 7.3020 7.4345 7.4345 7.4345 7.4345 8.5819 8.5819 8.5819 8.5819 8.6051 8.6051 8.6051 8.6051 8.6087 8.6087 8.6087 8.6087 9.4074 9.4074 9.4074 9.4074 9.4506 9.4506 9.4506 9.4506 10.0432 10.0432 10.0432 10.0432 10.1827 10.1827 10.1827 10.1827 10.1884 10.1884 10.1884 10.1884 11.6274 11.6274 11.6274 11.6274 11.6626 11.6626 11.6626 11.6626 12.6871 12.6871 12.6871 12.6871 12.9795 12.9795 12.9795 12.9795 13.0503 13.0503 13.0503 13.0503 14.0678 14.0678 k = 0.0000 0.0000 0.2537 ( 5100 PWs) bands (ev): -0.0470 -0.0470 -0.0470 -0.0470 6.4044 6.4044 6.4044 6.4044 7.3020 7.3020 7.3020 7.3020 7.4345 7.4345 7.4345 7.4345 8.5819 8.5819 8.5819 8.5819 8.6051 8.6051 8.6051 8.6051 8.6087 8.6087 8.6087 8.6087 9.4074 9.4074 9.4074 9.4074 9.4506 9.4506 9.4506 9.4506 10.0432 10.0432 10.0432 10.0432 10.1827 10.1827 10.1827 10.1827 10.1884 10.1884 10.1884 10.1884 11.6274 11.6274 11.6274 11.6274 11.6626 11.6626 11.6626 11.6626 12.6871 12.6871 12.6871 12.6871 12.9795 12.9795 12.9795 12.9795 13.0503 13.0503 13.0503 13.0503 14.0678 14.0678 k = 0.0114 0.0066 0.2537 ( 5116 PWs) bands (ev): -0.0459 -0.0459 -0.0459 -0.0459 6.4047 6.4047 6.4047 6.4047 7.3011 7.3011 7.3011 7.3011 7.4338 7.4338 7.4338 7.4338 8.5817 8.5817 8.5817 8.5817 8.6056 8.6056 8.6056 8.6056 8.6094 8.6094 8.6094 8.6094 9.4073 9.4073 9.4073 9.4073 9.4505 9.4505 9.4505 9.4505 10.0429 10.0429 10.0429 10.0429 10.1815 10.1815 10.1815 10.1815 10.1888 10.1888 10.1888 10.1888 11.6235 11.6235 11.6235 11.6235 11.6594 11.6594 11.6594 11.6594 12.6792 12.6792 12.6792 12.6792 12.9812 12.9812 12.9812 12.9812 13.0508 13.0508 13.0508 13.0508 14.0729 14.0729 k = 0.0227 0.0131 0.2537 ( 5118 PWs) bands (ev): -0.0424 -0.0424 -0.0424 -0.0424 6.4054 6.4054 6.4054 6.4054 7.2984 7.2984 7.2984 7.2984 7.4320 7.4320 7.4320 7.4320 8.5812 8.5812 8.5812 8.5812 8.6070 8.6070 8.6070 8.6070 8.6116 8.6116 8.6116 8.6116 9.4072 9.4072 9.4072 9.4072 9.4503 9.4503 9.4503 9.4503 10.0422 10.0422 10.0422 10.0422 10.1788 10.1788 10.1788 10.1788 10.1896 10.1896 10.1896 10.1896 11.6111 11.6111 11.6111 11.6111 11.6506 11.6506 11.6506 11.6506 12.6574 12.6574 12.6574 12.6574 12.9840 12.9840 12.9840 12.9840 13.0524 13.0524 13.0524 13.0524 14.0887 14.0887 k = 0.0341 0.0197 0.2537 ( 5114 PWs) bands (ev): -0.0367 -0.0367 -0.0367 -0.0367 6.4066 6.4066 6.4066 6.4066 7.2937 7.2937 7.2937 7.2937 7.4292 7.4292 7.4292 7.4292 8.5804 8.5804 8.5804 8.5804 8.6094 8.6094 8.6094 8.6094 8.6153 8.6153 8.6153 8.6153 9.4069 9.4069 9.4069 9.4069 9.4501 9.4501 9.4501 9.4501 10.0410 10.0410 10.0410 10.0410 10.1751 10.1751 10.1751 10.1751 10.1901 10.1901 10.1901 10.1901 11.5891 11.5891 11.5891 11.5891 11.6381 11.6381 11.6381 11.6381 12.6258 12.6258 12.6258 12.6258 12.9839 12.9839 12.9839 12.9839 13.0549 13.0549 13.0549 13.0549 14.1160 14.1160 k = 0.0455 0.0262 0.2537 ( 5114 PWs) bands (ev): -0.0288 -0.0288 -0.0288 -0.0288 6.4081 6.4081 6.4081 6.4081 7.2865 7.2865 7.2865 7.2865 7.4259 7.4259 7.4259 7.4259 8.5794 8.5794 8.5794 8.5794 8.6129 8.6129 8.6129 8.6129 8.6204 8.6204 8.6204 8.6204 9.4064 9.4064 9.4064 9.4064 9.4498 9.4498 9.4498 9.4498 10.0391 10.0391 10.0391 10.0391 10.1706 10.1706 10.1706 10.1706 10.1903 10.1903 10.1903 10.1903 11.5573 11.5573 11.5573 11.5573 11.6227 11.6227 11.6227 11.6227 12.5882 12.5882 12.5882 12.5882 12.9794 12.9794 12.9794 12.9794 13.0566 13.0566 13.0566 13.0566 14.1553 14.1553 k = 0.0568 0.0328 0.2537 ( 5118 PWs) bands (ev): -0.0185 -0.0185 -0.0185 -0.0185 6.4100 6.4100 6.4100 6.4100 7.2764 7.2764 7.2764 7.2764 7.4224 7.4224 7.4224 7.4224 8.5783 8.5783 8.5783 8.5783 8.6176 8.6176 8.6176 8.6176 8.6269 8.6269 8.6269 8.6269 9.4055 9.4055 9.4055 9.4055 9.4497 9.4497 9.4497 9.4497 10.0365 10.0365 10.0365 10.0365 10.1653 10.1653 10.1653 10.1653 10.1901 10.1901 10.1901 10.1901 11.5170 11.5170 11.5170 11.5170 11.6044 11.6044 11.6044 11.6044 12.5470 12.5470 12.5470 12.5470 12.9712 12.9712 12.9712 12.9712 13.0554 13.0554 13.0554 13.0554 14.2061 14.2061 k = 0.0682 0.0394 0.2537 ( 5122 PWs) bands (ev): -0.0061 -0.0061 -0.0061 -0.0061 6.4120 6.4120 6.4120 6.4120 7.2626 7.2626 7.2626 7.2626 7.4192 7.4192 7.4192 7.4192 8.5773 8.5773 8.5773 8.5773 8.6236 8.6236 8.6236 8.6236 8.6350 8.6350 8.6350 8.6350 9.4040 9.4040 9.4040 9.4040 9.4499 9.4499 9.4499 9.4499 10.0332 10.0332 10.0332 10.0332 10.1591 10.1591 10.1591 10.1591 10.1895 10.1895 10.1895 10.1895 11.4696 11.4696 11.4696 11.4696 11.5832 11.5832 11.5832 11.5832 12.5034 12.5034 12.5034 12.5034 12.9609 12.9609 12.9609 12.9609 13.0506 13.0506 13.0506 13.0506 14.2659 14.2659 k = 0.0795 0.0459 0.2537 ( 5122 PWs) bands (ev): 0.0086 0.0086 0.0086 0.0086 6.4141 6.4141 6.4141 6.4141 7.2451 7.2451 7.2451 7.2451 7.4168 7.4168 7.4168 7.4168 8.5764 8.5764 8.5764 8.5764 8.6309 8.6309 8.6309 8.6309 8.6445 8.6445 8.6445 8.6445 9.4019 9.4019 9.4019 9.4019 9.4506 9.4506 9.4506 9.4506 10.0289 10.0289 10.0289 10.0289 10.1523 10.1523 10.1523 10.1523 10.1886 10.1886 10.1886 10.1886 11.4167 11.4167 11.4167 11.4167 11.5588 11.5588 11.5588 11.5588 12.4577 12.4577 12.4577 12.4577 12.9496 12.9496 12.9496 12.9496 13.0427 13.0427 13.0427 13.0427 14.3308 14.3308 k = 0.0909 0.0525 0.2537 ( 5122 PWs) bands (ev): 0.0254 0.0254 0.0254 0.0254 6.4160 6.4160 6.4160 6.4160 7.2235 7.2235 7.2235 7.2235 7.4155 7.4155 7.4155 7.4155 8.5757 8.5757 8.5757 8.5757 8.6395 8.6395 8.6395 8.6395 8.6558 8.6558 8.6558 8.6558 9.3989 9.3989 9.3989 9.3989 9.4517 9.4517 9.4517 9.4517 10.0235 10.0235 10.0235 10.0235 10.1447 10.1447 10.1447 10.1447 10.1875 10.1875 10.1875 10.1875 11.3596 11.3596 11.3596 11.3596 11.5314 11.5314 11.5314 11.5314 12.4103 12.4103 12.4103 12.4103 12.9383 12.9383 12.9383 12.9383 13.0328 13.0328 13.0328 13.0328 14.3958 14.3958 k = 0.1023 0.0590 0.2537 ( 5134 PWs) bands (ev): 0.0444 0.0444 0.0444 0.0444 6.4174 6.4174 6.4174 6.4174 7.1980 7.1980 7.1980 7.1980 7.4153 7.4153 7.4153 7.4153 8.5751 8.5751 8.5751 8.5751 8.6493 8.6493 8.6493 8.6493 8.6688 8.6688 8.6688 8.6688 9.3950 9.3950 9.3950 9.3950 9.4535 9.4535 9.4535 9.4535 10.0170 10.0170 10.0170 10.0170 10.1363 10.1363 10.1363 10.1363 10.1862 10.1862 10.1862 10.1862 11.2997 11.2997 11.2997 11.2997 11.5011 11.5011 11.5011 11.5011 12.3610 12.3610 12.3610 12.3610 12.9277 12.9277 12.9277 12.9277 13.0226 13.0226 13.0226 13.0226 14.4556 14.4556 k = 0.1136 0.0656 0.2537 ( 5122 PWs) bands (ev): 0.0656 0.0656 0.0656 0.0656 6.4179 6.4179 6.4179 6.4179 7.1692 7.1692 7.1692 7.1692 7.4162 7.4162 7.4162 7.4162 8.5749 8.5749 8.5749 8.5749 8.6605 8.6605 8.6605 8.6605 8.6838 8.6838 8.6838 8.6838 9.3902 9.3902 9.3902 9.3902 9.4559 9.4559 9.4559 9.4559 10.0090 10.0090 10.0090 10.0090 10.1274 10.1274 10.1274 10.1274 10.1849 10.1849 10.1849 10.1849 11.2380 11.2380 11.2380 11.2380 11.4682 11.4682 11.4682 11.4682 12.3101 12.3101 12.3101 12.3101 12.9183 12.9183 12.9183 12.9183 13.0130 13.0130 13.0130 13.0130 14.5061 14.5061 k = 0.1250 0.0722 0.2537 ( 5124 PWs) bands (ev): 0.0887 0.0887 0.0887 0.0887 6.4169 6.4169 6.4169 6.4169 7.1375 7.1375 7.1375 7.1375 7.4181 7.4181 7.4181 7.4181 8.5747 8.5747 8.5747 8.5747 8.6727 8.6727 8.6727 8.6727 8.7009 8.7009 8.7009 8.7009 9.3846 9.3846 9.3846 9.3846 9.4589 9.4589 9.4589 9.4589 9.9996 9.9996 9.9996 9.9996 10.1177 10.1177 10.1177 10.1177 10.1835 10.1835 10.1835 10.1835 11.1755 11.1755 11.1755 11.1755 11.4328 11.4328 11.4328 11.4328 12.2576 12.2576 12.2576 12.2576 12.9106 12.9106 12.9106 12.9106 13.0052 13.0052 13.0052 13.0052 14.5453 14.5453 k = 0.1364 0.0787 0.2537 ( 5116 PWs) bands (ev): 0.1140 0.1140 0.1140 0.1140 6.4139 6.4139 6.4139 6.4139 7.1040 7.1040 7.1040 7.1040 7.4209 7.4209 7.4209 7.4209 8.5746 8.5746 8.5746 8.5746 8.6859 8.6859 8.6859 8.6859 8.7203 8.7203 8.7203 8.7203 9.3782 9.3782 9.3782 9.3782 9.4624 9.4624 9.4624 9.4624 9.9886 9.9886 9.9886 9.9886 10.1076 10.1076 10.1076 10.1076 10.1821 10.1821 10.1821 10.1821 11.1130 11.1130 11.1130 11.1130 11.3952 11.3952 11.3952 11.3952 12.2041 12.2041 12.2041 12.2041 12.9047 12.9047 12.9047 12.9047 12.9995 12.9995 12.9995 12.9995 14.5731 14.5731 k = 0.1477 0.0853 0.2537 ( 5108 PWs) bands (ev): 0.1411 0.1411 0.1411 0.1411 6.4079 6.4079 6.4079 6.4079 7.0698 7.0698 7.0698 7.0698 7.4245 7.4245 7.4245 7.4245 8.5744 8.5744 8.5744 8.5744 8.7001 8.7001 8.7001 8.7001 8.7421 8.7421 8.7421 8.7421 9.3711 9.3711 9.3711 9.3711 9.4664 9.4664 9.4664 9.4664 9.9759 9.9759 9.9759 9.9759 10.0969 10.0969 10.0969 10.0969 10.1807 10.1807 10.1807 10.1807 11.0511 11.0511 11.0511 11.0511 11.3558 11.3558 11.3558 11.3558 12.1499 12.1499 12.1499 12.1499 12.9010 12.9010 12.9010 12.9010 12.9962 12.9962 12.9962 12.9962 14.5902 14.5902 k = 0.1591 0.0919 0.2537 ( 5120 PWs) bands (ev): 0.1702 0.1702 0.1702 0.1702 6.3978 6.3978 6.3978 6.3978 7.0362 7.0362 7.0362 7.0362 7.4287 7.4287 7.4287 7.4287 8.5740 8.5740 8.5740 8.5740 8.7150 8.7150 8.7150 8.7150 8.7663 8.7663 8.7663 8.7663 9.3635 9.3635 9.3635 9.3635 9.4708 9.4708 9.4708 9.4708 9.9616 9.9616 9.9616 9.9616 10.0857 10.0857 10.0857 10.0857 10.1793 10.1793 10.1793 10.1793 10.9903 10.9903 10.9903 10.9903 11.3149 11.3149 11.3149 11.3149 12.0956 12.0956 12.0956 12.0956 12.8994 12.8994 12.8994 12.8994 12.9955 12.9955 12.9955 12.9955 14.5977 14.5977 k = 0.1705 0.0984 0.2537 ( 5120 PWs) bands (ev): 0.2011 0.2011 0.2011 0.2011 6.3825 6.3825 6.3825 6.3825 7.0048 7.0048 7.0048 7.0048 7.4336 7.4336 7.4336 7.4336 8.5732 8.5732 8.5732 8.5732 8.7306 8.7306 8.7306 8.7306 8.7929 8.7929 8.7929 8.7929 9.3554 9.3554 9.3554 9.3554 9.4755 9.4755 9.4755 9.4755 9.9456 9.9456 9.9456 9.9456 10.0743 10.0743 10.0743 10.0743 10.1779 10.1779 10.1779 10.1779 10.9311 10.9311 10.9311 10.9311 11.2728 11.2728 11.2728 11.2728 12.0415 12.0415 12.0415 12.0415 12.9001 12.9001 12.9001 12.9001 12.9973 12.9973 12.9973 12.9973 14.5965 14.5965 k = 0.1818 0.1050 0.2537 ( 5116 PWs) bands (ev): 0.2338 0.2338 0.2338 0.2338 6.3606 6.3606 6.3606 6.3606 6.9773 6.9773 6.9773 6.9773 7.4391 7.4391 7.4391 7.4391 8.5720 8.5720 8.5720 8.5720 8.7469 8.7469 8.7469 8.7469 8.8217 8.8217 8.8217 8.8217 9.3470 9.3470 9.3470 9.3470 9.4804 9.4804 9.4804 9.4804 9.9282 9.9282 9.9282 9.9282 10.0625 10.0625 10.0625 10.0625 10.1764 10.1764 10.1764 10.1764 10.8737 10.8737 10.8737 10.8737 11.2298 11.2298 11.2298 11.2298 11.9882 11.9882 11.9882 11.9882 12.9031 12.9031 12.9031 12.9031 13.0015 13.0015 13.0015 13.0015 14.5875 14.5875 k = 0.1932 0.1115 0.2537 ( 5116 PWs) bands (ev): 0.2682 0.2682 0.2682 0.2682 6.3313 6.3313 6.3313 6.3313 6.9549 6.9549 6.9549 6.9549 7.4450 7.4450 7.4450 7.4450 8.5700 8.5700 8.5700 8.5700 8.7637 8.7637 8.7637 8.7637 8.8526 8.8526 8.8526 8.8526 9.3385 9.3385 9.3385 9.3385 9.4856 9.4856 9.4856 9.4856 9.9094 9.9094 9.9094 9.9094 10.0505 10.0505 10.0505 10.0505 10.1748 10.1748 10.1748 10.1748 10.8184 10.8184 10.8184 10.8184 11.1862 11.1862 11.1862 11.1862 11.9360 11.9360 11.9360 11.9360 12.9085 12.9085 12.9085 12.9085 13.0079 13.0079 13.0079 13.0079 14.5715 14.5715 k = 0.2045 0.1181 0.2537 ( 5118 PWs) bands (ev): 0.3042 0.3042 0.3042 0.3042 6.2940 6.2940 6.2940 6.2940 6.9385 6.9385 6.9385 6.9385 7.4513 7.4513 7.4513 7.4513 8.5673 8.5673 8.5673 8.5673 8.7810 8.7810 8.7810 8.7810 8.8854 8.8854 8.8854 8.8854 9.3299 9.3299 9.3299 9.3299 9.4909 9.4909 9.4909 9.4909 9.8896 9.8896 9.8896 9.8896 10.0384 10.0384 10.0384 10.0384 10.1729 10.1729 10.1729 10.1729 10.7654 10.7654 10.7654 10.7654 11.1424 11.1424 11.1424 11.1424 11.8853 11.8853 11.8853 11.8853 12.9161 12.9161 12.9161 12.9161 13.0164 13.0164 13.0164 13.0164 14.5492 14.5492 k = 0.2159 0.1247 0.2537 ( 5112 PWs) bands (ev): 0.3417 0.3417 0.3417 0.3417 6.2486 6.2486 6.2486 6.2486 6.9285 6.9285 6.9285 6.9285 7.4581 7.4581 7.4581 7.4581 8.5637 8.5637 8.5637 8.5637 8.7987 8.7987 8.7987 8.7987 8.9199 8.9199 8.9199 8.9199 9.3216 9.3216 9.3216 9.3216 9.4962 9.4962 9.4962 9.4962 9.8688 9.8688 9.8688 9.8688 10.0262 10.0262 10.0262 10.0262 10.1707 10.1707 10.1707 10.1707 10.7148 10.7148 10.7148 10.7148 11.0986 11.0986 11.0986 11.0986 11.8364 11.8364 11.8364 11.8364 12.9261 12.9261 12.9261 12.9261 13.0267 13.0267 13.0267 13.0267 14.5213 14.5213 k = 0.2273 0.1312 0.2537 ( 5116 PWs) bands (ev): 0.3805 0.3805 0.3805 0.3805 6.1959 6.1959 6.1959 6.1959 6.9247 6.9247 6.9247 6.9247 7.4651 7.4651 7.4651 7.4651 8.5590 8.5590 8.5590 8.5590 8.8167 8.8167 8.8167 8.8167 8.9558 8.9558 8.9558 8.9558 9.3136 9.3136 9.3136 9.3136 9.5014 9.5014 9.5014 9.5014 9.8475 9.8475 9.8475 9.8475 10.0140 10.0140 10.0140 10.0140 10.1681 10.1681 10.1681 10.1681 10.6667 10.6667 10.6667 10.6667 11.0549 11.0549 11.0549 11.0549 11.7894 11.7894 11.7894 11.7894 12.9383 12.9383 12.9383 12.9383 13.0389 13.0389 13.0389 13.0389 14.4885 14.4885 k = 0.2386 0.1378 0.2537 ( 5122 PWs) bands (ev): 0.4206 0.4206 0.4206 0.4206 6.1367 6.1367 6.1367 6.1367 6.9265 6.9265 6.9265 6.9265 7.4724 7.4724 7.4724 7.4724 8.5533 8.5533 8.5533 8.5533 8.8350 8.8350 8.8350 8.8350 8.9927 8.9927 8.9927 8.9927 9.3062 9.3062 9.3062 9.3062 9.5064 9.5064 9.5064 9.5064 9.8259 9.8259 9.8259 9.8259 10.0020 10.0020 10.0020 10.0020 10.1647 10.1647 10.1647 10.1647 10.6213 10.6213 10.6213 10.6213 11.0117 11.0117 11.0117 11.0117 11.7445 11.7445 11.7445 11.7445 12.9528 12.9528 12.9528 12.9528 13.0527 13.0527 13.0527 13.0527 14.4515 14.4515 k = 0.2500 0.1443 0.2537 ( 5130 PWs) bands (ev): 0.4619 0.4619 0.4619 0.4619 6.0722 6.0722 6.0722 6.0722 6.9330 6.9330 6.9330 6.9330 7.4799 7.4799 7.4799 7.4799 8.5463 8.5463 8.5463 8.5463 8.8534 8.8534 8.8534 8.8534 9.0303 9.0303 9.0303 9.0303 9.2996 9.2996 9.2996 9.2996 9.5111 9.5111 9.5111 9.5111 9.8043 9.8043 9.8043 9.8043 9.9902 9.9902 9.9902 9.9902 10.1606 10.1606 10.1606 10.1606 10.5786 10.5786 10.5786 10.5786 10.9693 10.9693 10.9693 10.9693 11.7018 11.7018 11.7018 11.7018 12.9695 12.9695 12.9695 12.9695 13.0682 13.0682 13.0682 13.0682 14.4110 14.4110 k = 0.2614 0.1509 0.2537 ( 5138 PWs) bands (ev): 0.5041 0.5041 0.5041 0.5041 6.0035 6.0035 6.0035 6.0035 6.9435 6.9435 6.9435 6.9435 7.4877 7.4877 7.4877 7.4877 8.5382 8.5382 8.5382 8.5382 8.8719 8.8719 8.8719 8.8719 9.0682 9.0682 9.0682 9.0682 9.2939 9.2939 9.2939 9.2939 9.5154 9.5154 9.5154 9.5154 9.7830 9.7830 9.7830 9.7830 9.9789 9.9789 9.9789 9.9789 10.1553 10.1553 10.1553 10.1553 10.5388 10.5388 10.5388 10.5388 10.9276 10.9276 10.9276 10.9276 11.6614 11.6614 11.6614 11.6614 12.9883 12.9883 12.9883 12.9883 13.0851 13.0851 13.0851 13.0851 14.3677 14.3677 k = 0.2727 0.1575 0.2537 ( 5138 PWs) bands (ev): 0.5472 0.5472 0.5472 0.5472 5.9316 5.9316 5.9316 5.9316 6.9573 6.9573 6.9573 6.9573 7.4955 7.4955 7.4955 7.4955 8.5290 8.5290 8.5290 8.5290 8.8904 8.8904 8.8904 8.8904 9.1059 9.1059 9.1059 9.1059 9.2895 9.2895 9.2895 9.2895 9.5192 9.5192 9.5192 9.5192 9.7622 9.7622 9.7622 9.7622 9.9680 9.9680 9.9680 9.9680 10.1489 10.1489 10.1489 10.1489 10.5022 10.5022 10.5022 10.5022 10.8870 10.8870 10.8870 10.8870 11.6233 11.6233 11.6233 11.6233 13.0094 13.0094 13.0094 13.0094 13.1034 13.1034 13.1034 13.1034 14.3224 14.3224 k = 0.2841 0.1640 0.2537 ( 5152 PWs) bands (ev): 0.5909 0.5909 0.5909 0.5909 5.8575 5.8575 5.8575 5.8575 6.9737 6.9737 6.9737 6.9737 7.5035 7.5035 7.5035 7.5035 8.5187 8.5187 8.5187 8.5187 8.9087 8.9087 8.9087 8.9087 9.1427 9.1427 9.1427 9.1427 9.2865 9.2865 9.2865 9.2865 9.5224 9.5224 9.5224 9.5224 9.7422 9.7422 9.7422 9.7422 9.9578 9.9578 9.9578 9.9578 10.1409 10.1409 10.1409 10.1409 10.4689 10.4689 10.4689 10.4689 10.8476 10.8476 10.8476 10.8476 11.5876 11.5876 11.5876 11.5876 13.0326 13.0326 13.0326 13.0326 13.1232 13.1232 13.1232 13.1232 14.2756 14.2756 k = 0.2955 0.1706 0.2537 ( 5150 PWs) bands (ev): 0.6351 0.6351 0.6351 0.6351 5.7820 5.7820 5.7820 5.7820 6.9921 6.9921 6.9921 6.9921 7.5115 7.5115 7.5115 7.5115 8.5075 8.5075 8.5075 8.5075 8.9270 8.9270 8.9270 8.9270 9.1776 9.1776 9.1776 9.1776 9.2857 9.2857 9.2857 9.2857 9.5248 9.5248 9.5248 9.5248 9.7234 9.7234 9.7234 9.7234 9.9484 9.9484 9.9484 9.9484 10.1311 10.1311 10.1311 10.1311 10.4391 10.4391 10.4391 10.4391 10.8095 10.8095 10.8095 10.8095 11.5540 11.5540 11.5540 11.5540 13.0578 13.0578 13.0578 13.0578 13.1444 13.1444 13.1444 13.1444 14.2280 14.2280 k = 0.3068 0.1771 0.2537 ( 5138 PWs) bands (ev): 0.6795 0.6795 0.6795 0.6795 5.7059 5.7059 5.7059 5.7059 7.0121 7.0121 7.0121 7.0121 7.5195 7.5195 7.5195 7.5195 8.4955 8.4955 8.4955 8.4955 8.9450 8.9450 8.9450 8.9450 9.2090 9.2090 9.2090 9.2090 9.2880 9.2880 9.2880 9.2880 9.5263 9.5263 9.5263 9.5263 9.7059 9.7059 9.7059 9.7059 9.9400 9.9400 9.9400 9.9400 10.1197 10.1197 10.1197 10.1197 10.4132 10.4132 10.4132 10.4132 10.7729 10.7729 10.7729 10.7729 11.5227 11.5227 11.5227 11.5227 13.0852 13.0852 13.0852 13.0852 13.1669 13.1669 13.1669 13.1669 14.1802 14.1802 k = 0.3182 0.1837 0.2537 ( 5146 PWs) bands (ev): 0.7240 0.7240 0.7240 0.7240 5.6298 5.6298 5.6298 5.6298 7.0333 7.0333 7.0333 7.0333 7.5275 7.5275 7.5275 7.5275 8.4829 8.4829 8.4829 8.4829 8.9626 8.9626 8.9626 8.9626 9.2341 9.2341 9.2342 9.2342 9.2957 9.2957 9.2957 9.2957 9.5269 9.5269 9.5269 9.5269 9.6899 9.6899 9.6899 9.6899 9.9325 9.9325 9.9325 9.9325 10.1066 10.1066 10.1066 10.1066 10.3911 10.3911 10.3911 10.3911 10.7378 10.7378 10.7378 10.7378 11.4935 11.4935 11.4935 11.4935 13.1145 13.1145 13.1145 13.1145 13.1908 13.1908 13.1908 13.1908 14.1327 14.1327 k = 0.3295 0.1903 0.2537 ( 5136 PWs) bands (ev): 0.7682 0.7682 0.7682 0.7682 5.5544 5.5544 5.5544 5.5544 7.0552 7.0552 7.0552 7.0552 7.5354 7.5354 7.5354 7.5354 8.4700 8.4700 8.4700 8.4700 8.9798 8.9798 8.9798 8.9798 9.2503 9.2503 9.2503 9.2503 9.3107 9.3107 9.3107 9.3107 9.5266 9.5266 9.5266 9.5266 9.6757 9.6757 9.6757 9.6757 9.9261 9.9261 9.9261 9.9261 10.0923 10.0923 10.0923 10.0923 10.3727 10.3727 10.3727 10.3727 10.7044 10.7044 10.7044 10.7044 11.4663 11.4663 11.4663 11.4663 13.1459 13.1459 13.1459 13.1459 13.2161 13.2161 13.2161 13.2161 14.0860 14.0860 k = 0.3409 0.1968 0.2537 ( 5132 PWs) bands (ev): 0.8120 0.8120 0.8120 0.8120 5.4804 5.4804 5.4804 5.4804 7.0775 7.0775 7.0775 7.0775 7.5432 7.5432 7.5432 7.5432 8.4570 8.4570 8.4570 8.4570 8.9966 8.9966 8.9966 8.9966 9.2592 9.2592 9.2592 9.2592 9.3304 9.3304 9.3304 9.3304 9.5253 9.5253 9.5253 9.5253 9.6635 9.6635 9.6635 9.6635 9.9207 9.9207 9.9207 9.9207 10.0775 10.0775 10.0775 10.0775 10.3576 10.3576 10.3576 10.3576 10.6727 10.6727 10.6727 10.6727 11.4412 11.4412 11.4412 11.4412 13.1791 13.1791 13.1791 13.1791 13.2428 13.2428 13.2428 13.2428 14.0405 14.0405 k = 0.3523 0.2034 0.2537 ( 5144 PWs) bands (ev): 0.8549 0.8549 0.8549 0.8549 5.4082 5.4082 5.4082 5.4082 7.0999 7.0999 7.0999 7.0999 7.5508 7.5508 7.5508 7.5508 8.4441 8.4441 8.4441 8.4441 9.0127 9.0127 9.0127 9.0127 9.2649 9.2649 9.2649 9.2649 9.3501 9.3501 9.3501 9.3501 9.5230 9.5230 9.5230 9.5230 9.6534 9.6534 9.6534 9.6534 9.9162 9.9162 9.9162 9.9162 10.0629 10.0629 10.0629 10.0629 10.3456 10.3456 10.3456 10.3456 10.6428 10.6428 10.6428 10.6428 11.4179 11.4179 11.4179 11.4179 13.2141 13.2141 13.2141 13.2141 13.2708 13.2708 13.2708 13.2708 13.9967 13.9967 k = 0.3636 0.2099 0.2537 ( 5148 PWs) bands (ev): 0.8968 0.8968 0.8968 0.8968 5.3384 5.3384 5.3384 5.3384 7.1220 7.1220 7.1220 7.1220 7.5581 7.5581 7.5581 7.5581 8.4315 8.4315 8.4315 8.4315 9.0282 9.0282 9.0282 9.0282 9.2696 9.2696 9.2696 9.2696 9.3672 9.3672 9.3672 9.3672 9.5196 9.5196 9.5196 9.5196 9.6455 9.6455 9.6455 9.6455 9.9126 9.9126 9.9126 9.9126 10.0495 10.0495 10.0495 10.0495 10.3361 10.3361 10.3361 10.3361 10.6148 10.6148 10.6148 10.6148 11.3965 11.3965 11.3965 11.3965 13.2508 13.2508 13.2508 13.2508 13.3002 13.3002 13.3002 13.3002 13.9549 13.9549 k = 0.3750 0.2165 0.2537 ( 5146 PWs) bands (ev): 0.9373 0.9373 0.9373 0.9373 5.2716 5.2716 5.2716 5.2716 7.1436 7.1436 7.1436 7.1436 7.5651 7.5651 7.5651 7.5651 8.4196 8.4196 8.4196 8.4196 9.0428 9.0428 9.0428 9.0428 9.2740 9.2740 9.2740 9.2740 9.3805 9.3805 9.3805 9.3805 9.5154 9.5154 9.5154 9.5154 9.6396 9.6396 9.6396 9.6396 9.9095 9.9095 9.9095 9.9095 10.0383 10.0383 10.0383 10.0383 10.3287 10.3287 10.3287 10.3287 10.5889 10.5889 10.5889 10.5889 11.3769 11.3769 11.3769 11.3769 13.2890 13.2890 13.2890 13.2890 13.3309 13.3309 13.3309 13.3309 13.9154 13.9154 k = 0.3864 0.2231 0.2537 ( 5150 PWs) bands (ev): 0.9760 0.9760 0.9760 0.9760 5.2084 5.2084 5.2084 5.2084 7.1643 7.1643 7.1643 7.1643 7.5718 7.5718 7.5718 7.5718 8.4083 8.4083 8.4083 8.4083 9.0567 9.0567 9.0567 9.0567 9.2785 9.2785 9.2785 9.2785 9.3898 9.3898 9.3898 9.3898 9.5103 9.5103 9.5103 9.5103 9.6350 9.6350 9.6350 9.6350 9.9070 9.9070 9.9070 9.9070 10.0300 10.0300 10.0300 10.0300 10.3230 10.3230 10.3230 10.3230 10.5649 10.5649 10.5649 10.5649 11.3590 11.3590 11.3590 11.3590 13.3283 13.3283 13.3283 13.3283 13.3631 13.3631 13.3631 13.3631 13.8787 13.8787 k = 0.3977 0.2296 0.2537 ( 5138 PWs) bands (ev): 1.0126 1.0126 1.0126 1.0126 5.1491 5.1491 5.1491 5.1491 7.1840 7.1840 7.1840 7.1840 7.5781 7.5781 7.5781 7.5781 8.3980 8.3980 8.3980 8.3980 9.0696 9.0696 9.0696 9.0696 9.2830 9.2830 9.2830 9.2830 9.3957 9.3957 9.3957 9.3957 9.5045 9.5045 9.5045 9.5045 9.6311 9.6311 9.6311 9.6311 9.9049 9.9049 9.9049 9.9049 10.0249 10.0249 10.0249 10.0249 10.3186 10.3186 10.3186 10.3186 10.5431 10.5431 10.5431 10.5431 11.3428 11.3428 11.3428 11.3428 13.3683 13.3683 13.3683 13.3683 13.3969 13.3969 13.3969 13.3969 13.8449 13.8449 k = 0.4091 0.2362 0.2537 ( 5132 PWs) bands (ev): 1.0467 1.0467 1.0467 1.0467 5.0944 5.0944 5.0944 5.0944 7.2022 7.2022 7.2022 7.2022 7.5838 7.5838 7.5838 7.5838 8.3888 8.3888 8.3888 8.3888 9.0814 9.0814 9.0814 9.0814 9.2874 9.2874 9.2874 9.2874 9.3988 9.3988 9.3988 9.3988 9.4982 9.4982 9.4982 9.4982 9.6271 9.6271 9.6271 9.6271 9.9034 9.9034 9.9034 9.9034 10.0229 10.0229 10.0229 10.0229 10.3152 10.3152 10.3152 10.3152 10.5234 10.5234 10.5234 10.5234 11.3283 11.3283 11.3283 11.3283 13.4078 13.4078 13.4078 13.4078 13.4326 13.4326 13.4326 13.4326 13.8143 13.8143 k = 0.4205 0.2427 0.2537 ( 5124 PWs) bands (ev): 1.0779 1.0779 1.0779 1.0779 5.0447 5.0447 5.0447 5.0447 7.2189 7.2189 7.2189 7.2189 7.5891 7.5891 7.5891 7.5891 8.3807 8.3807 8.3807 8.3807 9.0920 9.0920 9.0920 9.0920 9.2918 9.2918 9.2918 9.2918 9.4000 9.4000 9.4000 9.4000 9.4918 9.4918 9.4918 9.4918 9.6225 9.6225 9.6225 9.6225 9.9023 9.9023 9.9023 9.9023 10.0236 10.0236 10.0236 10.0236 10.3127 10.3127 10.3127 10.3127 10.5060 10.5060 10.5060 10.5060 11.3155 11.3155 11.3155 11.3155 13.4457 13.4457 13.4457 13.4457 13.4709 13.4709 13.4709 13.4709 13.7873 13.7873 k = 0.4318 0.2493 0.2537 ( 5126 PWs) bands (ev): 1.1058 1.1058 1.1058 1.1058 5.0005 5.0005 5.0005 5.0005 7.2338 7.2338 7.2338 7.2338 7.5938 7.5938 7.5938 7.5938 8.3737 8.3737 8.3737 8.3737 9.1014 9.1014 9.1014 9.1014 9.2959 9.2959 9.2959 9.2959 9.3998 9.3998 9.3998 9.3998 9.4855 9.4855 9.4855 9.4855 9.6173 9.6173 9.6173 9.6173 9.9019 9.9019 9.9019 9.9019 10.0263 10.0263 10.0263 10.0263 10.3108 10.3108 10.3108 10.3108 10.4908 10.4908 10.4908 10.4908 11.3043 11.3043 11.3043 11.3043 13.4809 13.4809 13.4809 13.4809 13.5113 13.5113 13.5113 13.5113 13.7641 13.7641 k = 0.4432 0.2559 0.2537 ( 5122 PWs) bands (ev): 1.1302 1.1302 1.1302 1.1302 4.9623 4.9623 4.9623 4.9623 7.2467 7.2467 7.2467 7.2467 7.5979 7.5979 7.5979 7.5979 8.3678 8.3678 8.3678 8.3678 9.1094 9.1094 9.1094 9.1094 9.2997 9.2997 9.2997 9.2997 9.3990 9.3990 9.3990 9.3990 9.4797 9.4797 9.4797 9.4797 9.6117 9.6117 9.6117 9.6117 9.9019 9.9019 9.9019 9.9019 10.0302 10.0302 10.0302 10.0302 10.3094 10.3094 10.3094 10.3094 10.4779 10.4779 10.4779 10.4779 11.2947 11.2947 11.2947 11.2947 13.5132 13.5132 13.5132 13.5132 13.5522 13.5522 13.5522 13.5522 13.7452 13.7452 k = 0.4545 0.2624 0.2537 ( 5130 PWs) bands (ev): 1.1507 1.1507 1.1507 1.1507 4.9304 4.9304 4.9304 4.9304 7.2575 7.2575 7.2575 7.2575 7.6013 7.6013 7.6013 7.6013 8.3632 8.3632 8.3632 8.3632 9.1161 9.1161 9.1161 9.1161 9.3029 9.3029 9.3029 9.3029 9.3979 9.3979 9.3979 9.3979 9.4745 9.4745 9.4745 9.4745 9.6060 9.6060 9.6060 9.6060 9.9022 9.9022 9.9022 9.9022 10.0345 10.0345 10.0345 10.0345 10.3083 10.3083 10.3083 10.3083 10.4673 10.4673 10.4673 10.4673 11.2869 11.2869 11.2869 11.2869 13.5421 13.5421 13.5421 13.5421 13.5915 13.5915 13.5915 13.5915 13.7314 13.7314 k = 0.4659 0.2690 0.2537 ( 5136 PWs) bands (ev): 1.1669 1.1669 1.1669 1.1669 4.9053 4.9053 4.9053 4.9053 7.2660 7.2660 7.2660 7.2660 7.6039 7.6039 7.6039 7.6039 8.3596 8.3596 8.3596 8.3596 9.1212 9.1212 9.1212 9.1212 9.3055 9.3055 9.3055 9.3055 9.3969 9.3969 9.3969 9.3969 9.4703 9.4703 9.4703 9.4703 9.6009 9.6009 9.6009 9.6009 9.9027 9.9027 9.9027 9.9027 10.0386 10.0386 10.0386 10.0386 10.3076 10.3076 10.3076 10.3076 10.4590 10.4590 10.4590 10.4590 11.2807 11.2807 11.2807 11.2807 13.5665 13.5665 13.5665 13.5665 13.6257 13.6257 13.6257 13.6257 13.7239 13.7239 k = 0.4773 0.2756 0.2537 ( 5130 PWs) bands (ev): 1.1787 1.1787 1.1787 1.1787 4.8871 4.8871 4.8871 4.8871 7.2721 7.2721 7.2721 7.2721 7.6059 7.6059 7.6059 7.6059 8.3571 8.3571 8.3571 8.3571 9.1250 9.1250 9.1250 9.1250 9.3075 9.3075 9.3075 9.3075 9.3961 9.3961 9.3961 9.3961 9.4672 9.4672 9.4672 9.4672 9.5968 9.5968 9.5968 9.5968 9.9032 9.9032 9.9032 9.9032 10.0419 10.0419 10.0419 10.0419 10.3071 10.3071 10.3071 10.3071 10.4532 10.4532 10.4532 10.4532 11.2764 11.2764 11.2764 11.2764 13.5850 13.5850 13.5850 13.5850 13.6504 13.6504 13.6504 13.6504 13.7245 13.7245 k = 0.4886 0.2821 0.2537 ( 5122 PWs) bands (ev): 1.1859 1.1859 1.1859 1.1859 4.8760 4.8760 4.8760 4.8760 7.2759 7.2759 7.2759 7.2759 7.6071 7.6071 7.6071 7.6071 8.3556 8.3556 8.3556 8.3556 9.1272 9.1272 9.1272 9.1272 9.3087 9.3087 9.3087 9.3087 9.3956 9.3956 9.3956 9.3956 9.4653 9.4653 9.4653 9.4653 9.5941 9.5941 9.5941 9.5941 9.9036 9.9036 9.9036 9.9036 10.0441 10.0441 10.0441 10.0441 10.3069 10.3069 10.3069 10.3069 10.4496 10.4496 10.4496 10.4496 11.2737 11.2737 11.2737 11.2737 13.5963 13.5963 13.5963 13.5963 13.6628 13.6628 13.6628 13.6628 13.7310 13.7310 k = 0.5000 0.2887 0.2537 ( 5124 PWs) bands (ev): 1.1882 1.1882 1.1882 1.1882 4.8724 4.8724 4.8724 4.8724 7.2771 7.2771 7.2771 7.2771 7.6075 7.6075 7.6075 7.6075 8.3551 8.3551 8.3551 8.3551 9.1279 9.1279 9.1279 9.1279 9.3091 9.3091 9.3091 9.3091 9.3954 9.3954 9.3954 9.3954 9.4646 9.4646 9.4646 9.4646 9.5932 9.5932 9.5932 9.5932 9.9037 9.9037 9.9037 9.9037 10.0448 10.0448 10.0448 10.0448 10.3068 10.3068 10.3068 10.3068 10.4485 10.4485 10.4485 10.4485 11.2728 11.2728 11.2728 11.2728 13.6001 13.6001 13.6001 13.6001 13.6661 13.6661 13.6661 13.6661 13.7349 13.7349 k = 0.5000 0.2887 0.2537 ( 5124 PWs) bands (ev): 1.1882 1.1882 1.1882 1.1882 4.8724 4.8724 4.8724 4.8724 7.2771 7.2771 7.2771 7.2771 7.6075 7.6075 7.6075 7.6075 8.3551 8.3551 8.3551 8.3551 9.1279 9.1279 9.1279 9.1279 9.3091 9.3091 9.3091 9.3091 9.3954 9.3954 9.3954 9.3954 9.4646 9.4646 9.4646 9.4646 9.5932 9.5932 9.5932 9.5932 9.9037 9.9037 9.9037 9.9037 10.0448 10.0448 10.0448 10.0448 10.3068 10.3068 10.3068 10.3068 10.4485 10.4485 10.4485 10.4485 11.2728 11.2728 11.2728 11.2728 13.6001 13.6001 13.6001 13.6001 13.6661 13.6661 13.6661 13.6661 13.7349 13.7349 k = 0.4933 0.3002 0.2537 ( 5124 PWs) bands (ev): 1.1886 1.1886 1.1890 1.1890 4.8726 4.8726 4.8748 4.8748 7.2733 7.2733 7.2777 7.2777 7.5989 7.5989 7.6053 7.6053 8.3591 8.3591 8.3592 8.3592 9.1228 9.1228 9.1322 9.1322 9.3034 9.3034 9.3145 9.3145 9.3926 9.3926 9.3975 9.3975 9.4600 9.4600 9.4698 9.4698 9.5911 9.5911 9.5955 9.5955 9.9012 9.9012 9.9041 9.9041 10.0425 10.0425 10.0449 10.0449 10.3049 10.3049 10.3087 10.3087 10.4499 10.4499 10.4538 10.4538 11.2716 11.2716 11.2735 11.2735 13.5809 13.5809 13.6007 13.6007 13.6626 13.6626 13.6739 13.6739 13.7380 13.7380 k = 0.4867 0.3118 0.2537 ( 5128 PWs) bands (ev): 1.1901 1.1901 1.1909 1.1909 4.8756 4.8756 4.8798 4.8798 7.2658 7.2658 7.2745 7.2745 7.5808 7.5808 7.5931 7.5931 8.3706 8.3706 8.3711 8.3711 9.1169 9.1169 9.1354 9.1354 9.2974 9.2974 9.3196 9.3196 9.3893 9.3893 9.3988 9.3988 9.4561 9.4561 9.4753 9.4753 9.5889 9.5889 9.5977 9.5977 9.8969 9.8969 9.9022 9.9022 10.0381 10.0381 10.0425 10.0425 10.3039 10.3039 10.3101 10.3101 10.4585 10.4585 10.4651 10.4651 11.2699 11.2699 11.2738 11.2738 13.5537 13.5537 13.5809 13.5809 13.6673 13.6673 13.6776 13.6776 13.7515 13.7515 k = 0.4800 0.3233 0.2537 ( 5136 PWs) bands (ev): 1.1927 1.1927 1.1939 1.1939 4.8812 4.8812 4.8876 4.8876 7.2535 7.2535 7.2660 7.2660 7.5562 7.5562 7.5733 7.5733 8.3882 8.3882 8.3896 8.3896 9.1101 9.1101 9.1377 9.1377 9.2909 9.2909 9.3244 9.3244 9.3859 9.3859 9.3992 9.3992 9.4530 9.4530 9.4810 9.4810 9.5867 9.5867 9.6000 9.6000 9.8911 9.8911 9.8981 9.8981 10.0323 10.0323 10.0378 10.0378 10.3042 10.3042 10.3106 10.3106 10.4738 10.4738 10.4813 10.4813 11.2677 11.2677 11.2735 11.2735 13.5231 13.5231 13.5519 13.5519 13.6725 13.6725 13.6769 13.6769 13.7715 13.7715 k = 0.4733 0.3349 0.2537 ( 5142 PWs) bands (ev): 1.1964 1.1964 1.1980 1.1980 4.8894 4.8894 4.8981 4.8981 7.2344 7.2344 7.2496 7.2496 7.5297 7.5297 7.5497 7.5497 8.4103 8.4103 8.4129 8.4129 9.1025 9.1025 9.1387 9.1387 9.2843 9.2843 9.3288 9.3288 9.3826 9.3826 9.3988 9.3988 9.4507 9.4507 9.4870 9.4870 9.5846 9.5846 9.6023 9.6023 9.8842 9.8842 9.8920 9.8920 10.0255 10.0255 10.0312 10.0312 10.3060 10.3060 10.3105 10.3105 10.4948 10.4948 10.5015 10.5015 11.2650 11.2650 11.2728 11.2728 13.4910 13.4910 13.5196 13.5196 13.6721 13.6721 13.6747 13.6747 13.7935 13.7935 k = 0.4667 0.3464 0.2537 ( 5142 PWs) bands (ev): 1.2012 1.2012 1.2032 1.2032 4.9002 4.9002 4.9112 4.9112 7.2060 7.2060 7.2222 7.2222 7.5062 7.5062 7.5267 7.5267 8.4353 8.4353 8.4396 8.4396 9.0940 9.0940 9.1384 9.1384 9.2775 9.2775 9.3328 9.3328 9.3796 9.3796 9.3976 9.3976 9.4493 9.4493 9.4930 9.4930 9.5825 9.5825 9.6047 9.6047 9.8767 9.8767 9.8840 9.8840 10.0182 10.0182 10.0231 10.0231 10.3090 10.3090 10.3100 10.3100 10.5201 10.5201 10.5249 10.5249 11.2617 11.2617 11.2716 11.2716 13.4584 13.4584 13.4862 13.4862 13.6621 13.6621 13.6728 13.6728 13.8132 13.8132 k = 0.4600 0.3580 0.2537 ( 5140 PWs) bands (ev): 1.2070 1.2070 1.2094 1.2094 4.9136 4.9136 4.9269 4.9269 7.1666 7.1666 7.1818 7.1818 7.4896 7.4896 7.5080 7.5080 8.4619 8.4619 8.4680 8.4680 9.0847 9.0847 9.1364 9.1364 9.2707 9.2707 9.3364 9.3364 9.3772 9.3772 9.3960 9.3960 9.4487 9.4487 9.4989 9.4989 9.5804 9.5804 9.6071 9.6071 9.8688 9.8688 9.8746 9.8746 10.0106 10.0106 10.0142 10.0142 10.3094 10.3094 10.3129 10.3129 10.5487 10.5487 10.5506 10.5506 11.2579 11.2579 11.2699 11.2699 13.4256 13.4256 13.4524 13.4524 13.6460 13.6460 13.6650 13.6650 13.8246 13.8246 k = 0.4533 0.3695 0.2537 ( 5144 PWs) bands (ev): 1.2137 1.2137 1.2165 1.2165 4.9295 4.9295 4.9453 4.9453 7.1155 7.1155 7.1285 7.1285 7.4810 7.4810 7.4953 7.4953 8.4890 8.4890 8.4971 8.4971 9.0746 9.0746 9.1325 9.1325 9.2643 9.2643 9.3395 9.3395 9.3754 9.3754 9.3943 9.3943 9.4487 9.4487 9.5048 9.5048 9.5784 9.5784 9.6096 9.6096 9.8611 9.8611 9.8642 9.8642 10.0031 10.0031 10.0047 10.0047 10.3086 10.3086 10.3171 10.3171 10.5780 10.5780 10.5794 10.5794 11.2535 11.2535 11.2677 11.2677 13.3929 13.3929 13.4187 13.4187 13.6239 13.6239 13.6497 13.6497 13.8246 13.8246 k = 0.4467 0.3811 0.2537 ( 5134 PWs) bands (ev): 1.2213 1.2213 1.2245 1.2245 4.9479 4.9479 4.9664 4.9664 7.0540 7.0540 7.0648 7.0648 7.4794 7.4794 7.4890 7.4890 8.5159 8.5159 8.5260 8.5260 9.0638 9.0638 9.1266 9.1266 9.2586 9.2586 9.3420 9.3420 9.3744 9.3744 9.3926 9.3926 9.4493 9.4493 9.5105 9.5105 9.5764 9.5764 9.6123 9.6123 9.8531 9.8531 9.8537 9.8537 9.9950 9.9950 9.9957 9.9957 10.3078 10.3078 10.3215 10.3215 10.6066 10.6066 10.6115 10.6115 11.2485 11.2485 11.2650 11.2650 13.3603 13.3603 13.3854 13.3854 13.5970 13.5970 13.6267 13.6267 13.8195 13.8195 k = 0.4400 0.3926 0.2537 ( 5146 PWs) bands (ev): 1.2298 1.2298 1.2334 1.2334 4.9687 4.9687 4.9900 4.9900 6.9840 6.9840 6.9931 6.9931 7.4830 7.4830 7.4879 7.4879 8.5418 8.5418 8.5538 8.5538 9.0523 9.0523 9.1187 9.1187 9.2536 9.2536 9.3439 9.3439 9.3741 9.3741 9.3912 9.3912 9.4504 9.4504 9.5160 9.5160 9.5745 9.5745 9.6151 9.6151 9.8418 9.8418 9.8470 9.8470 9.9855 9.9855 9.9886 9.9886 10.3067 10.3067 10.3258 10.3258 10.6358 10.6358 10.6442 10.6442 11.2429 11.2429 11.2618 11.2618 13.3276 13.3276 13.3522 13.3522 13.5673 13.5673 13.5980 13.5980 13.8149 13.8149 k = 0.4333 0.4041 0.2537 ( 5150 PWs) bands (ev): 1.2390 1.2390 1.2429 1.2429 4.9919 4.9919 5.0161 5.0161 6.9075 6.9075 6.9158 6.9158 7.4904 7.4904 7.4911 7.4911 8.5666 8.5666 8.5803 8.5803 9.0404 9.0404 9.1089 9.1089 9.2497 9.2497 9.3453 9.3453 9.3745 9.3745 9.3900 9.3900 9.4518 9.4518 9.5211 9.5211 9.5727 9.5727 9.6181 9.6181 9.8307 9.8307 9.8412 9.8412 9.9762 9.9762 9.9817 9.9817 10.3054 10.3055 10.3297 10.3297 10.6651 10.6651 10.6771 10.6771 11.2367 11.2367 11.2580 11.2580 13.2945 13.2945 13.3192 13.3192 13.5368 13.5368 13.5666 13.5666 13.8120 13.8120 k = 0.4267 0.4157 0.2537 ( 5144 PWs) bands (ev): 1.2488 1.2488 1.2531 1.2531 5.0173 5.0173 5.0448 5.0448 6.8263 6.8263 6.8348 6.8348 7.4973 7.4973 7.5005 7.5005 8.5897 8.5897 8.6048 8.6048 9.0284 9.0284 9.0977 9.0977 9.2466 9.2466 9.3463 9.3463 9.3756 9.3756 9.3891 9.3891 9.4535 9.4535 9.5257 9.5257 9.5712 9.5712 9.6215 9.6215 9.8200 9.8200 9.8364 9.8364 9.9673 9.9673 9.9752 9.9752 10.3038 10.3038 10.3330 10.3330 10.6943 10.6943 10.7096 10.7096 11.2298 11.2298 11.2536 11.2536 13.2609 13.2609 13.2860 13.2860 13.5073 13.5073 13.5349 13.5349 13.8099 13.8099 k = 0.4200 0.4272 0.2537 ( 5148 PWs) bands (ev): 1.2591 1.2591 1.2638 1.2638 5.0448 5.0448 5.0760 5.0760 6.7418 6.7418 6.7513 6.7513 7.5059 7.5059 7.5126 7.5126 8.6108 8.6108 8.6271 8.6271 9.0165 9.0165 9.0855 9.0855 9.2442 9.2442 9.3469 9.3469 9.3771 9.3771 9.3884 9.3884 9.4551 9.4551 9.5297 9.5297 9.5701 9.5701 9.6253 9.6253 9.8101 9.8101 9.8328 9.8328 9.9590 9.9590 9.9688 9.9688 10.3018 10.3018 10.3357 10.3357 10.7229 10.7229 10.7414 10.7414 11.2223 11.2223 11.2486 11.2486 13.2268 13.2268 13.2526 13.2526 13.4800 13.4800 13.5048 13.5048 13.8080 13.8080 k = 0.4133 0.4388 0.2537 ( 5142 PWs) bands (ev): 1.2698 1.2698 1.2749 1.2749 5.0744 5.0744 5.1095 5.1095 6.6552 6.6552 6.6666 6.6666 7.5162 7.5162 7.5260 7.5260 8.6297 8.6297 8.6467 8.6467 9.0053 9.0053 9.0731 9.0731 9.2425 9.2425 9.3475 9.3475 9.3791 9.3791 9.3878 9.3878 9.4566 9.4566 9.5330 9.5330 9.5694 9.5694 9.6296 9.6296 9.8011 9.8011 9.8304 9.8304 9.9512 9.9512 9.9627 9.9627 10.2994 10.2994 10.3376 10.3376 10.7506 10.7506 10.7722 10.7722 11.2142 11.2142 11.2431 11.2431 13.1921 13.1921 13.2188 13.2188 13.4557 13.4557 13.4774 13.4774 13.8058 13.8058 k = 0.4067 0.4503 0.2537 ( 5140 PWs) bands (ev): 1.2807 1.2807 1.2862 1.2862 5.1058 5.1058 5.1454 5.1454 6.5674 6.5674 6.5817 6.5817 7.5276 7.5276 7.5402 7.5402 8.6461 8.6461 8.6633 8.6633 8.9951 8.9951 9.0609 9.0609 9.2412 9.2412 9.3480 9.3480 9.3812 9.3812 9.3872 9.3872 9.4577 9.4577 9.5356 9.5356 9.5694 9.5694 9.6346 9.6346 9.7932 9.7932 9.8292 9.8292 9.9440 9.9440 9.9568 9.9568 10.2966 10.2966 10.3388 10.3388 10.7774 10.7774 10.8018 10.8018 11.2054 11.2054 11.2368 11.2368 13.1573 13.1573 13.1849 13.1849 13.4347 13.4347 13.4534 13.4534 13.8030 13.8030 k = 0.4000 0.4619 0.2537 ( 5142 PWs) bands (ev): 1.2918 1.2918 1.2975 1.2975 5.1389 5.1389 5.1836 5.1836 6.4793 6.4793 6.4973 6.4973 7.5397 7.5397 7.5548 7.5548 8.6598 8.6598 8.6767 8.6767 8.9865 8.9865 9.0498 9.0498 9.2402 9.2402 9.3485 9.3485 9.3834 9.3834 9.3866 9.3866 9.4582 9.4582 9.5373 9.5373 9.5701 9.5701 9.6403 9.6403 9.7863 9.7863 9.8291 9.8291 9.9374 9.9374 9.9511 9.9511 10.2934 10.2934 10.3392 10.3392 10.8030 10.8030 10.8300 10.8300 11.1959 11.1959 11.2299 11.2299 13.1227 13.1227 13.1512 13.1512 13.4171 13.4171 13.4330 13.4330 13.7997 13.7997 k = 0.3933 0.4734 0.2537 ( 5148 PWs) bands (ev): 1.3028 1.3028 1.3088 1.3088 5.1734 5.1734 5.2239 5.2239 6.3916 6.3916 6.4145 6.4145 7.5521 7.5521 7.5696 7.5696 8.6706 8.6706 8.6866 8.6866 8.9798 8.9798 9.0401 9.0401 9.2393 9.2393 9.3491 9.3491 9.3854 9.3854 9.3860 9.3860 9.4581 9.4581 9.5383 9.5383 9.5716 9.5716 9.6468 9.6468 9.7805 9.7805 9.8301 9.8301 9.9315 9.9315 9.9455 9.9455 10.2899 10.2899 10.3388 10.3388 10.8273 10.8273 10.8567 10.8567 11.1858 11.1858 11.2223 11.2223 13.0891 13.0891 13.1183 13.1183 13.4025 13.4025 13.4159 13.4159 13.7959 13.7959 k = 0.3867 0.4850 0.2537 ( 5146 PWs) bands (ev): 1.3135 1.3135 1.3199 1.3199 5.2089 5.2089 5.2662 5.2662 6.3051 6.3051 6.3341 6.3341 7.5644 7.5644 7.5840 7.5840 8.6784 8.6784 8.6932 8.6932 8.9755 8.9755 9.0324 9.0324 9.2387 9.2387 9.3497 9.3497 9.3852 9.3852 9.3872 9.3872 9.4574 9.4574 9.5387 9.5387 9.5737 9.5737 9.6541 9.6541 9.7757 9.7757 9.8320 9.8320 9.9262 9.9262 9.9400 9.9400 10.2862 10.2862 10.3377 10.3377 10.8502 10.8502 10.8818 10.8818 11.1752 11.1752 11.2140 11.2140 13.0570 13.0570 13.0867 13.0867 13.3906 13.3906 13.4020 13.4020 13.7919 13.7919 k = 0.3800 0.4965 0.2537 ( 5146 PWs) bands (ev): 1.3238 1.3238 1.3304 1.3304 5.2449 5.2449 5.3105 5.3105 6.2204 6.2204 6.2570 6.2570 7.5764 7.5764 7.5978 7.5978 8.6834 8.6834 8.6965 8.6965 8.9734 8.9734 9.0269 9.0269 9.2380 9.2380 9.3505 9.3505 9.3843 9.3843 9.3885 9.3885 9.4562 9.4562 9.5387 9.5387 9.5763 9.5763 9.6621 9.6621 9.7716 9.7716 9.8347 9.8347 9.9216 9.9216 9.9347 9.9347 10.2824 10.2824 10.3361 10.3361 10.8716 10.8716 10.9053 10.9053 11.1642 11.1642 11.2052 11.2052 13.0271 13.0271 13.0571 13.0571 13.3812 13.3812 13.3909 13.3909 13.7877 13.7877 k = 0.3733 0.5081 0.2537 ( 5142 PWs) bands (ev): 1.3335 1.3335 1.3404 1.3404 5.2808 5.2808 5.3564 5.3564 6.1383 6.1383 6.1843 6.1843 7.5875 7.5875 7.6106 7.6106 8.6859 8.6859 8.6972 8.6972 8.9733 8.9733 9.0235 9.0235 9.2374 9.2374 9.3513 9.3513 9.3832 9.3832 9.3894 9.3894 9.4547 9.4547 9.5384 9.5384 9.5791 9.5791 9.6707 9.6707 9.7680 9.7680 9.8378 9.8378 9.9176 9.9176 9.9296 9.9296 10.2786 10.2786 10.3341 10.3341 10.8916 10.8916 10.9270 10.9270 11.1528 11.1528 11.1958 11.1958 12.9999 12.9999 13.0301 13.0301 13.3738 13.3738 13.3821 13.3821 13.7836 13.7836 k = 0.3667 0.5196 0.2537 ( 5142 PWs) bands (ev): 1.3423 1.3423 1.3494 1.3494 5.3158 5.3158 5.4037 5.4037 6.0595 6.0595 6.1174 6.1174 7.5976 7.5976 7.6220 7.6220 8.6863 8.6863 8.6959 8.6959 8.9748 8.9748 9.0220 9.0220 9.2368 9.2368 9.3521 9.3521 9.3820 9.3820 9.3898 9.3898 9.4531 9.4531 9.5381 9.5381 9.5820 9.5820 9.6798 9.6798 9.7645 9.7645 9.8412 9.8412 9.9142 9.9142 9.9248 9.9248 10.2751 10.2751 10.3318 10.3318 10.9098 10.9098 10.9469 10.9469 11.1413 11.1413 11.1861 11.1861 12.9760 12.9760 13.0062 13.0062 13.3680 13.3680 13.3752 13.3752 13.7799 13.7799 k = 0.3600 0.5312 0.2537 ( 5142 PWs) bands (ev): 1.3500 1.3500 1.3573 1.3573 5.3485 5.3485 5.4517 5.4517 5.9849 5.9849 6.0579 6.0579 7.6063 7.6063 7.6319 7.6319 8.6853 8.6853 8.6934 8.6934 8.9772 8.9772 9.0220 9.0220 9.2362 9.2362 9.3530 9.3530 9.3806 9.3806 9.3898 9.3898 9.4517 9.4517 9.5377 9.5377 9.5848 9.5848 9.6892 9.6892 9.7608 9.7608 9.8446 9.8446 9.9114 9.9114 9.9204 9.9204 10.2719 10.2719 10.3294 10.3294 10.9262 10.9262 10.9646 10.9646 11.1302 11.1302 11.1763 11.1763 12.9558 12.9558 12.9859 12.9859 13.3636 13.3636 13.3701 13.3701 13.7765 13.7765 k = 0.3533 0.5427 0.2537 ( 5126 PWs) bands (ev): 1.3564 1.3564 1.3638 1.3638 5.3772 5.3772 5.4994 5.4994 5.9160 5.9160 6.0079 6.0079 7.6134 7.6134 7.6399 7.6399 8.6836 8.6836 8.6906 8.6906 8.9800 8.9800 9.0230 9.0230 9.2357 9.2357 9.3538 9.3538 9.3793 9.3793 9.3895 9.3895 9.4504 9.4504 9.5375 9.5375 9.5872 9.5872 9.6986 9.6986 9.7567 9.7567 9.8476 9.8476 9.9092 9.9092 9.9166 9.9166 10.2693 10.2693 10.3273 10.3273 10.9403 10.9403 10.9798 10.9798 11.1198 11.1198 11.1671 11.1671 12.9396 12.9396 12.9697 12.9697 13.3604 13.3604 13.3663 13.3663 13.7738 13.7738 k = 0.3467 0.5543 0.2537 ( 5130 PWs) bands (ev): 1.3613 1.3613 1.3688 1.3688 5.3998 5.3998 5.5444 5.5444 5.8556 5.8556 5.9697 5.9697 7.6186 7.6186 7.6457 7.6457 8.6818 8.6818 8.6879 8.6879 8.9825 8.9825 9.0244 9.0244 9.2352 9.2352 9.3544 9.3544 9.3782 9.3782 9.3890 9.3890 9.4495 9.4495 9.5374 9.5374 9.5890 9.5890 9.7075 9.7075 9.7519 9.7519 9.8501 9.8501 9.9076 9.9076 9.9137 9.9137 10.2673 10.2673 10.3256 10.3256 10.9514 10.9514 10.9919 10.9919 11.1111 11.1111 11.1590 11.1590 12.9278 12.9278 12.9578 12.9578 13.3582 13.3582 13.3638 13.3638 13.7718 13.7718 k = 0.3400 0.5658 0.2537 ( 5118 PWs) bands (ev): 1.3644 1.3644 1.3720 1.3720 5.4142 5.4142 5.5808 5.5808 5.8097 5.8097 5.9458 5.9458 7.6218 7.6218 7.6493 7.6493 8.6804 8.6804 8.6861 8.6861 8.9844 8.9844 9.0256 9.0256 9.2349 9.2349 9.3549 9.3549 9.3773 9.3773 9.3886 9.3886 9.4489 9.4489 9.5373 9.5373 9.5902 9.5902 9.7151 9.7151 9.7471 9.7471 9.8518 9.8518 9.9066 9.9066 9.9118 9.9118 10.2661 10.2661 10.3245 10.3245 10.9588 10.9588 10.9998 10.9998 11.1050 11.1050 11.1534 11.1534 12.9206 12.9206 12.9506 12.9506 13.3569 13.3569 13.3623 13.3623 13.7707 13.7707 k = 0.3333 0.5774 0.2537 ( 5106 PWs) bands (ev): 1.3655 1.3655 1.3731 1.3731 5.4190 5.4190 5.5960 5.5960 5.7913 5.7913 5.9377 5.9377 7.6229 7.6229 7.6505 7.6505 8.6799 8.6799 8.6855 8.6855 8.9851 8.9851 9.0261 9.0261 9.2349 9.2349 9.3551 9.3551 9.3770 9.3770 9.3885 9.3885 9.4488 9.4488 9.5374 9.5374 9.5906 9.5906 9.7187 9.7187 9.7446 9.7446 9.8524 9.8524 9.9062 9.9062 9.9112 9.9112 10.2657 10.2657 10.3241 10.3241 10.9614 10.9614 11.0026 11.0026 11.1028 11.1028 11.1513 11.1513 12.9182 12.9182 12.9481 12.9482 13.3565 13.3565 13.3618 13.3618 13.7703 13.7703 k = 0.3333 0.5774 0.2537 ( 5106 PWs) bands (ev): 1.3655 1.3655 1.3731 1.3731 5.4190 5.4190 5.5960 5.5960 5.7913 5.7913 5.9377 5.9377 7.6229 7.6229 7.6505 7.6505 8.6799 8.6799 8.6855 8.6855 8.9851 8.9851 9.0261 9.0261 9.2349 9.2349 9.3551 9.3551 9.3770 9.3770 9.3885 9.3885 9.4488 9.4488 9.5374 9.5374 9.5906 9.5906 9.7187 9.7187 9.7446 9.7446 9.8524 9.8524 9.9062 9.9062 9.9112 9.9112 10.2657 10.2657 10.3241 10.3241 10.9614 10.9614 11.0026 11.0026 11.1028 11.1028 11.1513 11.1513 12.9182 12.9182 12.9481 12.9482 13.3565 13.3565 13.3618 13.3618 13.7703 13.7703 k = 0.3267 0.5658 0.2537 ( 5128 PWs) bands (ev): 1.3643 1.3643 1.3719 1.3719 5.4147 5.4147 5.5819 5.5819 5.8087 5.8087 5.9454 5.9454 7.6219 7.6219 7.6493 7.6493 8.6804 8.6804 8.6861 8.6861 8.9843 8.9843 9.0255 9.0255 9.2349 9.2349 9.3549 9.3549 9.3773 9.3773 9.3886 9.3886 9.4489 9.4489 9.5373 9.5373 9.5901 9.5901 9.7147 9.7147 9.7474 9.7474 9.8517 9.8517 9.9066 9.9066 9.9118 9.9118 10.2661 10.2661 10.3245 10.3245 10.9587 10.9587 10.9997 10.9997 11.1051 11.1051 11.1535 11.1535 12.9206 12.9206 12.9506 12.9506 13.3569 13.3569 13.3623 13.3623 13.7706 13.7706 k = 0.3200 0.5543 0.2537 ( 5132 PWs) bands (ev): 1.3607 1.3607 1.3683 1.3683 5.4033 5.4033 5.5507 5.5507 5.8498 5.8498 5.9666 5.9666 7.6187 7.6187 7.6458 7.6458 8.6822 8.6822 8.6883 8.6883 8.9818 8.9818 9.0234 9.0234 9.2353 9.2353 9.3543 9.3543 9.3784 9.3784 9.3894 9.3894 9.4495 9.4495 9.5372 9.5372 9.5890 9.5890 9.7055 9.7055 9.7537 9.7537 9.8497 9.8497 9.9080 9.9080 9.9138 9.9138 10.2673 10.2673 10.3257 10.3257 10.9513 10.9513 10.9915 10.9915 11.1118 11.1118 11.1600 11.1600 12.9278 12.9278 12.9579 12.9579 13.3584 13.3584 13.3638 13.3639 13.7718 13.7718 k = 0.3133 0.5427 0.2537 ( 5132 PWs) bands (ev): 1.3545 1.3545 1.3619 1.3619 5.3880 5.3880 5.5156 5.5156 5.9013 5.9013 5.9985 5.9985 7.6136 7.6136 7.6402 7.6402 8.6852 8.6852 8.6919 8.6919 8.9775 8.9775 9.0196 9.0196 9.2361 9.2361 9.3533 9.3533 9.3801 9.3801 9.3908 9.3908 9.4505 9.4505 9.5370 9.5370 9.5872 9.5872 9.6938 9.6938 9.7607 9.7607 9.8462 9.8462 9.9104 9.9104 9.9172 9.9172 10.2691 10.2691 10.3277 10.3277 10.9399 10.9399 10.9788 10.9788 11.1220 11.1220 11.1702 11.1702 12.9398 12.9398 12.9699 12.9699 13.3610 13.3610 13.3666 13.3666 13.7736 13.7736 k = 0.3067 0.5312 0.2537 ( 5132 PWs) bands (ev): 1.3456 1.3456 1.3528 1.3528 5.3716 5.3716 5.4824 5.4824 5.9577 5.9577 6.0381 6.0381 7.6067 7.6067 7.6327 7.6327 8.6890 8.6890 8.6966 8.6966 8.9713 8.9713 9.0141 9.0141 9.2373 9.2373 9.3518 9.3518 9.3825 9.3825 9.3927 9.3927 9.4520 9.4520 9.5366 9.5366 9.5849 9.5849 9.6808 9.6808 9.7675 9.7675 9.8414 9.8414 9.9138 9.9138 9.9219 9.9219 10.2715 10.2715 10.3302 10.3302 10.9258 10.9258 10.9628 10.9628 11.1350 11.1350 11.1830 11.1830 12.9562 12.9562 12.9864 12.9864 13.3649 13.3649 13.3706 13.3706 13.7760 13.7760 k = 0.3000 0.5196 0.2537 ( 5148 PWs) bands (ev): 1.3337 1.3337 1.3407 1.3407 5.3564 5.3564 5.4535 5.4535 6.0164 6.0164 6.0832 6.0832 7.5983 7.5983 7.6235 7.6235 8.6935 8.6935 8.7022 8.7022 8.9633 8.9633 9.0068 9.0068 9.2387 9.2387 9.3498 9.3498 9.3853 9.3853 9.3953 9.3953 9.4541 9.4541 9.5361 9.5361 9.5823 9.5823 9.6675 9.6675 9.7733 9.7733 9.8356 9.8356 9.9183 9.9183 9.9278 9.9278 10.2743 10.2743 10.3331 10.3331 10.9097 10.9097 10.9445 10.9445 11.1501 11.1501 11.1979 11.1979 12.9766 12.9766 13.0068 13.0068 13.3705 13.3705 13.3762 13.3762 13.7789 13.7789 k = 0.2933 0.5081 0.2537 ( 5144 PWs) bands (ev): 1.3188 1.3188 1.3256 1.3256 5.3440 5.3440 5.4298 5.4298 6.0764 6.0764 6.1319 6.1319 7.5887 7.5887 7.6132 7.6132 8.6982 8.6982 8.7083 8.7083 8.9536 8.9536 8.9979 8.9979 9.2404 9.2404 9.3470 9.3470 9.3886 9.3886 9.3982 9.3982 9.4570 9.4570 9.5356 9.5356 9.5797 9.5797 9.6543 9.6543 9.7782 9.7782 9.8288 9.8288 9.9238 9.9238 9.9349 9.9349 10.2774 10.2774 10.3363 10.3363 10.8925 10.8925 10.9248 10.9248 11.1669 11.1669 11.2144 11.2144 13.0004 13.0004 13.0306 13.0306 13.3778 13.3778 13.3833 13.3833 13.7824 13.7824 k = 0.2867 0.4965 0.2537 ( 5152 PWs) bands (ev): 1.3010 1.3010 1.3075 1.3075 5.3356 5.3356 5.4119 5.4119 6.1368 6.1368 6.1828 6.1828 7.5783 7.5783 7.6020 7.6020 8.7026 8.7026 8.7143 8.7143 8.9426 8.9426 8.9877 8.9877 9.2423 9.2423 9.3433 9.3433 9.3922 9.3922 9.4015 9.4015 9.4608 9.4608 9.5352 9.5352 9.5772 9.5772 9.6417 9.6417 9.7817 9.7817 9.8215 9.8215 9.9302 9.9302 9.9432 9.9432 10.2806 10.2806 10.3396 10.3396 10.8745 10.8745 10.9041 10.9041 11.1852 11.1852 11.2323 11.2323 13.0269 13.0269 13.0568 13.0568 13.3871 13.3871 13.3921 13.3921 13.7865 13.7865 k = 0.2800 0.4850 0.2537 ( 5152 PWs) bands (ev): 1.2800 1.2800 1.2862 1.2862 5.3318 5.3318 5.4002 5.4002 6.1970 6.1970 6.2350 6.2350 7.5674 7.5674 7.5904 7.5904 8.7061 8.7061 8.7196 8.7196 8.9305 8.9305 8.9763 8.9763 9.2443 9.2443 9.3386 9.3386 9.3962 9.3962 9.4049 9.4049 9.4655 9.4655 9.5351 9.5351 9.5752 9.5752 9.6302 9.6302 9.7839 9.7839 9.8135 9.8135 9.9375 9.9375 9.9527 9.9527 10.2839 10.2839 10.3426 10.3426 10.8563 10.8563 10.8832 10.8832 11.2048 11.2048 11.2515 11.2515 13.0549 13.0549 13.0845 13.0845 13.3985 13.3985 13.4023 13.4023 13.7914 13.7914 k = 0.2733 0.4734 0.2537 ( 5156 PWs) bands (ev): 1.2561 1.2561 1.2620 1.2620 5.3331 5.3331 5.3947 5.3947 6.2565 6.2565 6.2874 6.2874 7.5564 7.5564 7.5788 7.5788 8.7083 8.7083 8.7236 8.7236 8.9180 8.9180 8.9642 8.9642 9.2462 9.2462 9.3330 9.3330 9.4004 9.4004 9.4085 9.4085 9.4710 9.4710 9.5356 9.5356 9.5740 9.5740 9.6198 9.6198 9.7846 9.7846 9.8052 9.8052 9.9457 9.9457 9.9632 9.9632 10.2872 10.2872 10.3454 10.3454 10.8382 10.8382 10.8623 10.8623 11.2257 11.2257 11.2719 11.2719 13.0833 13.0833 13.1124 13.1124 13.4116 13.4116 13.4133 13.4133 13.7976 13.7976 k = 0.2667 0.4619 0.2537 ( 5144 PWs) bands (ev): 1.2293 1.2293 1.2348 1.2348 5.3399 5.3399 5.3954 5.3954 6.3147 6.3147 6.3393 6.3393 7.5457 7.5457 7.5678 7.5678 8.7086 8.7086 8.7254 8.7254 8.9057 8.9057 8.9519 8.9519 9.2480 9.2480 9.3265 9.3265 9.4049 9.4049 9.4122 9.4122 9.4771 9.4771 9.5369 9.5369 9.5737 9.5737 9.6107 9.6107 9.7837 9.7837 9.7966 9.7966 9.9548 9.9548 9.9747 9.9747 10.2903 10.2903 10.3478 10.3478 10.8206 10.8206 10.8420 10.8420 11.2479 11.2479 11.2937 11.2937 13.1109 13.1109 13.1393 13.1393 13.4237 13.4237 13.4254 13.4254 13.8062 13.8062 k = 0.2600 0.4503 0.2537 ( 5144 PWs) bands (ev): 1.1996 1.1996 1.2048 1.2048 5.3521 5.3521 5.4022 5.4022 6.3711 6.3711 6.3899 6.3899 7.5357 7.5357 7.5576 7.5576 8.7066 8.7066 8.7245 8.7245 8.8942 8.8942 8.9396 8.9396 9.2493 9.2493 9.3194 9.3194 9.4096 9.4096 9.4161 9.4161 9.4835 9.4835 9.5390 9.5390 9.5748 9.5748 9.6030 9.6030 9.7815 9.7815 9.7879 9.7879 9.9648 9.9648 9.9872 9.9872 10.2933 10.2933 10.3498 10.3498 10.8037 10.8037 10.8228 10.8228 11.2715 11.2715 11.3166 11.3166 13.1365 13.1365 13.1641 13.1641 13.4310 13.4310 13.4377 13.4377 13.8190 13.8190 k = 0.2533 0.4388 0.2537 ( 5142 PWs) bands (ev): 1.1674 1.1674 1.1721 1.1721 5.3699 5.3699 5.4151 5.4151 6.4251 6.4251 6.4385 6.4385 7.5268 7.5268 7.5487 7.5487 8.7020 8.7020 8.7202 8.7202 8.8840 8.8840 8.9277 8.9277 9.2500 9.2500 9.3120 9.3120 9.4142 9.4142 9.4203 9.4203 9.4894 9.4894 9.5420 9.5420 9.5776 9.5776 9.5964 9.5964 9.7780 9.7780 9.7791 9.7791 9.9758 9.9758 10.0006 10.0006 10.2961 10.2961 10.3512 10.3512 10.7880 10.7880 10.8049 10.8049 11.2965 11.2965 11.3409 11.3409 13.1591 13.1591 13.1859 13.1859 13.4318 13.4318 13.4450 13.4450 13.8385 13.8385 k = 0.2467 0.4272 0.2537 ( 5134 PWs) bands (ev): 1.1326 1.1326 1.1370 1.1370 5.3930 5.3930 5.4338 5.4338 6.4763 6.4763 6.4845 6.4845 7.5192 7.5192 7.5415 7.5415 8.6948 8.6948 8.7125 8.7125 8.8755 8.8755 8.9164 8.9164 9.2501 9.2501 9.3044 9.3044 9.4186 9.4186 9.4248 9.4248 9.4943 9.4943 9.5456 9.5456 9.5826 9.5826 9.5910 9.5910 9.7705 9.7705 9.7736 9.7736 9.9877 9.9877 10.0148 10.0148 10.2989 10.2989 10.3521 10.3521 10.7737 10.7737 10.7888 10.7888 11.3230 11.3230 11.3667 11.3667 13.1783 13.1783 13.2040 13.2040 13.4231 13.4231 13.4430 13.4430 13.8673 13.8673 k = 0.2400 0.4157 0.2537 ( 5138 PWs) bands (ev): 1.0957 1.0957 1.0997 1.0997 5.4214 5.4214 5.4580 5.4580 6.5240 6.5240 6.5272 6.5272 7.5132 7.5132 7.5363 7.5363 8.6851 8.6851 8.7017 8.7017 8.8685 8.8685 8.9057 8.9057 9.2495 9.2495 9.2971 9.2971 9.4223 9.4223 9.4293 9.4293 9.4975 9.4975 9.5495 9.5495 9.5869 9.5869 9.5903 9.5903 9.7625 9.7625 9.7687 9.7687 10.0006 10.0006 10.0296 10.0296 10.3017 10.3017 10.3526 10.3526 10.7611 10.7611 10.7748 10.7748 11.3510 11.3510 11.3939 11.3939 13.1936 13.1936 13.2181 13.2181 13.4039 13.4039 13.4291 13.4291 13.9039 13.9039 k = 0.2333 0.4041 0.2537 ( 5138 PWs) bands (ev): 1.0567 1.0567 1.0603 1.0603 5.4548 5.4548 5.4875 5.4875 6.5661 6.5661 6.5678 6.5678 7.5090 7.5090 7.5332 7.5332 8.6736 8.6736 8.6885 8.6885 8.8626 8.8626 8.8957 8.8957 9.2485 9.2485 9.2902 9.2902 9.4247 9.4247 9.4330 9.4330 9.4986 9.4986 9.5532 9.5532 9.5846 9.5846 9.6007 9.6007 9.7557 9.7557 9.7641 9.7641 10.0145 10.0145 10.0450 10.0450 10.3048 10.3048 10.3529 10.3529 10.7506 10.7506 10.7631 10.7631 11.3806 11.3806 11.4227 11.4227 13.2045 13.2045 13.2273 13.2273 13.3759 13.3759 13.4036 13.4036 13.9372 13.9372 k = 0.2267 0.3926 0.2537 ( 5142 PWs) bands (ev): 1.0159 1.0159 1.0192 1.0192 5.4930 5.4930 5.5220 5.5220 6.6008 6.6008 6.6073 6.6073 7.5067 7.5067 7.5323 7.5323 8.6607 8.6607 8.6740 8.6740 8.8572 8.8572 8.8859 8.8859 9.2471 9.2471 9.2840 9.2840 9.4249 9.4249 9.4347 9.4347 9.4976 9.4976 9.5555 9.5555 9.5853 9.5853 9.6138 9.6138 9.7505 9.7505 9.7605 9.7605 10.0295 10.0295 10.0609 10.0609 10.3084 10.3084 10.3531 10.3531 10.7422 10.7422 10.7541 10.7541 11.4119 11.4119 11.4532 11.4532 13.2101 13.2101 13.2295 13.2295 13.3437 13.3437 13.3704 13.3704 13.9760 13.9760 k = 0.2200 0.3811 0.2537 ( 5140 PWs) bands (ev): 0.9736 0.9736 0.9766 0.9766 5.5355 5.5355 5.5610 5.5610 6.6309 6.6309 6.6423 6.6423 7.5062 7.5062 7.5334 7.5334 8.6473 8.6473 8.6589 8.6589 8.8518 8.8518 8.8763 8.8763 9.2456 9.2456 9.2787 9.2787 9.4219 9.4219 9.4330 9.4330 9.4952 9.4952 9.5559 9.5559 9.5900 9.5900 9.6291 9.6291 9.7477 9.7477 9.7589 9.7589 10.0457 10.0457 10.0770 10.0770 10.3128 10.3128 10.3535 10.3535 10.7362 10.7362 10.7478 10.7478 11.4451 11.4451 11.4854 11.4854 13.2076 13.2076 13.2192 13.2192 13.3153 13.3153 13.3354 13.3354 14.0130 14.0130 k = 0.2133 0.3695 0.2537 ( 5132 PWs) bands (ev): 0.9301 0.9301 0.9328 0.9328 5.5822 5.5822 5.6043 5.6043 6.6565 6.6565 6.6725 6.6725 7.5071 7.5071 7.5364 7.5364 8.6339 8.6339 8.6442 8.6442 8.8461 8.8461 8.8666 8.8666 9.2443 9.2443 9.2744 9.2744 9.4144 9.4144 9.4264 9.4264 9.4925 9.4925 9.5543 9.5543 9.5992 9.5992 9.6460 9.6460 9.7480 9.7480 9.7599 9.7599 10.0628 10.0628 10.0931 10.0931 10.3184 10.3184 10.3543 10.3543 10.7327 10.7327 10.7443 10.7443 11.4801 11.4801 11.5195 11.5195 13.1908 13.1908 13.1919 13.1919 13.2989 13.2989 13.3070 13.3070 14.0442 14.0442 k = 0.2067 0.3580 0.2537 ( 5136 PWs) bands (ev): 0.8855 0.8855 0.8879 0.8879 5.6325 5.6325 5.6513 5.6513 6.6775 6.6775 6.6982 6.6982 7.5092 7.5092 7.5406 7.5406 8.6212 8.6212 8.6305 8.6305 8.8397 8.8397 8.8567 8.8567 9.2433 9.2433 9.2712 9.2712 9.4015 9.4015 9.4142 9.4142 9.4901 9.4901 9.5513 9.5513 9.6125 9.6125 9.6639 9.6639 9.7518 9.7518 9.7641 9.7641 10.0809 10.0809 10.1089 10.1089 10.3258 10.3258 10.3561 10.3561 10.7317 10.7317 10.7437 10.7437 11.5170 11.5170 11.5554 11.5554 13.1486 13.1486 13.1598 13.1598 13.2902 13.2902 13.2919 13.2919 14.0689 14.0689 k = 0.2000 0.3464 0.2537 ( 5132 PWs) bands (ev): 0.8402 0.8402 0.8423 0.8423 5.6861 5.6861 5.7016 5.7016 6.6944 6.6944 6.7195 6.7195 7.5119 7.5119 7.5455 7.5455 8.6097 8.6097 8.6183 8.6183 8.8326 8.8326 8.8465 8.8465 9.2426 9.2426 9.2691 9.2691 9.3830 9.3830 9.3964 9.3964 9.4885 9.4885 9.5475 9.5475 9.6290 9.6290 9.6822 9.6822 9.7595 9.7595 9.7714 9.7714 10.0998 10.0998 10.1240 10.1240 10.3357 10.3357 10.3594 10.3594 10.7333 10.7333 10.7459 10.7459 11.5559 11.5559 11.5934 11.5934 13.0999 13.0999 13.1160 13.1160 13.2820 13.2820 13.2885 13.2885 14.0921 14.0921 k = 0.1933 0.3349 0.2537 ( 5128 PWs) bands (ev): 0.7943 0.7943 0.7963 0.7963 5.7425 5.7425 5.7547 5.7547 6.7075 6.7075 6.7370 6.7370 7.5145 7.5145 7.5504 7.5504 8.5999 8.5999 8.6080 8.6080 8.8247 8.8247 8.8359 8.8359 9.2422 9.2422 9.2681 9.2681 9.3598 9.3598 9.3740 9.3740 9.4875 9.4875 9.5431 9.5431 9.6482 9.6482 9.7003 9.7003 9.7712 9.7712 9.7818 9.7818 10.1189 10.1189 10.1378 10.1378 10.3487 10.3487 10.3652 10.3652 10.7373 10.7373 10.7508 10.7508 11.5968 11.5968 11.6334 11.6334 13.0486 13.0486 13.0668 13.0668 13.2773 13.2773 13.2856 13.2856 14.1186 14.1186 k = 0.1867 0.3233 0.2537 ( 5128 PWs) bands (ev): 0.7482 0.7482 0.7499 0.7499 5.8012 5.8012 5.8101 5.8101 6.7174 6.7174 6.7511 6.7511 7.5166 7.5166 7.5547 7.5547 8.5920 8.5920 8.5997 8.5997 8.8161 8.8161 8.8250 8.8250 9.2415 9.2415 9.2675 9.2675 9.3330 9.3330 9.3482 9.3482 9.4867 9.4867 9.5384 9.5384 9.6693 9.6693 9.7180 9.7180 9.7864 9.7864 9.7948 9.7948 10.1377 10.1377 10.1501 10.1501 10.3655 10.3655 10.3743 10.3743 10.7439 10.7439 10.7585 10.7585 11.6399 11.6399 11.6755 11.6755 12.9966 12.9966 13.0154 13.0154 13.2734 13.2734 13.2822 13.2822 14.1480 14.1480 k = 0.1800 0.3118 0.2537 ( 5116 PWs) bands (ev): 0.7020 0.7020 0.7035 0.7035 5.8617 5.8617 5.8672 5.8672 6.7248 6.7248 6.7627 6.7627 7.5175 7.5175 7.5578 7.5578 8.5860 8.5860 8.5936 8.5936 8.8067 8.8067 8.8136 8.8136 9.2389 9.2389 9.2652 9.2652 9.3058 9.3058 9.3218 9.3218 9.4860 9.4860 9.5334 9.5334 9.6918 9.6918 9.7354 9.7354 9.8046 9.8046 9.8103 9.8103 10.1552 10.1552 10.1605 10.1605 10.3869 10.3869 10.3882 10.3882 10.7529 10.7529 10.7688 10.7688 11.6851 11.6851 11.7197 11.7197 12.9449 12.9449 12.9637 12.9637 13.2693 13.2693 13.2779 13.2779 14.1798 14.1798 k = 0.1733 0.3002 0.2537 ( 5112 PWs) bands (ev): 0.6560 0.6560 0.6573 0.6573 5.9233 5.9233 5.9254 5.9254 6.7305 6.7305 6.7725 6.7725 7.5170 7.5170 7.5592 7.5592 8.5820 8.5820 8.5893 8.5893 8.7966 8.7966 8.8020 8.8020 9.2298 9.2298 9.2510 9.2510 9.2889 9.2889 9.2998 9.2998 9.4853 9.4853 9.5283 9.5283 9.7151 9.7151 9.7529 9.7529 9.8247 9.8247 9.8276 9.8276 10.1689 10.1689 10.1705 10.1705 10.4082 10.4082 10.4132 10.4132 10.7643 10.7643 10.7815 10.7815 11.7324 11.7324 11.7660 11.7660 12.8941 12.8941 12.9125 12.9125 13.2645 13.2645 13.2726 13.2726 14.2137 14.2137 k = 0.1667 0.2887 0.2537 ( 5120 PWs) bands (ev): 0.6104 0.6104 0.6115 0.6115 5.9839 5.9839 5.9854 5.9854 6.7351 6.7351 6.7812 6.7812 7.5148 7.5148 7.5587 7.5587 8.5797 8.5797 8.5868 8.5868 8.7860 8.7860 8.7901 8.7901 9.2087 9.2087 9.2204 9.2204 9.2874 9.2874 9.2886 9.2886 9.4842 9.4842 9.5231 9.5231 9.7388 9.7388 9.7706 9.7706 9.8459 9.8459 9.8465 9.8465 10.1753 10.1753 10.1828 10.1828 10.4352 10.4352 10.4446 10.4446 10.7780 10.7780 10.7968 10.7968 11.7818 11.7818 11.8145 11.8145 12.8446 12.8446 12.8623 12.8623 13.2588 13.2588 13.2663 13.2663 14.2471 14.2471 k = 0.1600 0.2771 0.2537 ( 5120 PWs) bands (ev): 0.5653 0.5653 0.5662 0.5662 6.0419 6.0419 6.0470 6.0470 6.7397 6.7397 6.7898 6.7898 7.5108 7.5108 7.5562 7.5562 8.5788 8.5788 8.5856 8.5856 8.7750 8.7750 8.7780 8.7780 9.1773 9.1773 9.1839 9.1839 9.2872 9.2872 9.2913 9.2913 9.4830 9.4830 9.5178 9.5178 9.7626 9.7626 9.7888 9.7888 9.8665 9.8665 9.8677 9.8677 10.1801 10.1801 10.1919 10.1919 10.4697 10.4697 10.4812 10.4812 10.7941 10.7941 10.8144 10.8144 11.8334 11.8334 11.8652 11.8652 12.7966 12.7966 12.8136 12.8136 13.2522 13.2522 13.2592 13.2592 14.2798 14.2798 k = 0.1533 0.2656 0.2537 ( 5120 PWs) bands (ev): 0.5209 0.5209 0.5217 0.5217 6.0985 6.0985 6.1074 6.1074 6.7451 6.7451 6.7991 6.7991 7.5051 7.5051 7.5517 7.5517 8.5790 8.5790 8.5855 8.5855 8.7636 8.7636 8.7658 8.7658 9.1407 9.1407 9.1454 9.1454 9.2909 9.2909 9.2971 9.2971 9.4816 9.4816 9.5125 9.5125 9.7863 9.7863 9.8075 9.8075 9.8873 9.8873 9.8895 9.8895 10.1834 10.1834 10.1980 10.1980 10.5115 10.5115 10.5229 10.5229 10.8126 10.8126 10.8345 10.8345 11.8870 11.8870 11.9179 11.9179 12.7504 12.7504 12.7666 12.7666 13.2449 13.2449 13.2513 13.2513 14.3127 14.3127 k = 0.1467 0.2540 0.2537 ( 5124 PWs) bands (ev): 0.4773 0.4773 0.4781 0.4781 6.1527 6.1527 6.1652 6.1652 6.7525 6.7525 6.8101 6.8101 7.4979 7.4979 7.5454 7.5454 8.5800 8.5800 8.5860 8.5860 8.7521 8.7521 8.7536 8.7536 9.1019 9.1019 9.1060 9.1060 9.2970 9.2970 9.3039 9.3039 9.4800 9.4800 9.5071 9.5071 9.8096 9.8096 9.8265 9.8265 9.9085 9.9085 9.9112 9.9112 10.1857 10.1857 10.2016 10.2016 10.5602 10.5602 10.5696 10.5696 10.8335 10.8335 10.8569 10.8569 11.9427 11.9427 11.9727 11.9727 12.7063 12.7063 12.7215 12.7215 13.2367 13.2367 13.2427 13.2427 14.3452 14.3452 k = 0.1400 0.2425 0.2537 ( 5126 PWs) bands (ev): 0.4349 0.4349 0.4355 0.4355 6.2034 6.2034 6.2192 6.2192 6.7628 6.7628 6.8238 6.8238 7.4896 7.4896 7.5376 7.5376 8.5814 8.5814 8.5869 8.5869 8.7404 8.7404 8.7415 8.7415 9.0621 9.0621 9.0662 9.0662 9.3046 9.3046 9.3114 9.3114 9.4782 9.4782 9.5019 9.5019 9.8324 9.8324 9.8456 9.8456 9.9297 9.9297 9.9324 9.9324 10.1872 10.1872 10.2033 10.2033 10.6149 10.6149 10.6210 10.6210 10.8570 10.8570 10.8818 10.8818 12.0003 12.0003 12.0295 12.0295 12.6644 12.6644 12.6786 12.6786 13.2280 13.2280 13.2337 13.2337 14.3767 14.3767 k = 0.1333 0.2309 0.2537 ( 5126 PWs) bands (ev): 0.3936 0.3936 0.3941 0.3941 6.2495 6.2495 6.2681 6.2681 6.7775 6.7775 6.8410 6.8410 7.4803 7.4803 7.5287 7.5287 8.5830 8.5830 8.5878 8.5878 8.7287 8.7287 8.7295 8.7295 9.0222 9.0222 9.0266 9.0266 9.3129 9.3129 9.3194 9.3194 9.4762 9.4762 9.4966 9.4966 9.8546 9.8546 9.8647 9.8647 9.9507 9.9507 9.9533 9.9533 10.1880 10.1880 10.2036 10.2036 10.6748 10.6748 10.6767 10.6767 10.8831 10.8831 10.9093 10.9093 12.0598 12.0598 12.0880 12.0880 12.6250 12.6250 12.6380 12.6380 13.2186 13.2186 13.2242 13.2242 14.4068 14.4068 k = 0.1267 0.2194 0.2537 ( 5126 PWs) bands (ev): 0.3536 0.3536 0.3540 0.3540 6.2900 6.2900 6.3105 6.3105 6.7975 6.7975 6.8625 6.8625 7.4705 7.4705 7.5188 7.5188 8.5844 8.5844 8.5885 8.5885 8.7171 8.7171 8.7178 8.7178 8.9829 8.9829 8.9876 8.9876 9.3217 9.3217 9.3275 9.3275 9.4740 9.4740 9.4915 9.4915 9.8759 9.8759 9.8834 9.8834 9.9711 9.9711 9.9737 9.9737 10.1884 10.1884 10.2029 10.2029 10.7363 10.7363 10.7389 10.7389 10.9122 10.9122 10.9395 10.9395 12.1209 12.1209 12.1483 12.1483 12.5882 12.5882 12.6000 12.6000 13.2089 13.2089 13.2144 13.2144 14.4347 14.4347 k = 0.1200 0.2078 0.2537 ( 5126 PWs) bands (ev): 0.3150 0.3150 0.3153 0.3153 6.3244 6.3244 6.3454 6.3454 6.8235 6.8235 6.8885 6.8885 7.4604 7.4604 7.5084 7.5084 8.5855 8.5855 8.5890 8.5890 8.7058 8.7058 8.7064 8.7064 8.9443 8.9443 8.9495 8.9495 9.3308 9.3308 9.3358 9.3358 9.4718 9.4718 9.4865 9.4865 9.8962 9.8962 9.9015 9.9015 9.9910 9.9910 9.9936 9.9936 10.1885 10.1885 10.2015 10.2015 10.7992 10.7992 10.8061 10.8061 10.9446 10.9446 10.9725 10.9725 12.1836 12.1836 12.2100 12.2100 12.5544 12.5544 12.5649 12.5649 13.1987 13.1987 13.2044 13.2044 14.4598 14.4598 k = 0.1133 0.1963 0.2537 ( 5108 PWs) bands (ev): 0.2779 0.2779 0.2783 0.2783 6.3523 6.3523 6.3726 6.3726 6.8555 6.8555 6.9192 6.9192 7.4505 7.4505 7.4977 7.4977 8.5863 8.5863 8.5891 8.5891 8.6949 8.6949 8.6956 8.6956 8.9071 8.9071 8.9126 8.9126 9.3398 9.3398 9.3440 9.3440 9.4695 9.4695 9.4816 9.4816 9.9154 9.9154 9.9188 9.9188 10.0100 10.0100 10.0130 10.0130 10.1886 10.1886 10.1996 10.1996 10.8643 10.8643 10.8747 10.8747 10.9812 10.9812 11.0088 11.0088 12.2476 12.2476 12.2731 12.2731 12.5238 12.5238 12.5330 12.5330 13.1883 13.1883 13.1943 13.1943 14.4814 14.4814 k = 0.1067 0.1848 0.2537 ( 5108 PWs) bands (ev): 0.2425 0.2425 0.2428 0.2428 6.3740 6.3740 6.3926 6.3926 6.8926 6.8926 6.9536 6.9536 7.4409 7.4409 7.4871 7.4871 8.5866 8.5866 8.5887 8.5887 8.6845 8.6845 8.6853 8.6853 8.8715 8.8715 8.8773 8.8773 9.3487 9.3487 9.3519 9.3519 9.4672 9.4672 9.4769 9.4769 9.9334 9.9334 9.9351 9.9351 10.0281 10.0281 10.0318 10.0318 10.1885 10.1885 10.1975 10.1975 10.9306 10.9306 10.9421 10.9421 11.0239 11.0239 11.0487 11.0487 12.3126 12.3126 12.3369 12.3369 12.4969 12.4969 12.5047 12.5047 13.1777 13.1777 13.1841 13.1841 14.4988 14.4988 k = 0.1000 0.1732 0.2537 ( 5108 PWs) bands (ev): 0.2089 0.2089 0.2091 0.2091 6.3901 6.3901 6.4064 6.4064 6.9335 6.9335 6.9910 6.9910 7.4319 7.4319 7.4768 7.4768 8.5864 8.5864 8.5879 8.5879 8.6746 8.6746 8.6755 8.6755 8.8376 8.8376 8.8437 8.8437 9.3572 9.3572 9.3595 9.3595 9.4648 9.4648 9.4725 9.4725 9.9500 9.9500 9.9503 9.9503 10.0453 10.0453 10.0499 10.0499 10.1885 10.1885 10.1952 10.1952 10.9964 10.9964 11.0043 11.0043 11.0754 11.0754 11.0929 11.0929 12.3778 12.3778 12.4005 12.4005 12.4748 12.4748 12.4808 12.4808 13.1670 13.1670 13.1740 13.1740 14.5115 14.5115 k = 0.0933 0.1617 0.2537 ( 5108 PWs) bands (ev): 0.1770 0.1770 0.1772 0.1772 6.4016 6.4016 6.4153 6.4153 6.9765 6.9765 7.0299 7.0299 7.4238 7.4238 7.4670 7.4670 8.5858 8.5858 8.5867 8.5867 8.6653 8.6653 8.6665 8.6665 8.8058 8.8058 8.8121 8.8121 9.3653 9.3653 9.3667 9.3667 9.4624 9.4624 9.4682 9.4682 9.9642 9.9642 9.9651 9.9651 10.0614 10.0614 10.0672 10.0672 10.1886 10.1886 10.1930 10.1930 11.0593 11.0593 11.0600 11.0600 11.1369 11.1369 11.1424 11.1424 12.4375 12.4375 12.4462 12.4462 12.4672 12.4672 12.4754 12.4754 13.1562 13.1562 13.1640 13.1640 14.5188 14.5188 k = 0.0867 0.1501 0.2537 ( 5120 PWs) bands (ev): 0.1470 0.1470 0.1472 0.1472 6.4092 6.4092 6.4203 6.4203 7.0201 7.0201 7.0691 7.0691 7.4168 7.4168 7.4578 7.4578 8.5849 8.5849 8.5852 8.5852 8.6568 8.6568 8.6583 8.6583 8.7763 8.7763 8.7826 8.7826 9.3728 9.3728 9.3735 9.3735 9.4601 9.4601 9.4643 9.4643 9.9769 9.9769 9.9787 9.9787 10.0765 10.0765 10.0836 10.0836 10.1888 10.1888 10.1909 10.1909 11.1099 11.1099 11.1198 11.1198 11.1973 11.1973 11.2040 11.2040 12.4377 12.4377 12.4406 12.4406 12.5152 12.5152 12.5347 12.5347 13.1454 13.1454 13.1542 13.1542 14.5200 14.5200 k = 0.0800 0.1386 0.2537 ( 5124 PWs) bands (ev): 0.1190 0.1190 0.1191 0.1191 6.4138 6.4138 6.4226 6.4226 7.0630 7.0630 7.1074 7.1074 7.4112 7.4112 7.4496 7.4496 8.5835 8.5835 8.5837 8.5837 8.6490 8.6490 8.6508 8.6508 8.7490 8.7490 8.7555 8.7555 9.3797 9.3797 9.3797 9.3797 9.4579 9.4579 9.4607 9.4607 9.9884 9.9884 9.9908 9.9908 10.0906 10.0906 10.0989 10.0989 10.1890 10.1890 10.1892 10.1892 11.1596 11.1596 11.1762 11.1762 11.2561 11.2561 11.2721 11.2721 12.4298 12.4298 12.4320 12.4320 12.5800 12.5800 12.5982 12.5982 13.1346 13.1346 13.1446 13.1446 14.5144 14.5144 k = 0.0733 0.1270 0.2537 ( 5114 PWs) bands (ev): 0.0930 0.0930 0.0931 0.0931 6.4163 6.4163 6.4230 6.4230 7.1039 7.1039 7.1436 7.1436 7.4071 7.4071 7.4423 7.4423 8.5818 8.5818 8.5824 8.5824 8.6420 8.6420 8.6441 8.6441 8.7243 8.7243 8.7307 8.7307 9.3854 9.3854 9.3860 9.3860 9.4559 9.4559 9.4576 9.4576 9.9986 9.9986 10.0013 10.0013 10.1038 10.1038 10.1129 10.1129 10.1875 10.1875 10.1898 10.1898 11.2098 11.2098 11.2303 11.2303 11.3159 11.3159 11.3380 11.3380 12.4273 12.4273 12.4287 12.4287 12.6446 12.6446 12.6607 12.6607 13.1239 13.1239 13.1352 13.1352 14.5014 14.5014 k = 0.0667 0.1155 0.2537 ( 5114 PWs) bands (ev): 0.0691 0.0691 0.0692 0.0692 6.4170 6.4170 6.4220 6.4220 7.1420 7.1420 7.1767 7.1767 7.4047 7.4047 7.4362 7.4362 8.5803 8.5803 8.5811 8.5811 8.6357 8.6357 8.6382 8.6382 8.7021 8.7021 8.7084 8.7084 9.3904 9.3905 9.3914 9.3914 9.4541 9.4541 9.4549 9.4549 10.0077 10.0077 10.0103 10.0103 10.1159 10.1159 10.1257 10.1257 10.1864 10.1864 10.1904 10.1904 11.2610 11.2610 11.2835 11.2835 11.3740 11.3740 11.3996 11.3996 12.4313 12.4313 12.4320 12.4320 12.7074 12.7074 12.7210 12.7210 13.1133 13.1133 13.1259 13.1259 14.4798 14.4798 k = 0.0600 0.1039 0.2537 ( 5118 PWs) bands (ev): 0.0474 0.0474 0.0474 0.0474 6.4166 6.4166 6.4202 6.4202 7.1766 7.1766 7.2060 7.2060 7.4041 7.4041 7.4314 7.4314 8.5790 8.5790 8.5800 8.5800 8.6301 8.6301 8.6329 8.6329 8.6823 8.6823 8.6884 8.6884 9.3948 9.3948 9.3959 9.3959 9.4526 9.4526 9.4527 9.4527 10.0155 10.0155 10.0179 10.0179 10.1270 10.1270 10.1369 10.1369 10.1858 10.1858 10.1910 10.1910 11.3128 11.3128 11.3359 11.3359 11.4282 11.4282 11.4554 11.4554 12.4422 12.4422 12.4425 12.4425 12.7674 12.7674 12.7778 12.7778 13.1028 13.1028 13.1169 13.1169 14.4478 14.4478 k = 0.0533 0.0924 0.2537 ( 5118 PWs) bands (ev): 0.0278 0.0278 0.0278 0.0278 6.4154 6.4154 6.4179 6.4179 7.2071 7.2071 7.2310 7.2310 7.4055 7.4055 7.4279 7.4279 8.5782 8.5782 8.5792 8.5792 8.6251 8.6251 8.6283 8.6283 8.6650 8.6650 8.6709 8.6709 9.3984 9.3984 9.3996 9.3996 9.4511 9.4511 9.4514 9.4514 10.0222 10.0222 10.0242 10.0242 10.1372 10.1372 10.1467 10.1467 10.1857 10.1857 10.1916 10.1916 11.3647 11.3647 11.3875 11.3875 11.4771 11.4771 11.5041 11.5041 12.4601 12.4601 12.4603 12.4603 12.8232 12.8232 12.8301 12.8301 13.0925 13.0925 13.1079 13.1079 14.3925 14.3925 k = 0.0467 0.0808 0.2537 ( 5116 PWs) bands (ev): 0.0104 0.0104 0.0104 0.0104 6.4137 6.4137 6.4153 6.4153 7.2331 7.2331 7.2513 7.2513 7.4086 7.4086 7.4259 7.4259 8.5778 8.5778 8.5788 8.5788 8.6207 8.6207 8.6241 8.6241 8.6502 8.6502 8.6557 8.6557 9.4014 9.4014 9.4024 9.4024 9.4501 9.4501 9.4505 9.4505 10.0278 10.0278 10.0293 10.0293 10.1464 10.1464 10.1550 10.1550 10.1861 10.1861 10.1921 10.1921 11.4157 11.4157 11.4373 11.4373 11.5199 11.5199 11.5454 11.5454 12.4847 12.4847 12.4851 12.4851 12.8734 12.8734 12.8764 12.8764 13.0825 13.0825 13.0989 13.0989 14.3246 14.3246 k = 0.0400 0.0693 0.2537 ( 5116 PWs) bands (ev): -0.0048 -0.0048 -0.0047 -0.0047 6.4118 6.4118 6.4128 6.4128 7.2545 7.2545 7.2673 7.2673 7.4131 7.4131 7.4253 7.4253 8.5780 8.5780 8.5788 8.5788 8.6168 8.6168 8.6204 8.6204 8.6377 8.6377 8.6428 8.6428 9.4036 9.4036 9.4044 9.4044 9.4496 9.4496 9.4500 9.4500 10.0323 10.0323 10.0334 10.0334 10.1547 10.1547 10.1620 10.1620 10.1868 10.1868 10.1923 10.1923 11.4649 11.4649 11.4844 11.4844 11.5563 11.5563 11.5790 11.5790 12.5153 12.5153 12.5159 12.5159 12.9154 12.9154 12.9164 12.9164 13.0728 13.0728 13.0896 13.0896 14.2591 14.2591 k = 0.0333 0.0577 0.2537 ( 5116 PWs) bands (ev): -0.0176 -0.0176 -0.0176 -0.0176 6.4099 6.4099 6.4105 6.4105 7.2713 7.2713 7.2793 7.2793 7.4183 7.4183 7.4260 7.4260 8.5785 8.5785 8.5791 8.5791 8.6134 8.6134 8.6171 8.6171 8.6275 8.6275 8.6321 8.6321 9.4052 9.4052 9.4057 9.4057 9.4495 9.4495 9.4499 9.4499 10.0360 10.0360 10.0367 10.0367 10.1620 10.1620 10.1676 10.1676 10.1877 10.1877 10.1922 10.1922 11.5106 11.5106 11.5271 11.5271 11.5868 11.5868 11.6054 11.6054 12.5504 12.5504 12.5511 12.5511 12.9460 12.9460 12.9502 12.9502 13.0640 13.0640 13.0799 13.0799 14.2003 14.2004 k = 0.0267 0.0462 0.2537 ( 5120 PWs) bands (ev): -0.0282 -0.0282 -0.0282 -0.0282 6.4081 6.4081 6.4084 6.4084 7.2838 7.2838 7.2881 7.2881 7.4236 7.4236 7.4277 7.4277 8.5794 8.5794 8.5797 8.5797 8.6105 8.6105 8.6139 8.6139 8.6196 8.6196 8.6235 8.6235 9.4062 9.4062 9.4065 9.4065 9.4497 9.4497 9.4499 9.4499 10.0388 10.0388 10.0391 10.0391 10.1684 10.1684 10.1723 10.1723 10.1886 10.1886 10.1918 10.1918 11.5512 11.5512 11.5637 11.5637 11.6118 11.6118 11.6256 11.6256 12.5877 12.5877 12.5884 12.5884 12.9674 12.9674 12.9729 12.9729 13.0570 13.0570 13.0699 13.0699 14.1516 14.1516 k = 0.0200 0.0346 0.2537 ( 5116 PWs) bands (ev): -0.0364 -0.0364 -0.0364 -0.0364 6.4066 6.4066 6.4067 6.4067 7.2925 7.2925 7.2944 7.2944 7.4282 7.4282 7.4300 7.4300 8.5803 8.5803 8.5805 8.5805 8.6082 8.6082 8.6106 8.6106 8.6142 8.6142 8.6169 8.6169 9.4068 9.4068 9.4070 9.4070 9.4500 9.4500 9.4501 9.4501 10.0408 10.0408 10.0410 10.0410 10.1739 10.1739 10.1761 10.1761 10.1891 10.1891 10.1911 10.1911 11.5848 11.5848 11.5923 11.5923 11.6324 11.6324 11.6406 11.6406 12.6244 12.6244 12.6249 12.6249 12.9795 12.9795 12.9837 12.9837 13.0527 13.0527 13.0607 13.0607 14.1142 14.1142 k = 0.0133 0.0231 0.2537 ( 5112 PWs) bands (ev): -0.0423 -0.0423 -0.0423 -0.0423 6.4054 6.4054 6.4055 6.4055 7.2981 7.2981 7.2986 7.2986 7.4317 7.4317 7.4322 7.4322 8.5811 8.5811 8.5812 8.5812 8.6066 8.6066 8.6076 8.6076 8.6111 8.6111 8.6122 8.6122 9.4072 9.4072 9.4072 9.4072 9.4503 9.4503 9.4504 9.4504 10.0422 10.0422 10.0422 10.0422 10.1783 10.1783 10.1792 10.1792 10.1892 10.1892 10.1900 10.1900 11.6092 11.6092 11.6121 11.6121 11.6486 11.6486 11.6518 11.6518 12.6564 12.6564 12.6566 12.6566 12.9830 12.9830 12.9846 12.9846 13.0511 13.0511 13.0541 13.0541 14.0882 14.0882 k = 0.0067 0.0115 0.2537 ( 5112 PWs) bands (ev): -0.0458 -0.0458 -0.0458 -0.0458 6.4047 6.4047 6.4047 6.4047 7.3010 7.3010 7.3011 7.3011 7.4338 7.4338 7.4339 7.4339 8.5817 8.5817 8.5817 8.5817 8.6055 8.6055 8.6057 8.6057 8.6093 8.6093 8.6095 8.6095 9.4073 9.4073 9.4073 9.4073 9.4505 9.4505 9.4505 9.4505 10.0430 10.0430 10.0430 10.0430 10.1814 10.1814 10.1816 10.1816 10.1888 10.1888 10.1889 10.1889 11.6231 11.6231 11.6235 11.6235 11.6591 11.6591 11.6595 11.6595 12.6789 12.6789 12.6790 12.6790 12.9811 12.9811 12.9814 12.9814 13.0506 13.0506 13.0510 13.0510 14.0729 14.0729 k = 0.0000 0.0000 0.2537 ( 5100 PWs) bands (ev): -0.0470 -0.0470 -0.0470 -0.0470 6.4044 6.4044 6.4044 6.4044 7.3020 7.3020 7.3020 7.3020 7.4345 7.4345 7.4345 7.4345 8.5819 8.5819 8.5819 8.5819 8.6051 8.6051 8.6051 8.6051 8.6087 8.6087 8.6087 8.6087 9.4074 9.4074 9.4074 9.4074 9.4506 9.4506 9.4506 9.4506 10.0432 10.0432 10.0432 10.0432 10.1827 10.1827 10.1827 10.1827 10.1884 10.1884 10.1884 10.1884 11.6274 11.6274 11.6274 11.6274 11.6626 11.6626 11.6626 11.6626 12.6871 12.6871 12.6871 12.6871 12.9795 12.9795 12.9795 12.9795 13.0503 13.0503 13.0503 13.0503 14.0678 14.0678 k = 0.5000 0.2887 0.2537 ( 5124 PWs) bands (ev): 1.1882 1.1882 1.1882 1.1882 4.8724 4.8724 4.8724 4.8724 7.2771 7.2771 7.2771 7.2771 7.6075 7.6075 7.6075 7.6075 8.3551 8.3551 8.3551 8.3551 9.1279 9.1279 9.1279 9.1279 9.3091 9.3091 9.3091 9.3091 9.3954 9.3954 9.3954 9.3954 9.4646 9.4646 9.4646 9.4646 9.5932 9.5932 9.5932 9.5932 9.9037 9.9037 9.9037 9.9037 10.0448 10.0448 10.0448 10.0448 10.3068 10.3068 10.3068 10.3068 10.4485 10.4485 10.4485 10.4485 11.2728 11.2728 11.2728 11.2728 13.6001 13.6001 13.6001 13.6001 13.6661 13.6661 13.6661 13.6661 13.7349 13.7349 k = 0.5000 0.2887 0.2403 ( 5122 PWs) bands (ev): 1.1757 1.1757 1.2009 1.2009 4.8370 4.8370 4.9080 4.9080 7.2344 7.2344 7.3199 7.3199 7.5936 7.5936 7.6215 7.6215 8.3156 8.3156 8.3973 8.3973 9.1221 9.1221 9.1343 9.1343 9.3032 9.3032 9.3141 9.3141 9.3906 9.3906 9.3993 9.3993 9.4546 9.4546 9.4732 9.4732 9.5911 9.5911 9.5957 9.5957 9.8957 9.8957 9.9128 9.9128 10.0286 10.0286 10.0589 10.0589 10.3026 10.3026 10.3111 10.3111 10.4445 10.4445 10.4527 10.4527 11.2713 11.2713 11.2772 11.2772 13.5366 13.5366 13.6274 13.6274 13.6538 13.6538 13.6832 13.6832 13.7311 13.7311 k = 0.5000 0.2887 0.2270 ( 5132 PWs) bands (ev): 1.1634 1.1634 1.2137 1.2137 4.8023 4.8023 4.9437 4.9437 7.1922 7.1922 7.3624 7.3624 7.5800 7.5800 7.6355 7.6355 8.2793 8.2793 8.4417 8.4417 9.1166 9.1166 9.1409 9.1409 9.2966 9.2966 9.3176 9.3176 9.3852 9.3852 9.4024 9.4024 9.4433 9.4433 9.4801 9.4801 9.5896 9.5896 9.5982 9.5982 9.8885 9.8885 9.9232 9.9232 10.0106 10.0106 10.0708 10.0708 10.2985 10.2985 10.3157 10.3157 10.4408 10.4408 10.4571 10.4571 11.2725 11.2725 11.2842 11.2842 13.4656 13.4656 13.5860 13.5860 13.6756 13.6756 13.6824 13.6824 13.7493 13.7493 k = 0.5000 0.2887 0.2136 ( 5134 PWs) bands (ev): 1.1513 1.1513 1.2264 1.2264 4.7683 4.7683 4.9793 4.9793 7.1509 7.1509 7.4039 7.4039 7.5668 7.5668 7.6493 7.6493 8.2470 8.2470 8.4876 8.4876 9.1118 9.1118 9.1478 9.1478 9.2897 9.2897 9.3193 9.3193 9.3794 9.3794 9.4044 9.4044 9.4312 9.4312 9.4850 9.4850 9.5889 9.5889 9.6008 9.6008 9.8819 9.8819 9.9350 9.9350 9.9912 9.9912 10.0804 10.0804 10.2945 10.2945 10.3205 10.3205 10.4373 10.4373 10.4619 10.4619 11.2765 11.2765 11.2939 11.2939 13.3910 13.3910 13.5385 13.5385 13.6576 13.6576 13.6842 13.6842 13.7774 13.7774 k = 0.5000 0.2887 0.2003 ( 5142 PWs) bands (ev): 1.1397 1.1397 1.2389 1.2389 4.7353 4.7353 5.0145 5.0145 7.1108 7.1108 7.4436 7.4436 7.5541 7.5541 7.6629 7.6629 8.2196 8.2196 8.5347 8.5347 9.1074 9.1074 9.1548 9.1548 9.2826 9.2826 9.3182 9.3182 9.3735 9.3735 9.4052 9.4052 9.4189 9.4189 9.4878 9.4878 9.5892 9.5892 9.6032 9.6032 9.8752 9.8752 9.9478 9.9478 9.9715 9.9715 10.0879 10.0879 10.2907 10.2907 10.3255 10.3255 10.4339 10.4339 10.4668 10.4668 11.2831 11.2831 11.3061 11.3061 13.3152 13.3152 13.4881 13.4881 13.6095 13.6095 13.6830 13.6830 13.7839 13.7839 k = 0.5000 0.2887 0.1869 ( 5138 PWs) bands (ev): 1.1285 1.1285 1.2513 1.2513 4.7035 4.7035 5.0491 5.0491 7.0722 7.0722 7.4806 7.4806 7.5424 7.5424 7.6757 7.6757 8.1980 8.1980 8.5825 8.5825 9.1038 9.1038 9.1617 9.1617 9.2755 9.2755 9.3137 9.3137 9.3678 9.3678 9.4023 9.4023 9.4094 9.4094 9.4885 9.4885 9.5904 9.5904 9.6055 9.6055 9.8680 9.8680 9.9488 9.9488 9.9647 9.9647 10.0934 10.0934 10.2871 10.2871 10.3309 10.3309 10.4307 10.4307 10.4720 10.4720 11.2921 11.2921 11.3206 11.3206 13.2396 13.2396 13.4357 13.4357 13.5413 13.5413 13.6797 13.6797 13.7723 13.7723 k = 0.5000 0.2887 0.1736 ( 5128 PWs) bands (ev): 1.1177 1.1177 1.2634 1.2634 4.6730 4.6730 5.0827 5.0827 7.0352 7.0352 7.5109 7.5109 7.5350 7.5350 7.6876 7.6876 8.1832 8.1832 8.6305 8.6305 9.1007 9.1007 9.1682 9.1682 9.2686 9.2686 9.3052 9.3052 9.3619 9.3619 9.3922 9.3922 9.4074 9.4074 9.4873 9.4873 9.5926 9.5926 9.6078 9.6078 9.8597 9.8597 9.9308 9.9308 9.9789 9.9789 10.0975 10.0975 10.2837 10.2837 10.3363 10.3363 10.4276 10.4276 10.4775 10.4775 11.3033 11.3033 11.3371 11.3371 13.1656 13.1656 13.3819 13.3819 13.4659 13.4659 13.6755 13.6755 13.7679 13.7679 k = 0.5000 0.2887 0.1602 ( 5134 PWs) bands (ev): 1.1076 1.1076 1.2750 1.2750 4.6440 4.6440 5.1152 5.1152 7.0002 7.0002 7.5140 7.5140 7.5515 7.5515 7.6981 7.6981 8.1765 8.1765 8.6782 8.6782 9.0980 9.0980 9.1737 9.1737 9.2618 9.2618 9.2928 9.2928 9.3545 9.3545 9.3827 9.3827 9.4066 9.4066 9.4843 9.4843 9.5951 9.5951 9.6103 9.6103 9.8494 9.8494 9.9142 9.9142 9.9935 9.9935 10.1009 10.1009 10.2806 10.2806 10.3420 10.3420 10.4244 10.4244 10.4829 10.4829 11.3165 11.3165 11.3554 11.3554 13.0938 13.0938 13.3271 13.3271 13.3904 13.3904 13.6711 13.6711 13.7673 13.7673 k = 0.5000 0.2887 0.1469 ( 5132 PWs) bands (ev): 1.0980 1.0980 1.2862 1.2862 4.6167 4.6167 5.1462 5.1462 6.9672 6.9672 7.5050 7.5050 7.5764 7.5764 7.7067 7.7067 8.1787 8.1787 8.7252 8.7252 9.0958 9.0958 9.1774 9.1774 9.2551 9.2551 9.2773 9.2773 9.3448 9.3448 9.3764 9.3764 9.4058 9.4058 9.4799 9.4799 9.5974 9.5974 9.6137 9.6137 9.8369 9.8369 9.9008 9.9008 10.0065 10.0065 10.1049 10.1049 10.2779 10.2779 10.3476 10.3476 10.4211 10.4211 10.4884 10.4884 11.3313 11.3313 11.3752 11.3752 13.0251 13.0251 13.2716 13.2716 13.3178 13.3178 13.6666 13.6666 13.7683 13.7683 k = 0.5000 0.2887 0.1335 ( 5132 PWs) bands (ev): 1.0891 1.0891 1.2967 1.2967 4.5913 4.5913 5.1756 5.1756 6.9365 6.9365 7.4955 7.4955 7.5976 7.5976 7.7135 7.7135 8.1901 8.1901 8.7709 8.7709 9.0937 9.0937 9.1772 9.1772 9.2473 9.2473 9.2620 9.2620 9.3337 9.3337 9.3727 9.3727 9.4050 9.4050 9.4743 9.4743 9.5986 9.5986 9.6183 9.6183 9.8229 9.8229 9.8906 9.8906 10.0157 10.0157 10.1114 10.1114 10.2756 10.2756 10.3533 10.3533 10.4176 10.4176 10.4938 10.4938 11.3474 11.3474 11.3961 11.3961 12.9598 12.9598 13.2155 13.2155 13.2500 13.2500 13.6623 13.6623 13.7701 13.7701 k = 0.5000 0.2887 0.1202 ( 5130 PWs) bands (ev): 1.0809 1.0809 1.3066 1.3066 4.5679 4.5679 5.2030 5.2030 6.9082 6.9082 7.4866 7.4866 7.6141 7.6141 7.7186 7.7186 8.2105 8.2105 8.8147 8.8147 9.0911 9.0911 9.1693 9.1693 9.2375 9.2375 9.2526 9.2526 9.3225 9.3225 9.3706 9.3706 9.4043 9.4043 9.4678 9.4678 9.5988 9.5988 9.6241 9.6241 9.8085 9.8085 9.8827 9.8827 10.0195 10.0195 10.1219 10.1219 10.2738 10.2738 10.3589 10.3589 10.4139 10.4139 10.4990 10.4990 11.3644 11.3644 11.4177 11.4177 12.8987 12.8987 13.1590 13.1590 13.1884 13.1884 13.6582 13.6582 13.7721 13.7721 k = 0.5000 0.2887 0.1068 ( 5126 PWs) bands (ev): 1.0735 1.0735 1.3157 1.3157 4.5466 4.5466 5.2283 5.2283 6.8826 6.8826 7.4783 7.4783 7.6257 7.6257 7.7228 7.7228 8.2389 8.2389 8.8561 8.8561 9.0865 9.0865 9.1513 9.1513 9.2303 9.2303 9.2482 9.2482 9.3120 9.3120 9.3694 9.3694 9.4036 9.4036 9.4608 9.4608 9.5980 9.5980 9.6310 9.6310 9.7948 9.7948 9.8765 9.8765 10.0180 10.0180 10.1362 10.1362 10.2722 10.2722 10.3642 10.3642 10.4099 10.4099 10.5040 10.5040 11.3819 11.3819 11.4395 11.4395 12.8420 12.8420 13.1034 13.1034 13.1332 13.1332 13.6544 13.6544 13.7742 13.7742 k = 0.5000 0.2887 0.0935 ( 5122 PWs) bands (ev): 1.0669 1.0669 1.3239 1.3239 4.5275 4.5275 5.2512 5.2512 6.8596 6.8596 7.4710 7.4710 7.6327 7.6327 7.7268 7.7268 8.2741 8.2741 8.8944 8.8944 9.0749 9.0749 9.1301 9.1301 9.2269 9.2269 9.2467 9.2467 9.3025 9.3025 9.3690 9.3690 9.4028 9.4028 9.4536 9.4536 9.5963 9.5963 9.6385 9.6385 9.7823 9.7823 9.8714 9.8714 10.0123 10.0123 10.1531 10.1531 10.2710 10.2710 10.3692 10.3692 10.4056 10.4056 10.5087 10.5087 11.3993 11.3993 11.4610 11.4610 12.7903 12.7903 13.0508 13.0508 13.0836 13.0836 13.6509 13.6509 13.7762 13.7762 k = 0.5000 0.2887 0.0801 ( 5130 PWs) bands (ev): 1.0611 1.0611 1.3313 1.3313 4.5107 4.5107 5.2714 5.2714 6.8394 6.8394 7.4645 7.4645 7.6358 7.6358 7.7307 7.7307 8.3143 8.3143 8.9288 8.9288 9.0492 9.0492 9.1168 9.1168 9.2248 9.2248 9.2472 9.2472 9.2940 9.2940 9.3693 9.3693 9.4019 9.4019 9.4465 9.4465 9.5940 9.5940 9.6466 9.6466 9.7714 9.7714 9.8671 9.8671 10.0041 10.0041 10.1713 10.1713 10.2700 10.2700 10.3737 10.3737 10.4010 10.4010 10.5129 10.5129 11.4161 11.4161 11.4816 11.4816 12.7440 12.7440 13.0030 13.0030 13.0390 13.0390 13.6478 13.6478 13.7780 13.7780 k = 0.5000 0.2887 0.0668 ( 5134 PWs) bands (ev): 1.0561 1.0561 1.3376 1.3376 4.4963 4.4963 5.2890 5.2890 6.8222 6.8222 7.4589 7.4589 7.6362 7.6362 7.7348 7.7348 8.3579 8.3579 8.9579 8.9579 9.0129 9.0129 9.1118 9.1118 9.2230 9.2230 9.2491 9.2491 9.2867 9.2867 9.3703 9.3703 9.4009 9.4009 9.4398 9.4398 9.5914 9.5914 9.6550 9.6550 9.7618 9.7618 9.8635 9.8635 9.9946 9.9946 10.1894 10.1894 10.2690 10.2690 10.3778 10.3778 10.3961 10.3961 10.5166 10.5166 11.4318 11.4318 11.5007 11.5007 12.7036 12.7036 12.9611 12.9611 12.9998 12.9998 13.6451 13.6451 13.7795 13.7795 k = 0.5000 0.2887 0.0534 ( 5134 PWs) bands (ev): 1.0520 1.0520 1.3428 1.3428 4.4845 4.4845 5.3035 5.3035 6.8080 6.8080 7.4543 7.4543 7.6350 7.6350 7.7386 7.7386 8.4029 8.4029 8.9614 8.9614 8.9925 8.9925 9.1102 9.1102 9.2213 9.2213 9.2516 9.2516 9.2805 9.2805 9.3718 9.3718 9.3998 9.3998 9.4338 9.4338 9.5888 9.5888 9.6635 9.6635 9.7536 9.7536 9.8606 9.8606 9.9851 9.9851 10.2066 10.2066 10.2680 10.2680 10.3811 10.3811 10.3912 10.3912 10.5198 10.5198 11.4457 11.4457 11.5176 11.5176 12.6696 12.6696 12.9258 12.9258 12.9665 12.9665 13.6428 13.6428 13.7809 13.7809 k = 0.5000 0.2887 0.0401 ( 5126 PWs) bands (ev): 1.0488 1.0488 1.3470 1.3470 4.4752 4.4752 5.3150 5.3150 6.7969 6.7969 7.4507 7.4507 7.6331 7.6331 7.7419 7.7419 8.4468 8.4468 8.9227 8.9227 9.0090 9.0090 9.1098 9.1098 9.2199 9.2199 9.2541 9.2541 9.2754 9.2754 9.3736 9.3736 9.3986 9.3986 9.4288 9.4288 9.5863 9.5863 9.6719 9.6719 9.7463 9.7463 9.8583 9.8583 9.9765 9.9765 10.2222 10.2222 10.2666 10.2666 10.3833 10.3833 10.3870 10.3870 10.5223 10.5223 11.4572 11.4572 11.5317 11.5317 12.6425 12.6425 12.8978 12.8978 12.9397 12.9397 13.6410 13.6410 13.7819 13.7819 k = 0.5000 0.2887 0.0267 ( 5122 PWs) bands (ev): 1.0465 1.0465 1.3500 1.3500 4.4685 4.4685 5.3233 5.3233 6.7889 6.7889 7.4481 7.4481 7.6313 7.6313 7.7443 7.7443 8.4859 8.4859 8.8848 8.8848 9.0233 9.0233 9.1099 9.1099 9.2188 9.2188 9.2565 9.2565 9.2713 9.2713 9.3755 9.3755 9.3975 9.3975 9.4251 9.4251 9.5844 9.5844 9.6794 9.6794 9.7402 9.7402 9.8566 9.8566 9.9696 9.9696 10.2354 10.2354 10.2645 10.2645 10.3815 10.3815 10.3867 10.3867 10.5241 10.5241 11.4659 11.4659 11.5423 11.5423 12.6228 12.6228 12.8774 12.8774 12.9201 12.9201 13.6397 13.6397 13.7826 13.7826 k = 0.5000 0.2887 0.0134 ( 5122 PWs) bands (ev): 1.0451 1.0451 1.3518 1.3518 4.4645 4.4645 5.3283 5.3283 6.7841 6.7841 7.4466 7.4466 7.6301 7.6301 7.7459 7.7459 8.5145 8.5145 8.8567 8.8567 9.0321 9.0321 9.1100 9.1100 9.2182 9.2182 9.2584 9.2584 9.2685 9.2685 9.3770 9.3770 9.3965 9.3965 9.4227 9.4227 9.5831 9.5831 9.6849 9.6849 9.7357 9.7357 9.8555 9.8555 9.9651 9.9651 10.2455 10.2455 10.2616 10.2616 10.3789 10.3789 10.3877 10.3877 10.5253 10.5253 11.4714 11.4714 11.5488 11.5488 12.6108 12.6108 12.8649 12.8649 12.9081 12.9081 13.6390 13.6390 13.7831 13.7831 k = 0.5000 0.2887-0.0000 ( 5128 PWs) bands (ev): 1.0446 1.0446 1.3524 1.3524 4.4632 4.4632 5.3299 5.3299 6.7825 6.7825 7.4460 7.4460 7.6296 7.6296 7.7464 7.7464 8.5253 8.5253 8.8460 8.8460 9.0351 9.0351 9.1101 9.1101 9.2180 9.2180 9.2592 9.2592 9.2673 9.2673 9.3775 9.3775 9.3962 9.3962 9.4219 9.4219 9.5826 9.5826 9.6870 9.6870 9.7340 9.7340 9.8552 9.8552 9.9636 9.9636 10.2505 10.2505 10.2591 10.2591 10.3779 10.3779 10.3881 10.3881 10.5256 10.5256 11.4732 11.4732 11.5511 11.5511 12.6068 12.6068 12.8608 12.8608 12.9041 12.9041 13.6387 13.6387 13.7832 13.7832 k = 0.3333 0.5774-0.0000 ( 5187 PWs) bands (ev): 1.2334 1.2334 1.5211 1.5211 5.3506 5.3506 5.4872 5.4872 5.8343 5.8343 6.0313 6.0313 7.0130 7.0130 8.7042 8.7042 8.7283 8.7283 8.7413 8.7413 8.8874 8.8874 9.1822 9.1822 9.2178 9.2178 9.2842 9.2842 9.3161 9.3161 9.4165 9.4165 9.4616 9.4616 9.4701 9.4701 9.5792 9.5792 9.6262 9.6262 9.7300 9.7300 10.0270 10.0270 10.0562 10.0562 10.0949 10.0949 10.1233 10.1233 10.1644 10.1644 10.5552 10.5552 10.6043 10.6043 11.0594 11.0594 11.2710 11.2710 13.1966 13.1966 13.2569 13.2569 13.2635 13.2635 13.4443 13.4443 13.4516 13.4516 k = 0.3333 0.5774 0.0134 ( 5181 PWs) bands (ev): 1.2338 1.2338 1.5206 1.5206 5.3510 5.3510 5.4878 5.4878 5.8340 5.8340 6.0308 6.0308 7.0150 7.0150 8.6896 8.6896 8.7273 8.7273 8.7412 8.7412 8.9010 8.9010 9.1815 9.1815 9.2164 9.2164 9.2800 9.2800 9.3194 9.3194 9.4156 9.4156 9.4636 9.4636 9.4671 9.4671 9.5820 9.5820 9.6257 9.6257 9.7301 9.7301 10.0171 10.0171 10.0490 10.0490 10.1034 10.1034 10.1308 10.1308 10.1655 10.1655 10.5578 10.5578 10.6061 10.6061 11.0596 11.0596 11.2703 11.2703 13.1990 13.1990 13.2569 13.2569 13.2638 13.2638 13.4407 13.4407 13.4479 13.4479 k = 0.3333 0.5774 0.0267 ( 5169 PWs) bands (ev): 1.2351 1.2351 1.5189 1.5189 5.3523 5.3523 5.4896 5.4896 5.8333 5.8333 6.0293 6.0293 7.0208 7.0208 8.6529 8.6529 8.7262 8.7262 8.7405 8.7405 8.9328 8.9328 9.1793 9.1793 9.2121 9.2121 9.2708 9.2708 9.3264 9.3264 9.4135 9.4135 9.4593 9.4593 9.4690 9.4690 9.5894 9.5894 9.6242 9.6242 9.7302 9.7302 9.9962 9.9962 10.0330 10.0330 10.1184 10.1184 10.1473 10.1473 10.1704 10.1704 10.5657 10.5657 10.6114 10.6114 11.0600 11.0600 11.2681 11.2681 13.2062 13.2062 13.2571 13.2571 13.2645 13.2645 13.4303 13.4303 13.4374 13.4374 k = 0.3333 0.5774 0.0401 ( 5148 PWs) bands (ev): 1.2373 1.2373 1.5162 1.5162 5.3543 5.3543 5.4926 5.4926 5.8321 5.8321 6.0268 6.0268 7.0306 7.0306 8.6052 8.6052 8.7252 8.7252 8.7394 8.7394 8.9714 8.9714 9.1751 9.1751 9.2051 9.2051 9.2606 9.2606 9.3340 9.3340 9.4111 9.4111 9.4487 9.4487 9.4766 9.4766 9.5996 9.5996 9.6217 9.6217 9.7305 9.7305 9.9725 9.9725 10.0147 10.0147 10.1276 10.1276 10.1662 10.1662 10.1826 10.1826 10.5787 10.5787 10.6205 10.6205 11.0608 11.0608 11.2646 11.2646 13.2181 13.2181 13.2569 13.2569 13.2654 13.2654 13.4141 13.4141 13.4210 13.4210 k = 0.3333 0.5774 0.0534 ( 5142 PWs) bands (ev): 1.2404 1.2404 1.5124 1.5124 5.3571 5.3571 5.4967 5.4967 5.8305 5.8305 6.0234 6.0234 7.0441 7.0441 8.5521 8.5521 8.7238 8.7238 8.7378 8.7378 9.0111 9.0111 9.1681 9.1681 9.1953 9.1953 9.2518 9.2518 9.3413 9.3413 9.4092 9.4092 9.4373 9.4373 9.4854 9.4854 9.6110 9.6110 9.6183 9.6183 9.7309 9.7309 9.9490 9.9490 9.9963 9.9963 10.1288 10.1288 10.1846 10.1846 10.2013 10.2013 10.5970 10.5970 10.6334 10.6334 11.0618 11.0618 11.2598 11.2598 13.2341 13.2341 13.2556 13.2556 13.2656 13.2656 13.3938 13.3938 13.4007 13.4007 k = 0.3333 0.5774 0.0668 ( 5151 PWs) bands (ev): 1.2443 1.2443 1.5076 1.5076 5.3606 5.3606 5.5019 5.5019 5.8284 5.8284 6.0191 6.0191 7.0614 7.0614 8.4958 8.4958 8.7221 8.7221 8.7357 8.7357 9.0493 9.0493 9.1583 9.1583 9.1830 9.1830 9.2457 9.2457 9.3479 9.3479 9.4081 9.4081 9.4263 9.4263 9.4949 9.4949 9.6140 9.6140 9.6227 9.6227 9.7318 9.7318 9.9265 9.9265 9.9787 9.9787 10.1249 10.1249 10.2013 10.2013 10.2220 10.2220 10.6202 10.6202 10.6501 10.6501 11.0631 11.0631 11.2538 11.2538 13.2514 13.2514 13.2536 13.2536 13.2634 13.2634 13.3719 13.3719 13.3796 13.3796 k = 0.3333 0.5774 0.0801 ( 5154 PWs) bands (ev): 1.2490 1.2490 1.5018 1.5018 5.3647 5.3647 5.5080 5.5080 5.8259 5.8259 6.0139 6.0139 7.0825 7.0825 8.4373 8.4373 8.7200 8.7200 8.7331 8.7331 9.0829 9.0829 9.1476 9.1476 9.1687 9.1687 9.2431 9.2431 9.3538 9.3538 9.4081 9.4081 9.4164 9.4164 9.5045 9.5045 9.6089 9.6089 9.6341 9.6341 9.7330 9.7330 9.9055 9.9055 9.9622 9.9622 10.1181 10.1181 10.2157 10.2157 10.2417 10.2417 10.6480 10.6480 10.6707 10.6707 11.0647 11.0647 11.2469 11.2469 13.2416 13.2416 13.2554 13.2554 13.2752 13.2752 13.3522 13.3522 13.3634 13.3634 k = 0.3333 0.5774 0.0935 ( 5151 PWs) bands (ev): 1.2545 1.2545 1.4951 1.4951 5.3694 5.3694 5.5150 5.5150 5.8231 5.8231 6.0080 6.0080 7.1071 7.1071 8.3774 8.3774 8.7175 8.7175 8.7299 8.7299 9.1022 9.1022 9.1454 9.1454 9.1528 9.1528 9.2442 9.2442 9.3590 9.3590 9.4079 9.4079 9.4092 9.4092 9.5141 9.5141 9.6032 9.6032 9.6450 9.6450 9.7349 9.7349 9.8863 9.8863 9.9470 9.9470 10.1093 10.1093 10.2277 10.2277 10.2592 10.2592 10.6797 10.6797 10.6948 10.6948 11.0666 11.0666 11.2391 11.2391 13.2233 13.2233 13.2382 13.2382 13.2957 13.2957 13.3386 13.3386 13.3592 13.3592 k = 0.3333 0.5774 0.1068 ( 5157 PWs) bands (ev): 1.2609 1.2609 1.4876 1.4876 5.3745 5.3745 5.5228 5.5228 5.8200 5.8200 6.0015 6.0015 7.1352 7.1352 8.3163 8.3163 8.7145 8.7145 8.7263 8.7263 9.0964 9.0964 9.1361 9.1361 9.1624 9.1624 9.2491 9.2491 9.3636 9.3636 9.4008 9.4008 9.4114 9.4114 9.5233 9.5233 9.5971 9.5971 9.6553 9.6553 9.7375 9.7375 9.8690 9.8690 9.9329 9.9329 10.0987 10.0987 10.2373 10.2373 10.2740 10.2740 10.7144 10.7144 10.7218 10.7218 11.0688 11.0688 11.2308 11.2308 13.1965 13.1965 13.2119 13.2119 13.3104 13.3104 13.3321 13.3321 13.3720 13.3720 k = 0.3333 0.5774 0.1202 ( 5148 PWs) bands (ev): 1.2679 1.2679 1.4792 1.4792 5.3799 5.3799 5.5311 5.5311 5.8167 5.8167 5.9944 5.9944 7.1668 7.1668 8.2543 8.2543 8.7112 8.7112 8.7222 8.7222 9.0815 9.0815 9.1192 9.1192 9.1824 9.1824 9.2583 9.2583 9.3675 9.3675 9.3951 9.3951 9.4147 9.4147 9.5322 9.5322 9.5907 9.5907 9.6649 9.6649 9.7408 9.7408 9.8538 9.8538 9.9200 9.9200 10.0867 10.0867 10.2450 10.2450 10.2863 10.2863 10.7510 10.7510 10.7510 10.7510 11.0713 11.0713 11.2219 11.2219 13.1639 13.1639 13.1799 13.1799 13.3194 13.3194 13.3307 13.3307 13.3987 13.3987 k = 0.3333 0.5774 0.1335 ( 5148 PWs) bands (ev): 1.2757 1.2757 1.4701 1.4701 5.3855 5.3855 5.5399 5.5399 5.8132 5.8132 5.9869 5.9869 7.2017 7.2017 8.1917 8.1917 8.7075 8.7075 8.7176 8.7176 9.0651 9.0651 9.1028 9.1028 9.1977 9.1977 9.2716 9.2716 9.3708 9.3708 9.3905 9.3905 9.4187 9.4187 9.5403 9.5403 9.5844 9.5844 9.6739 9.6739 9.7448 9.7448 9.8410 9.8410 9.9082 9.9082 10.0732 10.0732 10.2508 10.2508 10.2961 10.2961 10.7815 10.7815 10.7885 10.7885 11.0741 11.0741 11.2129 11.2129 13.1284 13.1284 13.1455 13.1455 13.3264 13.3264 13.3323 13.3323 13.4326 13.4326 k = 0.3333 0.5774 0.1469 ( 5154 PWs) bands (ev): 1.2841 1.2841 1.4604 1.4604 5.3912 5.3912 5.5489 5.5489 5.8096 5.8096 5.9792 5.9792 7.2396 7.2396 8.1288 8.1288 8.7034 8.7034 8.7128 8.7128 9.0491 9.0491 9.0873 9.0873 9.2082 9.2082 9.2873 9.2873 9.3738 9.3738 9.3869 9.3869 9.4232 9.4232 9.5472 9.5472 9.5788 9.5788 9.6822 9.6822 9.7492 9.7492 9.8311 9.8311 9.8975 9.8975 10.0584 10.0584 10.2552 10.2552 10.3038 10.3038 10.8122 10.8122 10.8257 10.8257 11.0772 11.0772 11.2037 11.2037 13.0922 13.0922 13.1109 13.1109 13.3327 13.3327 13.3353 13.3353 13.4702 13.4702 k = 0.3333 0.5774 0.1602 ( 5154 PWs) bands (ev): 1.2932 1.2932 1.4501 1.4501 5.3967 5.3967 5.5578 5.5578 5.8060 5.8060 5.9714 5.9714 7.2806 7.2806 8.0657 8.0657 8.6993 8.6993 8.7078 8.7078 9.0344 9.0344 9.0731 9.0731 9.2155 9.2155 9.3032 9.3032 9.3765 9.3765 9.3841 9.3841 9.4279 9.4279 9.5519 9.5519 9.5750 9.5750 9.6898 9.6898 9.7530 9.7530 9.8253 9.8253 9.8878 9.8878 10.0424 10.0424 10.2585 10.2585 10.3098 10.3098 10.8422 10.8422 10.8617 10.8617 11.0806 11.0806 11.1946 11.1946 13.0570 13.0570 13.0774 13.0774 13.3388 13.3388 13.3390 13.3390 13.5102 13.5102 k = 0.3333 0.5774 0.1736 ( 5154 PWs) bands (ev): 1.3028 1.3028 1.4394 1.4394 5.4019 5.4019 5.5664 5.5664 5.8026 5.8026 5.9639 5.9639 7.3243 7.3243 8.0027 8.0027 8.6950 8.6950 8.7029 8.7029 9.0214 9.0214 9.0607 9.0607 9.2209 9.2209 9.3176 9.3176 9.3791 9.3791 9.3819 9.3819 9.4326 9.4326 9.5526 9.5526 9.5748 9.5748 9.6967 9.6967 9.7550 9.7550 9.8245 9.8245 9.8790 9.8790 10.0253 10.0253 10.2609 10.2609 10.3143 10.3143 10.8705 10.8705 10.8954 10.8954 11.0843 11.0843 11.1857 11.1857 13.0238 13.0238 13.0461 13.0461 13.3429 13.3429 13.3443 13.3443 13.5516 13.5516 k = 0.3333 0.5774 0.1869 ( 5142 PWs) bands (ev): 1.3129 1.3129 1.4282 1.4282 5.4067 5.4067 5.5745 5.5745 5.7995 5.7995 5.9568 5.9568 7.3708 7.3708 7.9400 7.9400 8.6910 8.6910 8.6982 8.6982 9.0103 9.0103 9.0501 9.0501 9.2252 9.2252 9.3298 9.3298 9.3802 9.3802 9.3816 9.3816 9.4370 9.4370 9.5500 9.5500 9.5778 9.5778 9.7029 9.7029 9.7547 9.7547 9.8297 9.8297 9.8714 9.8714 10.0072 10.0072 10.2626 10.2626 10.3177 10.3177 10.8962 10.8962 10.9259 10.9259 11.0882 11.0882 11.1772 11.1772 12.9937 12.9937 13.0180 13.0180 13.3467 13.3467 13.3494 13.3494 13.5937 13.5937 k = 0.3333 0.5774 0.2003 ( 5145 PWs) bands (ev): 1.3235 1.3235 1.4168 1.4168 5.4109 5.4109 5.5817 5.5817 5.7967 5.7967 5.9505 5.9505 7.4196 7.4196 7.8777 7.8777 8.6873 8.6873 8.6939 8.6939 9.0012 9.0012 9.0414 9.0414 9.2286 9.2286 9.3393 9.3393 9.3790 9.3790 9.3838 9.3838 9.4409 9.4409 9.5463 9.5463 9.5817 9.5817 9.7082 9.7082 9.7525 9.7525 9.8399 9.8399 9.8649 9.8649 9.9883 9.9883 10.2639 10.2639 10.3202 10.3202 10.9186 10.9186 10.9523 10.9523 11.0921 11.0921 11.1693 11.1693 12.9677 12.9677 12.9938 12.9939 13.3500 13.3500 13.3537 13.3537 13.6359 13.6359 k = 0.3333 0.5774 0.2136 ( 5148 PWs) bands (ev): 1.3344 1.3344 1.4051 1.4051 5.4144 5.4144 5.5877 5.5877 5.7944 5.7944 5.9451 5.9451 7.4707 7.4707 7.8162 7.8162 8.6842 8.6842 8.6903 8.6903 8.9941 8.9941 9.0347 9.0347 9.2313 9.2313 9.3464 9.3464 9.3781 9.3781 9.3857 9.3857 9.4442 9.4442 9.5426 9.5426 9.5853 9.5853 9.7126 9.7126 9.7496 9.7496 9.8540 9.8540 9.8595 9.8595 9.9688 9.9688 10.2647 10.2647 10.3220 10.3220 10.9368 10.9368 10.9737 10.9737 11.0960 11.0960 11.1623 11.1623 12.9466 12.9466 12.9743 12.9743 13.3527 13.3527 13.3571 13.3571 13.6774 13.6774 k = 0.3333 0.5774 0.2270 ( 5127 PWs) bands (ev): 1.3456 1.3456 1.3934 1.3934 5.4169 5.4169 5.5922 5.5922 5.7927 5.7927 5.9411 5.9411 7.5237 7.5237 7.7557 7.7557 8.6819 8.6819 8.6877 8.6877 8.9891 8.9891 9.0299 9.0299 9.2332 9.2332 9.3513 9.3513 9.3774 9.3774 9.3872 9.3872 9.4467 9.4467 9.5398 9.5398 9.5882 9.5882 9.7159 9.7159 9.7470 9.7470 9.8556 9.8556 9.8707 9.8707 9.9489 9.9489 10.2653 10.2653 10.3232 10.3232 10.9503 10.9503 10.9896 10.9896 11.0994 11.0994 11.1566 11.1566 12.9310 12.9310 12.9599 12.9599 13.3548 13.3548 13.3597 13.3597 13.7172 13.7172 k = 0.3333 0.5774 0.2403 ( 5118 PWs) bands (ev): 1.3569 1.3569 1.3817 1.3817 5.4185 5.4185 5.5951 5.5951 5.7917 5.7917 5.9386 5.9386 7.5782 7.5782 7.6968 7.6968 8.6804 8.6804 8.6860 8.6860 8.9861 8.9861 9.0271 9.0271 9.2344 9.2344 9.3542 9.3542 9.3771 9.3771 9.3881 9.3881 9.4482 9.4482 9.5380 9.5380 9.5900 9.5900 9.7179 9.7179 9.7452 9.7452 9.8532 9.8532 9.8891 9.8891 9.9288 9.9288 10.2656 10.2656 10.3239 10.3239 10.9586 10.9586 10.9993 10.9993 11.1019 11.1019 11.1527 11.1527 12.9214 12.9214 12.9511 12.9511 13.3560 13.3560 13.3613 13.3613 13.7524 13.7524 k = 0.3333 0.5774 0.2537 ( 5106 PWs) bands (ev): 1.3655 1.3655 1.3731 1.3731 5.4190 5.4190 5.5960 5.5960 5.7913 5.7913 5.9377 5.9377 7.6229 7.6229 7.6505 7.6505 8.6799 8.6799 8.6855 8.6855 8.9851 8.9851 9.0261 9.0261 9.2349 9.2349 9.3551 9.3551 9.3770 9.3770 9.3885 9.3885 9.4488 9.4488 9.5374 9.5374 9.5906 9.5906 9.7187 9.7187 9.7446 9.7446 9.8524 9.8524 9.9062 9.9062 9.9112 9.9112 10.2657 10.2657 10.3241 10.3241 10.9614 10.9614 11.0026 11.0026 11.1028 11.1028 11.1513 11.1513 12.9182 12.9182 12.9481 12.9482 13.3565 13.3565 13.3618 13.3618 13.7703 13.7703 Writing output data file ZrNi2Sb.save init_run : 0.26s CPU 0.38s WALL ( 1 calls) electrons : 273.99s CPU 277.76s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 273.98s CPU 277.75s 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 : 0.09s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.11s WALL ( 304 calls) cegterg : 249.65s CPU 252.58s WALL ( 464 calls) Called by sum_band: Called by *egterg: h_psi : 131.54s CPU 133.70s WALL ( 7132 calls) s_psi : 15.11s CPU 14.81s WALL ( 7132 calls) g_psi : 0.49s CPU 0.47s WALL ( 6364 calls) cdiaghg : 85.66s CPU 86.88s WALL ( 6668 calls) cegterg:over : 14.24s CPU 14.35s WALL ( 6364 calls) cegterg:upda : 11.41s CPU 11.40s WALL ( 6364 calls) cegterg:last : 6.61s CPU 6.60s WALL ( 1397 calls) cdiaghg:chol : 5.02s CPU 5.06s WALL ( 6668 calls) cdiaghg:inve : 3.45s CPU 3.67s WALL ( 6668 calls) cdiaghg:para : 6.48s CPU 6.34s WALL ( 13336 calls) Called by h_psi: h_psi:vloc : 97.77s CPU 99.77s WALL ( 7132 calls) h_psi:vnl : 33.25s CPU 33.46s WALL ( 7132 calls) add_vuspsi : 18.30s CPU 18.29s WALL ( 7132 calls) General routines calbec : 14.90s CPU 15.14s WALL ( 7132 calls) fft : 0.02s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 91.76s CPU 93.72s WALL ( 1282828 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.30s WALL ( 608 calls) Parallel routines fft_scatter : 37.68s CPU 38.87s WALL ( 1282851 calls) PWSCF : 4m55.81s CPU 5m20.69s WALL This run was terminated on: 21: 1: 1 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=