Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 16:50:42 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CuTe2.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 40 31 9 1660 1132 168 Max 41 32 11 1667 1150 173 Sum 2941 2285 657 119825 82057 12293 bravais-lattice index = 14 lattice parameter (alat) = 12.4820 a.u. unit-cell volume = 1944.7081 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 92.00 number of Kohn-Sham states= 110 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 237.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.482018 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.000000 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.000000 ) PseudoPot. # 1 for Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Te 6.00 127.60000 Te( 1.00) Cu 11.00 63.54600 Cu( 1.00) 24 Sym. Ops., with inversion, found (18 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 120 deg rotation - cart. axis [-1,-1,-1] cryst. s( 5) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 6 120 deg rotation - cart. axis [-1,1,1] cryst. s( 6) = ( 0 0 -1 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) f =( -0.5000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) isym = 9 120 deg rotation - cart. axis [1,1,1] cryst. s( 9) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 10 120 deg rotation - cart. axis [-1,1,-1] cryst. s(10) = ( 0 -1 0 ) f =( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) f =( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) f =( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) 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 =( -0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 17 inv. 120 deg rotation - cart. axis [-1,-1,-1] cryst. s(17) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(17) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 18 inv. 120 deg rotation - cart. axis [-1,1,1] cryst. s(18) = ( 0 0 1 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) cart. s(18) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) isym = 19 inv. 120 deg rotation - cart. axis [1,1,-1] cryst. s(19) = ( 0 0 1 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) cart. s(19) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) isym = 20 inv. 120 deg rotation - cart. axis [1,-1,1] cryst. s(20) = ( 0 0 -1 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) cart. s(20) = ( -0.0000000 1.0000000 0.0000000 ) f =( -0.5000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) isym = 21 inv. 120 deg rotation - cart. axis [1,1,1] cryst. s(21) = ( 0 -1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(21) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 22 inv. 120 deg rotation - cart. axis [-1,1,-1] cryst. s(22) = ( 0 1 0 ) f =( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) cart. s(22) = ( 0.0000000 0.0000000 -1.0000000 ) f =( -0.5000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) isym = 23 inv. 120 deg rotation - cart. axis [1,-1,-1] cryst. s(23) = ( 0 1 0 ) f =( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) cart. s(23) = ( 0.0000000 -0.0000000 1.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) isym = 24 inv. 120 deg rotation - cart. axis [-1,-1,1] cryst. s(24) = ( 0 -1 0 ) f =( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) cart. s(24) = ( -0.0000000 0.0000000 1.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) double point group T_h (m-3) there are 14 classes and 6 irreducible representations the character table: E -E 3C2 4C3 -4C3 4C3' -4C3' i -i 3s_h 4S6' -4S6' -3C2 -3s_h G_5+ 2.00 -2.00 0.00 1.00 -1.00 1.00 -1.00 2.00 -2.00 0.00 1.00 -1.00 G_6+ 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 2.00 -2.00 0.00 -0.50 0.50 G_7+ 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 2.00 -2.00 0.00 -0.50 0.50 G_5- 2.00 -2.00 0.00 1.00 -1.00 1.00 -1.00 -2.00 2.00 0.00 -1.00 1.00 G_6- 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 -2.00 2.00 0.00 0.50 -0.50 G_7- 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 -2.00 2.00 0.00 0.50 -0.50 4S6 -4S6 G_5+ 1.00 -1.00 G_6+ -0.50 0.50 G_7+ -0.50 0.50 G_5- -1.00 1.00 G_6- 0.50 -0.50 G_7- 0.50 -0.50 imaginary part E -E 3C2 4C3 -4C3 4C3' -4C3' i -i 3s_h 4S6' -4S6' -3C2 -3s_h G_5+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_6+ 0.00 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 0.00 0.87 -0.87 G_7+ 0.00 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 0.00 -0.87 0.87 G_5- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_6- 0.00 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 0.00 -0.87 0.87 G_7- 0.00 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 0.00 0.87 -0.87 4S6 -4S6 G_5+ 0.00 0.00 G_6+ -0.87 0.87 G_7+ 0.87 -0.87 G_5- 0.00 0.00 G_6- 0.87 -0.87 G_7- -0.87 0.87 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 3C2 -3C2 2 -2 3 -3 4 -4 180 deg rotation - cart. axis [0,0,1] 4C3 9 12 10 11 120 deg rotation - cart. axis [1,1,1] -4C3 -9 -12 -10 -11 120 deg rotation - cart. axis [1,1,1] E 4C3' 5 7 8 6 120 deg rotation - cart. axis [-1,-1,-1] -4C3' -5 -7 -8 -6 120 deg rotation - cart. axis [-1,-1,-1] E i 13 inversion -i -13 inversion E 3s_h-3s_h 14 -14 15 -15 16 -16 inv. 180 deg rotation - cart. axis [0,0,1] 4S6' 21 24 22 23 inv. 120 deg rotation - cart. axis [1,1,1] -4S6' -21 -24 -22 -23 inv. 120 deg rotation - cart. axis [1,1,1] E 4S6 17 19 20 18 inv. 120 deg rotation - cart. axis [-1,-1,-1] -4S6 -17 -19 -20 -18 inv. 120 deg rotation - cart. axis [-1,-1,-1] E Cartesian axes number of k points= 188 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 2) = ( 0.0000000 0.0208333 -0.0000000), wk = 0.0053191 k( 3) = ( 0.0000000 0.0416667 -0.0000000), wk = 0.0053191 k( 4) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0053191 k( 5) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0053191 k( 6) = ( 0.0000000 0.1041667 -0.0000000), wk = 0.0053191 k( 7) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0053191 k( 8) = ( 0.0000000 0.1458333 -0.0000000), wk = 0.0053191 k( 9) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0053191 k( 10) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0053191 k( 11) = ( 0.0000000 0.2083333 -0.0000000), wk = 0.0053191 k( 12) = ( 0.0000000 0.2291667 -0.0000000), wk = 0.0053191 k( 13) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0053191 k( 14) = ( 0.0000000 0.2708333 -0.0000000), wk = 0.0053191 k( 15) = ( 0.0000000 0.2916667 -0.0000000), wk = 0.0053191 k( 16) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0053191 k( 17) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0053191 k( 18) = ( 0.0000000 0.3541667 -0.0000000), wk = 0.0053191 k( 19) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0053191 k( 20) = ( 0.0000000 0.3958333 -0.0000000), wk = 0.0053191 k( 21) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0053191 k( 22) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0053191 k( 23) = ( 0.0000000 0.4583333 -0.0000000), wk = 0.0053191 k( 24) = ( 0.0000000 0.4791667 -0.0000000), wk = 0.0053191 k( 25) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0053191 k( 26) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0053191 k( 27) = ( 0.0208333 0.5000000 -0.0000000), wk = 0.0053191 k( 28) = ( 0.0416667 0.5000000 -0.0000000), wk = 0.0053191 k( 29) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0053191 k( 30) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0053191 k( 31) = ( 0.1041667 0.5000000 -0.0000000), wk = 0.0053191 k( 32) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0053191 k( 33) = ( 0.1458333 0.5000000 -0.0000000), wk = 0.0053191 k( 34) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0053191 k( 35) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0053191 k( 36) = ( 0.2083333 0.5000000 -0.0000000), wk = 0.0053191 k( 37) = ( 0.2291667 0.5000000 -0.0000000), wk = 0.0053191 k( 38) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0053191 k( 39) = ( 0.2708333 0.5000000 -0.0000000), wk = 0.0053191 k( 40) = ( 0.2916667 0.5000000 -0.0000000), wk = 0.0053191 k( 41) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0053191 k( 42) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0053191 k( 43) = ( 0.3541667 0.5000000 -0.0000000), wk = 0.0053191 k( 44) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0053191 k( 45) = ( 0.3958333 0.5000000 -0.0000000), wk = 0.0053191 k( 46) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0053191 k( 47) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0053191 k( 48) = ( 0.4583333 0.5000000 -0.0000000), wk = 0.0053191 k( 49) = ( 0.4791667 0.5000000 -0.0000000), wk = 0.0053191 k( 50) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0053191 k( 51) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0053191 k( 52) = ( 0.4852941 0.4852941 -0.0000000), wk = 0.0053191 k( 53) = ( 0.4705882 0.4705882 -0.0000000), wk = 0.0053191 k( 54) = ( 0.4558823 0.4558823 -0.0000000), wk = 0.0053191 k( 55) = ( 0.4411765 0.4411765 -0.0000000), wk = 0.0053191 k( 56) = ( 0.4264706 0.4264706 -0.0000000), wk = 0.0053191 k( 57) = ( 0.4117647 0.4117647 -0.0000000), wk = 0.0053191 k( 58) = ( 0.3970588 0.3970588 -0.0000000), wk = 0.0053191 k( 59) = ( 0.3823529 0.3823529 -0.0000000), wk = 0.0053191 k( 60) = ( 0.3676471 0.3676471 -0.0000000), wk = 0.0053191 k( 61) = ( 0.3529412 0.3529412 -0.0000000), wk = 0.0053191 k( 62) = ( 0.3382353 0.3382353 -0.0000000), wk = 0.0053191 k( 63) = ( 0.3235294 0.3235294 -0.0000000), wk = 0.0053191 k( 64) = ( 0.3088235 0.3088235 -0.0000000), wk = 0.0053191 k( 65) = ( 0.2941177 0.2941176 -0.0000000), wk = 0.0053191 k( 66) = ( 0.2794118 0.2794118 -0.0000000), wk = 0.0053191 k( 67) = ( 0.2647059 0.2647059 -0.0000000), wk = 0.0053191 k( 68) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0053191 k( 69) = ( 0.2352941 0.2352941 -0.0000000), wk = 0.0053191 k( 70) = ( 0.2205882 0.2205882 -0.0000000), wk = 0.0053191 k( 71) = ( 0.2058823 0.2058823 -0.0000000), wk = 0.0053191 k( 72) = ( 0.1911765 0.1911765 -0.0000000), wk = 0.0053191 k( 73) = ( 0.1764706 0.1764706 -0.0000000), wk = 0.0053191 k( 74) = ( 0.1617647 0.1617647 -0.0000000), wk = 0.0053191 k( 75) = ( 0.1470588 0.1470588 -0.0000000), wk = 0.0053191 k( 76) = ( 0.1323529 0.1323529 -0.0000000), wk = 0.0053191 k( 77) = ( 0.1176471 0.1176471 -0.0000000), wk = 0.0053191 k( 78) = ( 0.1029412 0.1029412 -0.0000000), wk = 0.0053191 k( 79) = ( 0.0882353 0.0882353 -0.0000000), wk = 0.0053191 k( 80) = ( 0.0735294 0.0735294 -0.0000000), wk = 0.0053191 k( 81) = ( 0.0588235 0.0588235 -0.0000000), wk = 0.0053191 k( 82) = ( 0.0441177 0.0441176 -0.0000000), wk = 0.0053191 k( 83) = ( 0.0294118 0.0294118 -0.0000000), wk = 0.0053191 k( 84) = ( 0.0147059 0.0147059 -0.0000000), wk = 0.0053191 k( 85) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 86) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 87) = ( 0.0119048 0.0119048 0.0119048), wk = 0.0053191 k( 88) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0053191 k( 89) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0053191 k( 90) = ( 0.0476191 0.0476190 0.0476190), wk = 0.0053191 k( 91) = ( 0.0595238 0.0595238 0.0595238), wk = 0.0053191 k( 92) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0053191 k( 93) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0053191 k( 94) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0053191 k( 95) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0053191 k( 96) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0053191 k( 97) = ( 0.1309524 0.1309524 0.1309524), wk = 0.0053191 k( 98) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0053191 k( 99) = ( 0.1547619 0.1547619 0.1547619), wk = 0.0053191 k( 100) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0053191 k( 101) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0053191 k( 102) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0053191 k( 103) = ( 0.2023810 0.2023809 0.2023809), wk = 0.0053191 k( 104) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0053191 k( 105) = ( 0.2261905 0.2261905 0.2261905), wk = 0.0053191 k( 106) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0053191 k( 107) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0053191 k( 108) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0053191 k( 109) = ( 0.2738095 0.2738095 0.2738095), wk = 0.0053191 k( 110) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0053191 k( 111) = ( 0.2976190 0.2976190 0.2976190), wk = 0.0053191 k( 112) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0053191 k( 113) = ( 0.3214286 0.3214286 0.3214286), wk = 0.0053191 k( 114) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0053191 k( 115) = ( 0.3452381 0.3452381 0.3452381), wk = 0.0053191 k( 116) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0053191 k( 117) = ( 0.3690476 0.3690476 0.3690476), wk = 0.0053191 k( 118) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0053191 k( 119) = ( 0.3928571 0.3928571 0.3928571), wk = 0.0053191 k( 120) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0053191 k( 121) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0053191 k( 122) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0053191 k( 123) = ( 0.4404762 0.4404762 0.4404762), wk = 0.0053191 k( 124) = ( 0.4523810 0.4523809 0.4523809), wk = 0.0053191 k( 125) = ( 0.4642857 0.4642857 0.4642857), wk = 0.0053191 k( 126) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0053191 k( 127) = ( 0.4880952 0.4880952 0.4880952), wk = 0.0053191 k( 128) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 k( 129) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 k( 130) = ( 0.4852941 0.5000000 0.4852941), wk = 0.0053191 k( 131) = ( 0.4705882 0.5000000 0.4705882), wk = 0.0053191 k( 132) = ( 0.4558823 0.5000000 0.4558823), wk = 0.0053191 k( 133) = ( 0.4411765 0.5000000 0.4411765), wk = 0.0053191 k( 134) = ( 0.4264706 0.5000000 0.4264706), wk = 0.0053191 k( 135) = ( 0.4117647 0.5000000 0.4117647), wk = 0.0053191 k( 136) = ( 0.3970588 0.5000000 0.3970588), wk = 0.0053191 k( 137) = ( 0.3823529 0.5000000 0.3823529), wk = 0.0053191 k( 138) = ( 0.3676471 0.5000000 0.3676471), wk = 0.0053191 k( 139) = ( 0.3529412 0.5000000 0.3529412), wk = 0.0053191 k( 140) = ( 0.3382353 0.5000000 0.3382353), wk = 0.0053191 k( 141) = ( 0.3235294 0.5000000 0.3235294), wk = 0.0053191 k( 142) = ( 0.3088235 0.5000000 0.3088235), wk = 0.0053191 k( 143) = ( 0.2941177 0.5000000 0.2941176), wk = 0.0053191 k( 144) = ( 0.2794118 0.5000000 0.2794118), wk = 0.0053191 k( 145) = ( 0.2647059 0.5000000 0.2647059), wk = 0.0053191 k( 146) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0053191 k( 147) = ( 0.2352941 0.5000000 0.2352941), wk = 0.0053191 k( 148) = ( 0.2205882 0.5000000 0.2205882), wk = 0.0053191 k( 149) = ( 0.2058823 0.5000000 0.2058823), wk = 0.0053191 k( 150) = ( 0.1911765 0.5000000 0.1911765), wk = 0.0053191 k( 151) = ( 0.1764706 0.5000000 0.1764706), wk = 0.0053191 k( 152) = ( 0.1617647 0.5000000 0.1617647), wk = 0.0053191 k( 153) = ( 0.1470588 0.5000000 0.1470588), wk = 0.0053191 k( 154) = ( 0.1323529 0.5000000 0.1323529), wk = 0.0053191 k( 155) = ( 0.1176471 0.5000000 0.1176471), wk = 0.0053191 k( 156) = ( 0.1029412 0.5000000 0.1029412), wk = 0.0053191 k( 157) = ( 0.0882353 0.5000000 0.0882353), wk = 0.0053191 k( 158) = ( 0.0735294 0.5000000 0.0735294), wk = 0.0053191 k( 159) = ( 0.0588235 0.5000000 0.0588235), wk = 0.0053191 k( 160) = ( 0.0441177 0.5000000 0.0441176), wk = 0.0053191 k( 161) = ( 0.0294118 0.5000000 0.0294118), wk = 0.0053191 k( 162) = ( 0.0147059 0.5000000 0.0147059), wk = 0.0053191 k( 163) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0053191 k( 164) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0053191 k( 165) = ( 0.5000000 0.5000000 0.0208333), wk = 0.0053191 k( 166) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0053191 k( 167) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0053191 k( 168) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0053191 k( 169) = ( 0.5000000 0.5000000 0.1041667), wk = 0.0053191 k( 170) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0053191 k( 171) = ( 0.5000000 0.5000000 0.1458333), wk = 0.0053191 k( 172) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0053191 k( 173) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0053191 k( 174) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0053191 k( 175) = ( 0.5000000 0.5000000 0.2291667), wk = 0.0053191 k( 176) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0053191 k( 177) = ( 0.5000000 0.5000000 0.2708333), wk = 0.0053191 k( 178) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0053191 k( 179) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0053191 k( 180) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0053191 k( 181) = ( 0.5000000 0.5000000 0.3541667), wk = 0.0053191 k( 182) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0053191 k( 183) = ( 0.5000000 0.5000000 0.3958333), wk = 0.0053191 k( 184) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0053191 k( 185) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0053191 k( 186) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0053191 k( 187) = ( 0.5000000 0.5000000 0.4791667), wk = 0.0053191 k( 188) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 2) = ( 0.0000000 0.0208333 0.0000000), wk = 0.0053191 k( 3) = ( 0.0000000 0.0416667 0.0000000), wk = 0.0053191 k( 4) = ( 0.0000000 0.0625000 0.0000000), wk = 0.0053191 k( 5) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0053191 k( 6) = ( 0.0000000 0.1041667 0.0000000), wk = 0.0053191 k( 7) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0053191 k( 8) = ( 0.0000000 0.1458333 0.0000000), wk = 0.0053191 k( 9) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0053191 k( 10) = ( 0.0000000 0.1875000 0.0000000), wk = 0.0053191 k( 11) = ( 0.0000000 0.2083333 0.0000000), wk = 0.0053191 k( 12) = ( 0.0000000 0.2291667 0.0000000), wk = 0.0053191 k( 13) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0053191 k( 14) = ( 0.0000000 0.2708333 0.0000000), wk = 0.0053191 k( 15) = ( 0.0000000 0.2916667 0.0000000), wk = 0.0053191 k( 16) = ( 0.0000000 0.3125000 0.0000000), wk = 0.0053191 k( 17) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0053191 k( 18) = ( 0.0000000 0.3541667 0.0000000), wk = 0.0053191 k( 19) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0053191 k( 20) = ( 0.0000000 0.3958333 0.0000000), wk = 0.0053191 k( 21) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0053191 k( 22) = ( 0.0000000 0.4375000 0.0000000), wk = 0.0053191 k( 23) = ( 0.0000000 0.4583333 0.0000000), wk = 0.0053191 k( 24) = ( 0.0000000 0.4791667 0.0000000), wk = 0.0053191 k( 25) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0053191 k( 26) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0053191 k( 27) = ( 0.0208333 0.5000000 0.0000000), wk = 0.0053191 k( 28) = ( 0.0416667 0.5000000 0.0000000), wk = 0.0053191 k( 29) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0053191 k( 30) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0053191 k( 31) = ( 0.1041667 0.5000000 0.0000000), wk = 0.0053191 k( 32) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0053191 k( 33) = ( 0.1458333 0.5000000 0.0000000), wk = 0.0053191 k( 34) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0053191 k( 35) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0053191 k( 36) = ( 0.2083333 0.5000000 0.0000000), wk = 0.0053191 k( 37) = ( 0.2291667 0.5000000 0.0000000), wk = 0.0053191 k( 38) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0053191 k( 39) = ( 0.2708333 0.5000000 0.0000000), wk = 0.0053191 k( 40) = ( 0.2916667 0.5000000 0.0000000), wk = 0.0053191 k( 41) = ( 0.3125000 0.5000000 0.0000000), wk = 0.0053191 k( 42) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0053191 k( 43) = ( 0.3541667 0.5000000 -0.0000000), wk = 0.0053191 k( 44) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0053191 k( 45) = ( 0.3958333 0.5000000 0.0000000), wk = 0.0053191 k( 46) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0053191 k( 47) = ( 0.4375000 0.5000000 0.0000000), wk = 0.0053191 k( 48) = ( 0.4583333 0.5000000 0.0000000), wk = 0.0053191 k( 49) = ( 0.4791667 0.5000000 0.0000000), wk = 0.0053191 k( 50) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0053191 k( 51) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0053191 k( 52) = ( 0.4852941 0.4852941 0.0000000), wk = 0.0053191 k( 53) = ( 0.4705882 0.4705882 0.0000000), wk = 0.0053191 k( 54) = ( 0.4558823 0.4558823 0.0000000), wk = 0.0053191 k( 55) = ( 0.4411765 0.4411765 0.0000000), wk = 0.0053191 k( 56) = ( 0.4264706 0.4264706 0.0000000), wk = 0.0053191 k( 57) = ( 0.4117647 0.4117647 0.0000000), wk = 0.0053191 k( 58) = ( 0.3970588 0.3970588 0.0000000), wk = 0.0053191 k( 59) = ( 0.3823529 0.3823529 0.0000000), wk = 0.0053191 k( 60) = ( 0.3676471 0.3676471 -0.0000000), wk = 0.0053191 k( 61) = ( 0.3529412 0.3529412 0.0000000), wk = 0.0053191 k( 62) = ( 0.3382353 0.3382353 0.0000000), wk = 0.0053191 k( 63) = ( 0.3235294 0.3235294 0.0000000), wk = 0.0053191 k( 64) = ( 0.3088235 0.3088235 -0.0000000), wk = 0.0053191 k( 65) = ( 0.2941177 0.2941177 -0.0000000), wk = 0.0053191 k( 66) = ( 0.2794118 0.2794118 -0.0000000), wk = 0.0053191 k( 67) = ( 0.2647059 0.2647059 0.0000000), wk = 0.0053191 k( 68) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0053191 k( 69) = ( 0.2352941 0.2352941 0.0000000), wk = 0.0053191 k( 70) = ( 0.2205882 0.2205882 0.0000000), wk = 0.0053191 k( 71) = ( 0.2058823 0.2058823 0.0000000), wk = 0.0053191 k( 72) = ( 0.1911765 0.1911765 0.0000000), wk = 0.0053191 k( 73) = ( 0.1764706 0.1764706 0.0000000), wk = 0.0053191 k( 74) = ( 0.1617647 0.1617647 -0.0000000), wk = 0.0053191 k( 75) = ( 0.1470588 0.1470588 -0.0000000), wk = 0.0053191 k( 76) = ( 0.1323529 0.1323529 0.0000000), wk = 0.0053191 k( 77) = ( 0.1176471 0.1176471 0.0000000), wk = 0.0053191 k( 78) = ( 0.1029412 0.1029412 0.0000000), wk = 0.0053191 k( 79) = ( 0.0882353 0.0882353 0.0000000), wk = 0.0053191 k( 80) = ( 0.0735294 0.0735294 -0.0000000), wk = 0.0053191 k( 81) = ( 0.0588235 0.0588235 0.0000000), wk = 0.0053191 k( 82) = ( 0.0441177 0.0441177 0.0000000), wk = 0.0053191 k( 83) = ( 0.0294118 0.0294118 0.0000000), wk = 0.0053191 k( 84) = ( 0.0147059 0.0147059 0.0000000), wk = 0.0053191 k( 85) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 86) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 87) = ( 0.0119048 0.0119048 0.0119048), wk = 0.0053191 k( 88) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0053191 k( 89) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0053191 k( 90) = ( 0.0476191 0.0476191 0.0476191), wk = 0.0053191 k( 91) = ( 0.0595238 0.0595238 0.0595238), wk = 0.0053191 k( 92) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0053191 k( 93) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0053191 k( 94) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0053191 k( 95) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0053191 k( 96) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0053191 k( 97) = ( 0.1309524 0.1309524 0.1309524), wk = 0.0053191 k( 98) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0053191 k( 99) = ( 0.1547619 0.1547619 0.1547619), wk = 0.0053191 k( 100) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0053191 k( 101) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0053191 k( 102) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0053191 k( 103) = ( 0.2023810 0.2023810 0.2023810), wk = 0.0053191 k( 104) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0053191 k( 105) = ( 0.2261905 0.2261905 0.2261905), wk = 0.0053191 k( 106) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0053191 k( 107) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0053191 k( 108) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0053191 k( 109) = ( 0.2738095 0.2738095 0.2738095), wk = 0.0053191 k( 110) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0053191 k( 111) = ( 0.2976190 0.2976190 0.2976190), wk = 0.0053191 k( 112) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0053191 k( 113) = ( 0.3214286 0.3214286 0.3214286), wk = 0.0053191 k( 114) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0053191 k( 115) = ( 0.3452381 0.3452381 0.3452381), wk = 0.0053191 k( 116) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0053191 k( 117) = ( 0.3690476 0.3690476 0.3690476), wk = 0.0053191 k( 118) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0053191 k( 119) = ( 0.3928571 0.3928571 0.3928571), wk = 0.0053191 k( 120) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0053191 k( 121) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0053191 k( 122) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0053191 k( 123) = ( 0.4404762 0.4404762 0.4404762), wk = 0.0053191 k( 124) = ( 0.4523810 0.4523810 0.4523810), wk = 0.0053191 k( 125) = ( 0.4642857 0.4642857 0.4642857), wk = 0.0053191 k( 126) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0053191 k( 127) = ( 0.4880952 0.4880952 0.4880952), wk = 0.0053191 k( 128) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 k( 129) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 k( 130) = ( 0.4852941 0.5000000 0.4852941), wk = 0.0053191 k( 131) = ( 0.4705882 0.5000000 0.4705882), wk = 0.0053191 k( 132) = ( 0.4558823 0.5000000 0.4558823), wk = 0.0053191 k( 133) = ( 0.4411765 0.5000000 0.4411765), wk = 0.0053191 k( 134) = ( 0.4264706 0.5000000 0.4264706), wk = 0.0053191 k( 135) = ( 0.4117647 0.5000000 0.4117647), wk = 0.0053191 k( 136) = ( 0.3970588 0.5000000 0.3970588), wk = 0.0053191 k( 137) = ( 0.3823529 0.5000000 0.3823529), wk = 0.0053191 k( 138) = ( 0.3676471 0.5000000 0.3676471), wk = 0.0053191 k( 139) = ( 0.3529412 0.5000000 0.3529412), wk = 0.0053191 k( 140) = ( 0.3382353 0.5000000 0.3382353), wk = 0.0053191 k( 141) = ( 0.3235294 0.5000000 0.3235294), wk = 0.0053191 k( 142) = ( 0.3088235 0.5000000 0.3088235), wk = 0.0053191 k( 143) = ( 0.2941177 0.5000000 0.2941177), wk = 0.0053191 k( 144) = ( 0.2794118 0.5000000 0.2794118), wk = 0.0053191 k( 145) = ( 0.2647059 0.5000000 0.2647059), wk = 0.0053191 k( 146) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0053191 k( 147) = ( 0.2352941 0.5000000 0.2352941), wk = 0.0053191 k( 148) = ( 0.2205882 0.5000000 0.2205882), wk = 0.0053191 k( 149) = ( 0.2058823 0.5000000 0.2058823), wk = 0.0053191 k( 150) = ( 0.1911765 0.5000000 0.1911765), wk = 0.0053191 k( 151) = ( 0.1764706 0.5000000 0.1764706), wk = 0.0053191 k( 152) = ( 0.1617647 0.5000000 0.1617647), wk = 0.0053191 k( 153) = ( 0.1470588 0.5000000 0.1470588), wk = 0.0053191 k( 154) = ( 0.1323529 0.5000000 0.1323529), wk = 0.0053191 k( 155) = ( 0.1176471 0.5000000 0.1176471), wk = 0.0053191 k( 156) = ( 0.1029412 0.5000000 0.1029412), wk = 0.0053191 k( 157) = ( 0.0882353 0.5000000 0.0882353), wk = 0.0053191 k( 158) = ( 0.0735294 0.5000000 0.0735294), wk = 0.0053191 k( 159) = ( 0.0588235 0.5000000 0.0588235), wk = 0.0053191 k( 160) = ( 0.0441177 0.5000000 0.0441177), wk = 0.0053191 k( 161) = ( 0.0294118 0.5000000 0.0294118), wk = 0.0053191 k( 162) = ( 0.0147059 0.5000000 0.0147059), wk = 0.0053191 k( 163) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0053191 k( 164) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0053191 k( 165) = ( 0.5000000 0.5000000 0.0208333), wk = 0.0053191 k( 166) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0053191 k( 167) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0053191 k( 168) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0053191 k( 169) = ( 0.5000000 0.5000000 0.1041667), wk = 0.0053191 k( 170) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0053191 k( 171) = ( 0.5000000 0.5000000 0.1458333), wk = 0.0053191 k( 172) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0053191 k( 173) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0053191 k( 174) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0053191 k( 175) = ( 0.5000000 0.5000000 0.2291667), wk = 0.0053191 k( 176) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0053191 k( 177) = ( 0.5000000 0.5000000 0.2708333), wk = 0.0053191 k( 178) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0053191 k( 179) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0053191 k( 180) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0053191 k( 181) = ( 0.5000000 0.5000000 0.3541667), wk = 0.0053191 k( 182) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0053191 k( 183) = ( 0.5000000 0.5000000 0.3958333), wk = 0.0053191 k( 184) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0053191 k( 185) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0053191 k( 186) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0053191 k( 187) = ( 0.5000000 0.5000000 0.4791667), wk = 0.0053191 k( 188) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 Dense grid: 119825 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 82057 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.52 Mb ( 312, 110) NL pseudopotentials 0.97 Mb ( 156, 408) Each V/rho on FFT grid 0.06 Mb ( 4096) Each G-vector array 0.01 Mb ( 1667) G-vector shells 0.00 Mb ( 474) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.09 Mb ( 312, 440) Each subspace H/S matrix 0.08 Mb ( 73, 73) Each matrix 1.37 Mb ( 408, 2, 110) The potential is recalculated from file : ./CuTe2.save/charge-density.dat Starting wfc are 136 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.0 secs Computing kpt #: 2 total cpu time spent up to now is 7.7 secs Computing kpt #: 3 total cpu time spent up to now is 10.8 secs Computing kpt #: 4 total cpu time spent up to now is 13.3 secs Computing kpt #: 5 total cpu time spent up to now is 15.8 secs Computing kpt #: 6 total cpu time spent up to now is 18.2 secs Computing kpt #: 7 total cpu time spent up to now is 20.7 secs Computing kpt #: 8 total cpu time spent up to now is 23.1 secs Computing kpt #: 9 total cpu time spent up to now is 25.3 secs Computing kpt #: 10 total cpu time spent up to now is 27.8 secs Computing kpt #: 11 total cpu time spent up to now is 29.9 secs Computing kpt #: 12 total cpu time spent up to now is 32.0 secs Computing kpt #: 13 total cpu time spent up to now is 34.0 secs Computing kpt #: 14 total cpu time spent up to now is 36.1 secs Computing kpt #: 15 total cpu time spent up to now is 38.1 secs Computing kpt #: 16 total cpu time spent up to now is 40.2 secs Computing kpt #: 17 total cpu time spent up to now is 42.2 secs Computing kpt #: 18 total cpu time spent up to now is 44.3 secs Computing kpt #: 19 total cpu time spent up to now is 46.3 secs Computing kpt #: 20 total cpu time spent up to now is 48.3 secs Computing kpt #: 21 total cpu time spent up to now is 50.3 secs Computing kpt #: 22 total cpu time spent up to now is 52.3 secs Computing kpt #: 23 total cpu time spent up to now is 54.3 secs Computing kpt #: 24 total cpu time spent up to now is 56.4 secs Computing kpt #: 25 total cpu time spent up to now is 58.4 secs Computing kpt #: 26 total cpu time spent up to now is 60.5 secs Computing kpt #: 27 total cpu time spent up to now is 62.5 secs Computing kpt #: 28 total cpu time spent up to now is 64.6 secs Computing kpt #: 29 total cpu time spent up to now is 66.7 secs Computing kpt #: 30 total cpu time spent up to now is 68.8 secs Computing kpt #: 31 total cpu time spent up to now is 71.0 secs Computing kpt #: 32 total cpu time spent up to now is 73.1 secs Computing kpt #: 33 total cpu time spent up to now is 75.3 secs Computing kpt #: 34 total cpu time spent up to now is 77.5 secs Computing kpt #: 35 total cpu time spent up to now is 79.6 secs Computing kpt #: 36 total cpu time spent up to now is 81.7 secs Computing kpt #: 37 total cpu time spent up to now is 83.8 secs Computing kpt #: 38 total cpu time spent up to now is 85.9 secs Computing kpt #: 39 total cpu time spent up to now is 87.9 secs Computing kpt #: 40 total cpu time spent up to now is 90.0 secs Computing kpt #: 41 total cpu time spent up to now is 92.0 secs Computing kpt #: 42 total cpu time spent up to now is 94.1 secs Computing kpt #: 43 total cpu time spent up to now is 96.2 secs Computing kpt #: 44 total cpu time spent up to now is 98.2 secs Computing kpt #: 45 total cpu time spent up to now is 100.3 secs Computing kpt #: 46 total cpu time spent up to now is 102.4 secs Computing kpt #: 47 total cpu time spent up to now is 104.4 secs Computing kpt #: 48 total cpu time spent up to now is 106.5 secs Computing kpt #: 49 total cpu time spent up to now is 108.7 secs Computing kpt #: 50 total cpu time spent up to now is 110.9 secs Computing kpt #: 51 total cpu time spent up to now is 113.0 secs Computing kpt #: 52 total cpu time spent up to now is 115.3 secs Computing kpt #: 53 total cpu time spent up to now is 117.5 secs Computing kpt #: 54 total cpu time spent up to now is 119.7 secs Computing kpt #: 55 total cpu time spent up to now is 121.8 secs Computing kpt #: 56 total cpu time spent up to now is 124.0 secs Computing kpt #: 57 total cpu time spent up to now is 126.2 secs Computing kpt #: 58 total cpu time spent up to now is 128.4 secs Computing kpt #: 59 total cpu time spent up to now is 130.6 secs Computing kpt #: 60 total cpu time spent up to now is 132.7 secs Computing kpt #: 61 total cpu time spent up to now is 134.9 secs Computing kpt #: 62 total cpu time spent up to now is 137.0 secs Computing kpt #: 63 total cpu time spent up to now is 139.2 secs Computing kpt #: 64 total cpu time spent up to now is 141.7 secs Computing kpt #: 65 total cpu time spent up to now is 143.8 secs Computing kpt #: 66 total cpu time spent up to now is 146.0 secs Computing kpt #: 67 total cpu time spent up to now is 148.2 secs Computing kpt #: 68 total cpu time spent up to now is 150.4 secs Computing kpt #: 69 total cpu time spent up to now is 152.6 secs Computing kpt #: 70 total cpu time spent up to now is 155.0 secs Computing kpt #: 71 total cpu time spent up to now is 157.5 secs Computing kpt #: 72 total cpu time spent up to now is 159.6 secs Computing kpt #: 73 total cpu time spent up to now is 161.8 secs Computing kpt #: 74 total cpu time spent up to now is 164.0 secs Computing kpt #: 75 total cpu time spent up to now is 166.2 secs Computing kpt #: 76 total cpu time spent up to now is 168.4 secs Computing kpt #: 77 total cpu time spent up to now is 170.8 secs Computing kpt #: 78 total cpu time spent up to now is 173.2 secs Computing kpt #: 79 total cpu time spent up to now is 175.6 secs Computing kpt #: 80 total cpu time spent up to now is 178.1 secs Computing kpt #: 81 total cpu time spent up to now is 180.5 secs Computing kpt #: 82 total cpu time spent up to now is 182.9 secs Computing kpt #: 83 total cpu time spent up to now is 185.4 secs Computing kpt #: 84 total cpu time spent up to now is 188.2 secs Computing kpt #: 85 total cpu time spent up to now is 190.7 secs Computing kpt #: 86 total cpu time spent up to now is 193.2 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 198.9 secs Computing kpt #: 88 total cpu time spent up to now is 201.4 secs Computing kpt #: 89 total cpu time spent up to now is 203.8 secs Computing kpt #: 90 total cpu time spent up to now is 206.3 secs Computing kpt #: 91 total cpu time spent up to now is 208.7 secs Computing kpt #: 92 total cpu time spent up to now is 211.1 secs Computing kpt #: 93 total cpu time spent up to now is 213.5 secs Computing kpt #: 94 total cpu time spent up to now is 215.6 secs Computing kpt #: 95 total cpu time spent up to now is 217.7 secs Computing kpt #: 96 total cpu time spent up to now is 219.8 secs Computing kpt #: 97 total cpu time spent up to now is 221.9 secs Computing kpt #: 98 total cpu time spent up to now is 224.0 secs Computing kpt #: 99 total cpu time spent up to now is 226.1 secs Computing kpt #: 100 total cpu time spent up to now is 228.2 secs Computing kpt #: 101 total cpu time spent up to now is 230.3 secs Computing kpt #: 102 total cpu time spent up to now is 232.3 secs Computing kpt #: 103 total cpu time spent up to now is 234.4 secs Computing kpt #: 104 total cpu time spent up to now is 236.4 secs Computing kpt #: 105 total cpu time spent up to now is 238.4 secs Computing kpt #: 106 total cpu time spent up to now is 240.5 secs Computing kpt #: 107 total cpu time spent up to now is 242.5 secs Computing kpt #: 108 total cpu time spent up to now is 244.6 secs Computing kpt #: 109 total cpu time spent up to now is 246.7 secs Computing kpt #: 110 total cpu time spent up to now is 248.7 secs Computing kpt #: 111 total cpu time spent up to now is 250.8 secs Computing kpt #: 112 total cpu time spent up to now is 252.9 secs Computing kpt #: 113 total cpu time spent up to now is 255.1 secs Computing kpt #: 114 total cpu time spent up to now is 257.2 secs Computing kpt #: 115 total cpu time spent up to now is 259.4 secs Computing kpt #: 116 total cpu time spent up to now is 261.6 secs Computing kpt #: 117 total cpu time spent up to now is 263.8 secs Computing kpt #: 118 total cpu time spent up to now is 266.0 secs Computing kpt #: 119 total cpu time spent up to now is 268.2 secs Computing kpt #: 120 total cpu time spent up to now is 270.3 secs Computing kpt #: 121 total cpu time spent up to now is 272.5 secs Computing kpt #: 122 total cpu time spent up to now is 274.8 secs Computing kpt #: 123 total cpu time spent up to now is 277.0 secs Computing kpt #: 124 total cpu time spent up to now is 279.1 secs Computing kpt #: 125 total cpu time spent up to now is 281.4 secs Computing kpt #: 126 total cpu time spent up to now is 283.6 secs Computing kpt #: 127 total cpu time spent up to now is 285.7 secs Computing kpt #: 128 total cpu time spent up to now is 287.6 secs Computing kpt #: 129 total cpu time spent up to now is 289.6 secs Computing kpt #: 130 total cpu time spent up to now is 291.7 secs Computing kpt #: 131 total cpu time spent up to now is 293.9 secs Computing kpt #: 132 total cpu time spent up to now is 296.0 secs Computing kpt #: 133 total cpu time spent up to now is 298.2 secs Computing kpt #: 134 total cpu time spent up to now is 300.3 secs Computing kpt #: 135 total cpu time spent up to now is 302.4 secs Computing kpt #: 136 total cpu time spent up to now is 304.6 secs Computing kpt #: 137 total cpu time spent up to now is 306.7 secs Computing kpt #: 138 total cpu time spent up to now is 308.9 secs Computing kpt #: 139 total cpu time spent up to now is 311.2 secs Computing kpt #: 140 total cpu time spent up to now is 313.3 secs Computing kpt #: 141 total cpu time spent up to now is 315.4 secs Computing kpt #: 142 total cpu time spent up to now is 317.5 secs Computing kpt #: 143 total cpu time spent up to now is 319.5 secs Computing kpt #: 144 total cpu time spent up to now is 321.6 secs Computing kpt #: 145 total cpu time spent up to now is 323.6 secs Computing kpt #: 146 total cpu time spent up to now is 325.8 secs Computing kpt #: 147 total cpu time spent up to now is 328.1 secs Computing kpt #: 148 total cpu time spent up to now is 330.2 secs Computing kpt #: 149 total cpu time spent up to now is 332.4 secs Computing kpt #: 150 total cpu time spent up to now is 334.5 secs Computing kpt #: 151 total cpu time spent up to now is 336.6 secs Computing kpt #: 152 total cpu time spent up to now is 338.7 secs Computing kpt #: 153 total cpu time spent up to now is 340.9 secs Computing kpt #: 154 total cpu time spent up to now is 343.0 secs Computing kpt #: 155 total cpu time spent up to now is 345.2 secs Computing kpt #: 156 total cpu time spent up to now is 347.3 secs Computing kpt #: 157 total cpu time spent up to now is 349.4 secs Computing kpt #: 158 total cpu time spent up to now is 351.5 secs Computing kpt #: 159 total cpu time spent up to now is 353.6 secs Computing kpt #: 160 total cpu time spent up to now is 355.7 secs Computing kpt #: 161 total cpu time spent up to now is 357.8 secs Computing kpt #: 162 total cpu time spent up to now is 360.0 secs Computing kpt #: 163 total cpu time spent up to now is 362.0 secs Computing kpt #: 164 total cpu time spent up to now is 364.2 secs Computing kpt #: 165 total cpu time spent up to now is 366.4 secs Computing kpt #: 166 total cpu time spent up to now is 368.6 secs Computing kpt #: 167 total cpu time spent up to now is 370.8 secs Computing kpt #: 168 total cpu time spent up to now is 373.1 secs Computing kpt #: 169 total cpu time spent up to now is 375.3 secs Computing kpt #: 170 total cpu time spent up to now is 377.4 secs Computing kpt #: 171 total cpu time spent up to now is 379.6 secs Computing kpt #: 172 total cpu time spent up to now is 381.8 secs Computing kpt #: 173 total cpu time spent up to now is 384.0 secs Computing kpt #: 174 total cpu time spent up to now is 386.1 secs Computing kpt #: 175 total cpu time spent up to now is 388.3 secs Computing kpt #: 176 total cpu time spent up to now is 390.5 secs Computing kpt #: 177 total cpu time spent up to now is 392.7 secs Computing kpt #: 178 total cpu time spent up to now is 394.9 secs Computing kpt #: 179 total cpu time spent up to now is 397.1 secs Computing kpt #: 180 total cpu time spent up to now is 399.4 secs Computing kpt #: 181 total cpu time spent up to now is 401.6 secs Computing kpt #: 182 total cpu time spent up to now is 403.8 secs Computing kpt #: 183 total cpu time spent up to now is 406.0 secs Computing kpt #: 184 total cpu time spent up to now is 408.3 secs Computing kpt #: 185 total cpu time spent up to now is 410.5 secs Computing kpt #: 186 total cpu time spent up to now is 412.7 secs Computing kpt #: 187 total cpu time spent up to now is 414.9 secs Computing kpt #: 188 total cpu time spent up to now is 416.8 secs ethr = 1.09E-08, avg # of iterations = 19.8 total cpu time spent up to now is 416.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 10251 PWs) bands (ev): -5.3568 -5.3568 -3.6785 -3.6785 -3.6785 -3.6785 -3.6722 -3.6722 -2.5110 -2.5110 -2.5110 -2.5110 -2.5077 -2.5077 -1.5192 -1.5192 3.0281 3.0281 3.0444 3.0444 3.0444 3.0444 3.2996 3.2996 3.4320 3.4320 3.6005 3.6005 3.6005 3.6005 3.6949 3.6949 3.6949 3.6949 4.2541 4.2541 4.2541 4.2541 4.6065 4.6065 4.6065 4.6065 4.6346 4.6346 4.7187 4.7187 4.7187 4.7187 4.9033 4.9033 5.3107 5.3107 5.3318 5.3318 5.3318 5.3318 5.3773 5.3773 5.3773 5.3773 5.3954 5.3954 5.4794 5.4794 5.4794 5.4794 5.5889 5.5889 5.6410 5.6410 5.6410 5.6410 5.6535 5.6535 6.2431 6.2431 6.2727 6.2727 6.2727 6.2727 6.3134 6.3134 6.4606 6.4606 6.4606 6.4606 8.3196 8.3196 8.4168 8.4168 8.4540 8.4540 8.4540 8.4540 9.4351 9.4351 9.4351 9.4351 10.0983 10.0983 10.7989 10.7989 10.7989 10.7989 11.1197 11.1197 12.8489 12.8489 12.9294 12.9294 k = 0.0000 0.0208-0.0000 ( 10259 PWs) bands (ev): -5.3556 -5.3556 -3.6813 -3.6813 -3.6783 -3.6783 -3.6729 -3.6729 -2.5105 -2.5105 -2.5097 -2.5097 -2.5066 -2.5066 -1.5207 -1.5207 3.0268 3.0268 3.0426 3.0426 3.0447 3.0447 3.2924 3.2924 3.4206 3.4206 3.5810 3.5810 3.5923 3.5923 3.7116 3.7116 3.7249 3.7249 4.2562 4.2562 4.2610 4.2610 4.6065 4.6065 4.6083 4.6083 4.6354 4.6354 4.7183 4.7183 4.7193 4.7193 4.9007 4.9007 5.3103 5.3103 5.3316 5.3316 5.3319 5.3319 5.3768 5.3768 5.3778 5.3778 5.3950 5.3950 5.4792 5.4792 5.4795 5.4795 5.5883 5.5883 5.6408 5.6408 5.6415 5.6415 5.6531 5.6531 6.2361 6.2361 6.2730 6.2730 6.2783 6.2783 6.3138 6.3138 6.4599 6.4599 6.4673 6.4673 8.2904 8.2904 8.4278 8.4278 8.4559 8.4559 8.4776 8.4776 9.4230 9.4230 9.4349 9.4349 10.0952 10.0952 10.7769 10.7769 10.7956 10.7956 11.1395 11.1395 12.8542 12.8542 12.9301 12.9301 k = 0.0000 0.0417-0.0000 ( 10259 PWs) bands (ev): -5.3522 -5.3522 -3.6915 -3.6915 -3.6776 -3.6776 -3.6730 -3.6730 -2.5088 -2.5088 -2.5070 -2.5070 -2.5023 -2.5023 -1.5254 -1.5254 3.0186 3.0186 3.0407 3.0407 3.0460 3.0460 3.2721 3.2721 3.3897 3.3897 3.5529 3.5529 3.5780 3.5780 3.7508 3.7508 3.7818 3.7818 4.2623 4.2623 4.2811 4.2811 4.6066 4.6066 4.6130 4.6130 4.6390 4.6390 4.7170 4.7170 4.7211 4.7211 4.8935 4.8935 5.3091 5.3091 5.3310 5.3310 5.3323 5.3323 5.3752 5.3752 5.3794 5.3794 5.3941 5.3941 5.4785 5.4785 5.4797 5.4797 5.5867 5.5867 5.6401 5.6401 5.6429 5.6429 5.6521 5.6521 6.2197 6.2197 6.2741 6.2741 6.2901 6.2901 6.3161 6.3161 6.4587 6.4587 6.4862 6.4862 8.2371 8.2371 8.4407 8.4407 8.4618 8.4618 8.5337 8.5337 9.3875 9.3875 9.4343 9.4343 10.0861 10.0861 10.7243 10.7243 10.7859 10.7859 11.1853 11.1853 12.8646 12.8646 12.9322 12.9322 k = 0.0000 0.0625-0.0000 ( 10251 PWs) bands (ev): -5.3463 -5.3463 -3.7091 -3.7091 -3.6766 -3.6766 -3.6722 -3.6722 -2.5062 -2.5062 -2.5034 -2.5034 -2.4941 -2.4941 -1.5331 -1.5331 3.0004 3.0004 3.0392 3.0392 3.0493 3.0493 3.2409 3.2409 3.3507 3.3507 3.5300 3.5300 3.5660 3.5660 3.8008 3.8008 3.8437 3.8437 4.2722 4.2722 4.3123 4.3123 4.6064 4.6064 4.6181 4.6181 4.6475 4.6475 4.7146 4.7146 4.7244 4.7244 4.8831 4.8831 5.3071 5.3071 5.3298 5.3298 5.3329 5.3329 5.3728 5.3728 5.3819 5.3819 5.3936 5.3936 5.4775 5.4775 5.4801 5.4801 5.5843 5.5843 5.6386 5.6386 5.6450 5.6450 5.6513 5.6513 6.1980 6.1980 6.2755 6.2755 6.3025 6.3025 6.3210 6.3210 6.4596 6.4596 6.5143 6.5143 8.1811 8.1811 8.4550 8.4550 8.4725 8.4725 8.5994 8.5994 9.3300 9.3300 9.4333 9.4333 10.0712 10.0712 10.6605 10.6605 10.7698 10.7698 11.2381 11.2381 12.8726 12.8726 12.9361 12.9361 k = 0.0000 0.0833-0.0000 ( 10247 PWs) bands (ev): -5.3382 -5.3382 -3.7333 -3.7333 -3.6752 -3.6752 -3.6709 -3.6709 -2.5027 -2.5027 -2.4987 -2.4987 -2.4830 -2.4830 -1.5439 -1.5439 2.9743 2.9743 3.0338 3.0338 3.0534 3.0534 3.2014 3.2014 3.3172 3.3172 3.5114 3.5114 3.5569 3.5569 3.8565 3.8565 3.9046 3.9046 4.2852 4.2852 4.3520 4.3520 4.6053 4.6053 4.6227 4.6227 4.6619 4.6619 4.7112 4.7112 4.7298 4.7298 4.8719 4.8719 5.3039 5.3039 5.3278 5.3278 5.3338 5.3338 5.3695 5.3695 5.3839 5.3839 5.3951 5.3951 5.4760 5.4760 5.4809 5.4809 5.5816 5.5816 5.6363 5.6363 5.6468 5.6468 5.6524 5.6524 6.1733 6.1733 6.2755 6.2755 6.3124 6.3124 6.3286 6.3286 6.4660 6.4660 6.5494 6.5494 8.1268 8.1268 8.4693 8.4693 8.4903 8.4903 8.6676 8.6676 9.2536 9.2536 9.4318 9.4318 10.0511 10.0511 10.5953 10.5953 10.7476 10.7476 11.2882 11.2882 12.8757 12.8757 12.9424 12.9424 k = 0.0000 0.1042-0.0000 ( 10239 PWs) bands (ev): -5.3278 -5.3278 -3.7634 -3.7634 -3.6734 -3.6734 -3.6692 -3.6692 -2.4984 -2.4984 -2.4925 -2.4925 -2.4697 -2.4697 -1.5574 -1.5574 2.9420 2.9420 3.0199 3.0199 3.0553 3.0553 3.1591 3.1591 3.2977 3.2977 3.4965 3.4965 3.5493 3.5493 3.9147 3.9147 3.9620 3.9620 4.3007 4.3007 4.3967 4.3967 4.6017 4.6017 4.6286 4.6286 4.6781 4.6781 4.7081 4.7081 4.7387 4.7387 4.8636 4.8636 5.2995 5.2995 5.3247 5.3247 5.3351 5.3351 5.3657 5.3657 5.3844 5.3844 5.4001 5.4001 5.4741 5.4741 5.4821 5.4821 5.5787 5.5787 5.6333 5.6333 5.6474 5.6474 5.6566 5.6566 6.1473 6.1473 6.2706 6.2706 6.3201 6.3201 6.3385 6.3385 6.4799 6.4799 6.5898 6.5898 8.0757 8.0757 8.4818 8.4818 8.5151 8.5151 8.7356 8.7356 9.1628 9.1628 9.4297 9.4297 10.0265 10.0265 10.5324 10.5324 10.7197 10.7197 11.3324 11.3324 12.8715 12.8715 12.9521 12.9521 k = 0.0000 0.1250-0.0000 ( 10239 PWs) bands (ev): -5.3151 -5.3151 -3.7986 -3.7986 -3.6712 -3.6712 -3.6671 -3.6671 -2.4933 -2.4933 -2.4850 -2.4850 -2.4548 -2.4548 -1.5738 -1.5738 2.9049 2.9049 2.9929 2.9929 3.0503 3.0503 3.1253 3.1253 3.2936 3.2936 3.4864 3.4864 3.5421 3.5421 3.9721 3.9721 4.0157 4.0157 4.3178 4.3178 4.4417 4.4417 4.5945 4.5945 4.6393 4.6393 4.6853 4.6853 4.7118 4.7118 4.7530 4.7530 4.8628 4.8628 5.2937 5.2937 5.3203 5.3203 5.3367 5.3367 5.3618 5.3618 5.3843 5.3843 5.4080 5.4080 5.4718 5.4718 5.4837 5.4837 5.5760 5.5760 5.6297 5.6297 5.6479 5.6479 5.6633 5.6633 6.1213 6.1213 6.2571 6.2571 6.3291 6.3291 6.3514 6.3514 6.5002 6.5002 6.6336 6.6336 8.0286 8.0286 8.4924 8.4924 8.5440 8.5440 8.8000 8.8000 9.0649 9.0649 9.4270 9.4270 9.9982 9.9982 10.4722 10.4722 10.6867 10.6867 11.3706 11.3706 12.8566 12.8566 12.9660 12.9660 k = 0.0000 0.1458-0.0000 ( 10239 PWs) bands (ev): -5.3001 -5.3001 -3.8382 -3.8382 -3.6688 -3.6688 -3.6647 -3.6647 -2.4873 -2.4873 -2.4760 -2.4760 -2.4390 -2.4390 -1.5927 -1.5927 2.8643 2.8643 2.9513 2.9513 3.0338 3.0338 3.1101 3.1101 3.3006 3.3006 3.4830 3.4830 3.5354 3.5354 4.0239 4.0239 4.0682 4.0682 4.3355 4.3355 4.4806 4.4806 4.5834 4.5834 4.6579 4.6579 4.6822 4.6822 4.7224 4.7224 4.7711 4.7711 4.8752 4.8752 5.2864 5.2864 5.3141 5.3141 5.3386 5.3386 5.3582 5.3582 5.3845 5.3845 5.4176 5.4176 5.4693 5.4693 5.4858 5.4858 5.5736 5.5736 5.6259 5.6259 5.6487 5.6487 5.6721 5.6721 6.0961 6.0961 6.2353 6.2353 6.3417 6.3417 6.3675 6.3675 6.5243 6.5243 6.6784 6.6784 7.9860 7.9860 8.4991 8.4991 8.5736 8.5736 8.8490 8.8490 8.9782 8.9782 9.4236 9.4236 9.9674 9.9674 10.4141 10.4141 10.6493 10.6493 11.4041 11.4041 12.8267 12.8267 12.9839 12.9839 k = 0.0000 0.1667-0.0000 ( 10235 PWs) bands (ev): -5.2828 -5.2828 -3.8816 -3.8816 -3.6662 -3.6662 -3.6621 -3.6621 -2.4807 -2.4807 -2.4656 -2.4656 -2.4229 -2.4229 -1.6140 -1.6140 2.8214 2.8214 2.9001 2.9001 3.0102 3.0102 3.1090 3.1090 3.3117 3.3117 3.4866 3.4866 3.5318 3.5318 4.0658 4.0658 4.1225 4.1225 4.3525 4.3525 4.5056 4.5056 4.5713 4.5713 4.6765 4.6765 4.6874 4.6874 4.7343 4.7343 4.7891 4.7891 4.9036 4.9036 5.2775 5.2775 5.3060 5.3060 5.3405 5.3405 5.3555 5.3555 5.3856 5.3856 5.4284 5.4284 5.4667 5.4667 5.4885 5.4885 5.5715 5.5715 5.6222 5.6222 5.6502 5.6502 5.6830 5.6830 6.0724 6.0724 6.2074 6.2074 6.3584 6.3584 6.3870 6.3870 6.5503 6.5503 6.7211 6.7211 7.9485 7.9485 8.4971 8.4971 8.5978 8.5978 8.8299 8.8299 8.9668 8.9668 9.4198 9.4198 9.9354 9.9354 10.3568 10.3568 10.6081 10.6081 11.4348 11.4348 12.7780 12.7780 12.9187 12.9187 k = 0.0000 0.1875-0.0000 ( 10239 PWs) bands (ev): -5.2633 -5.2633 -3.9281 -3.9281 -3.6633 -3.6633 -3.6592 -3.6592 -2.4732 -2.4732 -2.4538 -2.4538 -2.4069 -2.4069 -1.6376 -1.6376 2.7773 2.7773 2.8453 2.8453 2.9858 2.9858 3.1140 3.1140 3.3203 3.3203 3.4888 3.4888 3.5428 3.5428 4.0980 4.0980 4.1775 4.1775 4.3676 4.3676 4.5096 4.5096 4.5666 4.5666 4.6756 4.6756 4.7157 4.7157 4.7496 4.7496 4.8106 4.8106 4.9447 4.9447 5.2671 5.2671 5.2959 5.2959 5.3413 5.3413 5.3544 5.3544 5.3879 5.3879 5.4395 5.4395 5.4643 5.4643 5.4916 5.4916 5.5699 5.5699 5.6189 5.6189 5.6523 5.6523 5.6963 5.6963 6.0508 6.0508 6.1761 6.1761 6.3793 6.3793 6.4099 6.4099 6.5772 6.5772 6.7587 6.7587 7.9163 7.9163 8.4755 8.4755 8.6055 8.6055 8.7853 8.7853 9.0104 9.0104 9.4162 9.4162 9.9034 9.9034 10.2993 10.2993 10.5641 10.5641 11.4646 11.4646 12.7074 12.7074 12.7772 12.7772 k = 0.0000 0.2083-0.0000 ( 10247 PWs) bands (ev): -5.2416 -5.2416 -3.9772 -3.9772 -3.6602 -3.6602 -3.6561 -3.6561 -2.4652 -2.4652 -2.4406 -2.4406 -2.3914 -2.3914 -1.6632 -1.6632 2.7328 2.7328 2.7901 2.7901 2.9629 2.9629 3.1216 3.1216 3.3236 3.3236 3.4801 3.4801 3.5782 3.5782 4.1232 4.1232 4.2301 4.2301 4.3797 4.3797 4.4962 4.4962 4.5719 4.5719 4.6770 4.6770 4.7348 4.7348 4.7671 4.7671 4.8456 4.8456 4.9918 4.9918 5.2555 5.2555 5.2839 5.2839 5.3406 5.3406 5.3553 5.3553 5.3916 5.3916 5.4498 5.4498 5.4633 5.4633 5.4950 5.4950 5.5687 5.5687 5.6163 5.6163 5.6551 5.6551 5.7120 5.7120 6.0313 6.0313 6.1431 6.1431 6.4044 6.4044 6.4364 6.4364 6.6043 6.6043 6.7878 6.7878 7.8898 7.8898 8.4219 8.4219 8.5953 8.5953 8.7821 8.7821 9.0552 9.0552 9.4139 9.4139 9.8730 9.8730 10.2409 10.2409 10.5179 10.5179 11.4952 11.4952 12.6029 12.6029 12.6574 12.6574 k = 0.0000 0.2292-0.0000 ( 10259 PWs) bands (ev): -5.2176 -5.2176 -4.0284 -4.0284 -3.6571 -3.6571 -3.6529 -3.6529 -2.4565 -2.4565 -2.4260 -2.4260 -2.3770 -2.3770 -1.6906 -1.6906 2.6889 2.6889 2.7365 2.7365 2.9427 2.9427 3.1307 3.1307 3.3224 3.3224 3.4647 3.4647 3.6313 3.6313 4.1431 4.1431 4.2779 4.2779 4.3872 4.3872 4.4781 4.4781 4.5812 4.5812 4.6816 4.6816 4.7476 4.7476 4.7799 4.7799 4.8940 4.8940 5.0390 5.0390 5.2434 5.2434 5.2707 5.2707 5.3389 5.3389 5.3574 5.3574 5.3967 5.3967 5.4549 5.4549 5.4682 5.4682 5.4988 5.4988 5.5683 5.5683 5.6147 5.6147 5.6588 5.6588 5.7303 5.7303 6.0135 6.0135 6.1104 6.1104 6.4339 6.4339 6.4665 6.4665 6.6306 6.6306 6.8061 6.8061 7.8693 7.8693 8.3436 8.3436 8.5820 8.5820 8.8069 8.8069 9.0910 9.0910 9.4146 9.4146 9.8453 9.8453 10.1812 10.1812 10.4704 10.4704 11.5281 11.5281 12.4725 12.4725 12.5602 12.5602 k = 0.0000 0.2500-0.0000 ( 10251 PWs) bands (ev): -5.1915 -5.1915 -4.0811 -4.0811 -3.6538 -3.6538 -3.6497 -3.6497 -2.4473 -2.4473 -2.4100 -2.4100 -2.3637 -2.3637 -1.7195 -1.7195 2.6461 2.6461 2.6854 2.6854 2.9256 2.9256 3.1407 3.1407 3.3179 3.3179 3.4457 3.4457 3.6965 3.6965 4.1592 4.1592 4.3190 4.3190 4.3891 4.3891 4.4625 4.4625 4.5923 4.5923 4.6895 4.6895 4.7590 4.7590 4.7892 4.7892 4.9465 4.9465 5.0809 5.0809 5.2320 5.2320 5.2576 5.2576 5.3368 5.3368 5.3595 5.3595 5.4032 5.4032 5.4557 5.4557 5.4785 5.4785 5.5026 5.5026 5.5687 5.5687 5.6143 5.6143 5.6635 5.6635 5.7510 5.7510 5.9963 5.9963 6.0806 6.0806 6.4678 6.4678 6.5003 6.5003 6.6536 6.6536 6.8133 6.8133 7.8548 7.8548 8.2592 8.2592 8.5675 8.5675 8.8416 8.8416 9.1146 9.1146 9.4202 9.4202 9.8213 9.8213 10.1204 10.1204 10.4220 10.4220 11.5641 11.5641 12.3441 12.3441 12.4664 12.4664 k = 0.0000 0.2708-0.0000 ( 10267 PWs) bands (ev): -5.1633 -5.1633 -4.1350 -4.1350 -3.6506 -3.6506 -3.6464 -3.6464 -2.4377 -2.4377 -2.3925 -2.3925 -2.3519 -2.3519 -1.7499 -1.7499 2.6050 2.6050 2.6374 2.6374 2.9121 2.9121 3.1511 3.1511 3.3111 3.3111 3.4244 3.4244 3.7708 3.7708 4.1725 4.1725 4.3519 4.3519 4.3850 4.3850 4.4524 4.4524 4.6052 4.6052 4.7007 4.7007 4.7704 4.7704 4.7970 4.7970 4.9957 4.9957 5.1117 5.1117 5.2219 5.2219 5.2486 5.2486 5.3346 5.3346 5.3607 5.3607 5.4103 5.4103 5.4574 5.4574 5.4893 5.4893 5.5065 5.5065 5.5701 5.5701 5.6154 5.6154 5.6694 5.6694 5.7739 5.7739 5.9771 5.9771 6.0569 6.0569 6.5058 6.5058 6.5375 6.5375 6.6670 6.6670 6.8143 6.8143 7.8463 7.8463 8.1791 8.1791 8.5487 8.5487 8.8791 8.8791 9.1254 9.1254 9.4306 9.4306 9.8013 9.8013 10.0588 10.0588 10.3733 10.3733 11.6039 11.6039 12.2254 12.2254 12.3753 12.3753 k = 0.0000 0.2917-0.0000 ( 10267 PWs) bands (ev): -5.1330 -5.1330 -4.1898 -4.1898 -3.6473 -3.6473 -3.6433 -3.6433 -2.4277 -2.4277 -2.3736 -2.3736 -2.3418 -2.3418 -1.7813 -1.7813 2.5662 2.5662 2.5929 2.5929 2.9024 2.9024 3.1615 3.1615 3.3020 3.3020 3.4021 3.4021 3.8520 3.8520 4.1837 4.1837 4.3751 4.3751 4.3772 4.3772 4.4480 4.4480 4.6199 4.6199 4.7148 4.7148 4.7822 4.7822 4.8043 4.8043 5.0345 5.0345 5.1291 5.1291 5.2106 5.2106 5.2508 5.2508 5.3324 5.3324 5.3607 5.3607 5.4171 5.4171 5.4622 5.4622 5.4995 5.4995 5.5102 5.5102 5.5728 5.5728 5.6181 5.6181 5.6764 5.6764 5.7986 5.7986 5.9538 5.9538 6.0424 6.0424 6.5450 6.5450 6.5774 6.5774 6.6622 6.6622 6.8214 6.8214 7.8436 7.8436 8.1069 8.1069 8.5239 8.5239 8.9165 8.9165 9.1263 9.1263 9.4441 9.4441 9.7854 9.7854 9.9971 9.9971 10.3244 10.3244 11.6478 11.6478 12.1199 12.1199 12.2894 12.2894 k = 0.0000 0.3125-0.0000 ( 10283 PWs) bands (ev): -5.1006 -5.1006 -4.2450 -4.2450 -3.6441 -3.6441 -3.6402 -3.6402 -2.4174 -2.4174 -2.3534 -2.3534 -2.3334 -2.3334 -1.8137 -1.8137 2.5300 2.5300 2.5522 2.5522 2.8966 2.8966 3.1714 3.1714 3.2903 3.2903 3.3805 3.3805 3.9384 3.9384 4.1936 4.1936 4.3676 4.3676 4.3898 4.3898 4.4476 4.4476 4.6363 4.6363 4.7310 4.7310 4.7946 4.7946 4.8114 4.8114 5.0532 5.0532 5.1402 5.1402 5.1997 5.1997 5.2618 5.2618 5.3303 5.3303 5.3593 5.3593 5.4226 5.4226 5.4710 5.4710 5.5084 5.5084 5.5138 5.5138 5.5771 5.5771 5.6224 5.6224 5.6851 5.6851 5.8241 5.8241 5.9273 5.9273 6.0368 6.0368 6.5636 6.5636 6.6177 6.6177 6.6567 6.6567 6.8423 6.8423 7.8455 7.8455 8.0428 8.0428 8.4925 8.4925 8.9520 8.9520 9.1217 9.1217 9.4575 9.4575 9.7730 9.7730 9.9359 9.9359 10.2757 10.2757 11.6954 11.6954 12.0301 12.0301 12.2112 12.2112 k = 0.0000 0.3333-0.0000 ( 10291 PWs) bands (ev): -5.0662 -5.0662 -4.3004 -4.3004 -3.6411 -3.6411 -3.6374 -3.6374 -2.4071 -2.4071 -2.3318 -2.3318 -2.3266 -2.3266 -1.8468 -1.8468 2.4968 2.4968 2.5153 2.5153 2.8948 2.8948 3.1795 3.1795 3.2756 3.2756 3.3615 3.3615 4.0280 4.0280 4.2028 4.2028 4.3600 4.3600 4.3966 4.3966 4.4495 4.4495 4.6541 4.6541 4.7480 4.7480 4.8073 4.8073 4.8185 4.8185 5.0494 5.0494 5.1444 5.1444 5.1998 5.1998 5.2714 5.2714 5.3283 5.3283 5.3577 5.3577 5.4265 5.4265 5.4833 5.4833 5.5157 5.5157 5.5174 5.5174 5.5829 5.5829 5.6278 5.6278 5.6954 5.6954 5.8468 5.8468 5.9033 5.9033 6.0374 6.0374 6.5202 6.5202 6.6628 6.6628 6.6939 6.6939 6.8734 6.8734 7.8489 7.8489 7.9864 7.9864 8.4549 8.4549 8.9846 8.9846 9.1159 9.1159 9.4684 9.4684 9.7632 9.7632 9.8767 9.8767 10.2271 10.2271 11.7448 11.7448 11.9591 11.9591 12.1427 12.1427 k = 0.0000 0.3542-0.0000 ( 10275 PWs) bands (ev): -5.0298 -5.0298 -4.3558 -4.3558 -3.6382 -3.6382 -3.6348 -3.6348 -2.3967 -2.3967 -2.3220 -2.3220 -2.3086 -2.3086 -1.8804 -1.8804 2.4669 2.4669 2.4825 2.4825 2.8970 2.8970 3.1832 3.1832 3.2600 3.2600 3.3463 3.3463 4.1169 4.1169 4.2127 4.2127 4.3563 4.3563 4.3993 4.3993 4.4515 4.4515 4.6733 4.6733 4.7647 4.7647 4.8196 4.8196 4.8263 4.8263 5.0325 5.0325 5.1336 5.1336 5.2146 5.2146 5.2729 5.2729 5.3265 5.3265 5.3586 5.3586 5.4291 5.4291 5.4968 5.4968 5.5208 5.5208 5.5222 5.5222 5.5899 5.5899 5.6338 5.6338 5.7075 5.7075 5.8484 5.8484 5.9011 5.9011 6.0417 6.0417 6.4452 6.4452 6.7132 6.7132 6.7515 6.7515 6.9092 6.9092 7.8430 7.8430 7.9445 7.9445 8.4120 8.4120 9.0131 9.0131 9.1122 9.1122 9.4753 9.4753 9.7526 9.7526 9.8233 9.8233 10.1789 10.1789 11.7878 11.7878 11.9145 11.9145 12.0858 12.0858 k = 0.0000 0.3750-0.0000 ( 10275 PWs) bands (ev): -4.9915 -4.9915 -4.4109 -4.4109 -3.6356 -3.6356 -3.6324 -3.6324 -2.3864 -2.3864 -2.3189 -2.3189 -2.2843 -2.2843 -1.9142 -1.9142 2.4407 2.4407 2.4537 2.4537 2.9031 2.9031 3.1771 3.1771 3.2495 3.2495 3.3345 3.3345 4.1902 4.1902 4.2303 4.2303 4.3624 4.3624 4.4007 4.4007 4.4528 4.4528 4.6935 4.6935 4.7799 4.7799 4.8288 4.8288 4.8373 4.8373 5.0097 5.0097 5.1157 5.1157 5.2295 5.2295 5.2652 5.2652 5.3242 5.3242 5.3637 5.3637 5.4304 5.4304 5.5083 5.5083 5.5239 5.5239 5.5307 5.5307 5.5979 5.5979 5.6394 5.6394 5.7217 5.7217 5.8260 5.8260 5.9239 5.9239 6.0472 6.0472 6.3597 6.3597 6.7653 6.7653 6.8183 6.8183 6.9460 6.9460 7.8071 7.8071 7.9338 7.9338 8.3651 8.3651 9.0370 9.0370 9.1125 9.1125 9.4780 9.4780 9.7279 9.7279 9.7899 9.7899 10.1312 10.1312 11.8019 11.8019 11.9138 11.9138 12.0452 12.0452 k = 0.0000 0.3958-0.0000 ( 10275 PWs) bands (ev): -4.9513 -4.9513 -4.4655 -4.4655 -3.6332 -3.6332 -3.6305 -3.6305 -2.3763 -2.3763 -2.3176 -2.3176 -2.2587 -2.2587 -1.9482 -1.9482 2.4184 2.4184 2.4291 2.4291 2.9130 2.9130 3.1584 3.1584 3.2485 3.2485 3.3250 3.3250 4.2165 4.2165 4.2664 4.2664 4.3901 4.3901 4.4076 4.4076 4.4561 4.4561 4.7146 4.7146 4.7931 4.7931 4.8353 4.8353 4.8505 4.8505 4.9844 4.9844 5.0958 5.0958 5.2243 5.2243 5.2634 5.2634 5.3214 5.3214 5.3718 5.3718 5.4304 5.4304 5.5150 5.5150 5.5259 5.5259 5.5439 5.5439 5.6063 5.6063 5.6442 5.6442 5.7382 5.7382 5.7998 5.7998 5.9511 5.9511 6.0515 6.0515 6.2725 6.2725 6.8176 6.8176 6.8912 6.8912 6.9813 6.9813 7.7459 7.7459 7.9471 7.9471 8.3159 8.3159 9.0560 9.0560 9.1166 9.1166 9.4776 9.4776 9.6831 9.6831 9.7838 9.7838 10.0844 10.0844 11.7917 11.7917 11.9309 11.9309 12.0407 12.0407 k = 0.0000 0.4167-0.0000 ( 10255 PWs) bands (ev): -4.9094 -4.9094 -4.5194 -4.5194 -3.6311 -3.6311 -3.6289 -3.6289 -2.3665 -2.3665 -2.3179 -2.3179 -2.2318 -2.2318 -1.9820 -1.9820 2.4001 2.4001 2.4087 2.4087 2.9266 2.9266 3.1317 3.1317 3.2538 3.2538 3.3168 3.3168 4.2268 4.2268 4.2809 4.2809 4.4006 4.4006 4.4347 4.4347 4.4935 4.4935 4.7365 4.7365 4.8037 4.8037 4.8409 4.8409 4.8637 4.8637 4.9583 4.9583 5.0755 5.0755 5.1938 5.1938 5.2729 5.2729 5.3185 5.3185 5.3811 5.3811 5.4292 5.4292 5.5187 5.5187 5.5270 5.5270 5.5598 5.5598 5.6142 5.6142 5.6484 5.6484 5.7565 5.7565 5.7752 5.7752 5.9770 5.9770 6.0514 6.0514 6.1915 6.1915 6.8688 6.8688 6.9665 6.9665 7.0145 7.0145 7.6727 7.6727 7.9696 7.9696 8.2663 8.2663 9.0713 9.0713 9.1226 9.1226 9.4758 9.4758 9.6345 9.6345 9.7904 9.7904 10.0388 10.0388 11.7832 11.7832 11.9189 11.9189 12.0897 12.0897 k = 0.0000 0.4375-0.0000 ( 10247 PWs) bands (ev): -4.8657 -4.8657 -4.5725 -4.5725 -3.6294 -3.6294 -3.6276 -3.6276 -2.3573 -2.3573 -2.3198 -2.3198 -2.2038 -2.2038 -2.0156 -2.0156 2.3861 2.3861 2.3925 2.3925 2.9438 2.9438 3.1019 3.1019 3.2614 3.2614 3.3093 3.3093 4.2353 4.2353 4.2805 4.2805 4.4046 4.4046 4.4359 4.4359 4.5781 4.5781 4.7592 4.7592 4.8110 4.8110 4.8461 4.8461 4.8747 4.8747 4.9328 4.9328 5.0562 5.0562 5.1511 5.1511 5.2827 5.2827 5.3153 5.3153 5.3903 5.3903 5.4268 5.4268 5.5212 5.5212 5.5274 5.5274 5.5759 5.5759 5.6203 5.6203 5.6531 5.6531 5.7473 5.7473 5.7831 5.7831 5.9956 5.9956 6.0423 6.0423 6.1284 6.1284 6.9171 6.9171 7.0194 7.0194 7.0667 7.0667 7.5921 7.5921 7.9964 7.9964 8.2179 8.2179 9.0846 9.0846 9.1275 9.1275 9.4748 9.4748 9.5895 9.5895 9.8042 9.8042 9.9949 9.9949 11.7830 11.7830 11.8949 11.8949 12.1646 12.1646 k = 0.0000 0.4583-0.0000 ( 10247 PWs) bands (ev): -4.8204 -4.8204 -4.6245 -4.6245 -3.6281 -3.6281 -3.6269 -3.6269 -2.3486 -2.3486 -2.3232 -2.3232 -2.1746 -2.1746 -2.0488 -2.0488 2.3762 2.3762 2.3805 2.3805 2.9642 2.9642 3.0714 3.0714 3.2698 3.2698 3.3019 3.3019 4.2435 4.2435 4.2752 4.2752 4.4092 4.4092 4.4318 4.4318 4.6672 4.6672 4.7824 4.7824 4.8143 4.8143 4.8512 4.8512 4.8793 4.8793 4.9100 4.9100 5.0395 5.0395 5.1023 5.1023 5.2908 5.2908 5.3118 5.3118 5.3989 5.3989 5.4234 5.4234 5.5230 5.5230 5.5272 5.5272 5.5912 5.5912 5.6228 5.6228 5.6601 5.6601 5.7248 5.7248 5.8108 5.8108 5.9797 5.9797 6.0397 6.0397 6.0957 6.0957 6.9603 6.9603 7.0352 7.0352 7.1489 7.1489 7.5066 7.5066 8.0258 8.0258 8.1723 8.1723 9.0971 9.0971 9.1290 9.1290 9.4768 9.4768 9.5510 9.5510 9.8241 9.8241 9.9534 9.9534 11.7909 11.7909 11.8699 11.8699 12.2502 12.2502 k = 0.0000 0.4792-0.0000 ( 10234 PWs) bands (ev): -4.7735 -4.7735 -4.6755 -4.6755 -3.6271 -3.6271 -3.6265 -3.6265 -2.3408 -2.3408 -2.3279 -2.3279 -2.1444 -2.1444 -2.0814 -2.0814 2.3708 2.3708 2.3729 2.3729 2.9876 2.9876 3.0417 3.0417 3.2783 3.2783 3.2943 3.2943 4.2518 4.2518 4.2679 4.2679 4.4146 4.4146 4.4264 4.4264 4.7456 4.7456 4.8054 4.8054 4.8134 4.8134 4.8569 4.8569 4.8704 4.8704 4.8918 4.8918 5.0288 5.0288 5.0576 5.0576 5.2975 5.2975 5.3077 5.3077 5.4065 5.4065 5.4188 5.4188 5.5245 5.5245 5.5266 5.5266 5.6043 5.6043 5.6208 5.6208 5.6711 5.6711 5.7041 5.7041 5.8449 5.8449 5.9328 5.9328 6.0536 6.0536 6.0804 6.0804 6.9958 6.9958 7.0349 7.0349 7.2373 7.2373 7.4179 7.4179 8.0576 8.0576 8.1303 8.1303 9.1088 9.1088 9.1260 9.1260 9.4840 9.4840 9.5203 9.5203 9.8495 9.8495 9.9148 9.9148 11.8053 11.8053 11.8461 11.8461 12.3423 12.3423 k = 0.0000 0.5000-0.0000 ( 10274 PWs) bands (ev): -4.7252 -4.7252 -4.7252 -4.7252 -3.6266 -3.6266 -3.6266 -3.6266 -2.3338 -2.3338 -2.3338 -2.3338 -2.1134 -2.1134 -2.1134 -2.1134 2.3697 2.3697 2.3697 2.3697 3.0136 3.0136 3.0136 3.0136 3.2864 3.2864 3.2864 3.2864 4.2600 4.2600 4.2600 4.2600 4.4204 4.4204 4.4204 4.4204 4.7936 4.7936 4.7936 4.7936 4.8403 4.8403 4.8403 4.8403 4.8731 4.8731 4.8731 4.8731 5.0318 5.0318 5.0318 5.0318 5.3030 5.3030 5.3030 5.3030 5.4131 5.4131 5.4131 5.4131 5.5256 5.5256 5.5256 5.5256 5.6144 5.6144 5.6144 5.6144 5.6859 5.6859 5.6859 5.6859 5.8857 5.8857 5.8857 5.8857 6.0677 6.0677 6.0677 6.0677 7.0214 7.0214 7.0214 7.0214 7.3276 7.3276 7.3276 7.3276 8.0922 8.0922 8.0922 8.0922 9.1189 9.1189 9.1189 9.1189 9.4982 9.4982 9.4982 9.4982 9.8799 9.8799 9.8799 9.8799 11.8242 11.8242 11.8242 11.8242 12.4390 12.4390 k = 0.0000 0.5000-0.0000 ( 10274 PWs) bands (ev): -4.7252 -4.7252 -4.7252 -4.7252 -3.6266 -3.6266 -3.6266 -3.6266 -2.3338 -2.3338 -2.3338 -2.3338 -2.1134 -2.1134 -2.1134 -2.1134 2.3697 2.3697 2.3697 2.3697 3.0136 3.0136 3.0136 3.0136 3.2864 3.2864 3.2864 3.2864 4.2600 4.2600 4.2600 4.2600 4.4204 4.4204 4.4204 4.4204 4.7936 4.7936 4.7936 4.7936 4.8403 4.8403 4.8403 4.8403 4.8731 4.8731 4.8731 4.8731 5.0318 5.0318 5.0318 5.0318 5.3030 5.3030 5.3030 5.3030 5.4131 5.4131 5.4131 5.4131 5.5256 5.5256 5.5256 5.5256 5.6144 5.6144 5.6144 5.6144 5.6859 5.6859 5.6859 5.6859 5.8857 5.8857 5.8857 5.8857 6.0677 6.0677 6.0677 6.0677 7.0214 7.0214 7.0214 7.0214 7.3276 7.3276 7.3276 7.3276 8.0922 8.0922 8.0922 8.0922 9.1189 9.1189 9.1189 9.1189 9.4982 9.4982 9.4982 9.4982 9.8799 9.8799 9.8799 9.8799 11.8242 11.8242 11.8242 11.8242 12.4390 12.4390 k = 0.0208 0.5000-0.0000 ( 10246 PWs) bands (ev): -4.7242 -4.7242 -4.7242 -4.7242 -3.6279 -3.6279 -3.6279 -3.6279 -2.3336 -2.3336 -2.3336 -2.3336 -2.1140 -2.1140 -2.1140 -2.1140 2.3731 2.3731 2.3731 2.3731 3.0115 3.0115 3.0115 3.0115 3.2825 3.2825 3.2825 3.2825 4.2636 4.2636 4.2636 4.2636 4.4180 4.4180 4.4180 4.4180 4.7919 4.7919 4.7919 4.7919 4.8399 4.8399 4.8399 4.8399 4.8705 4.8705 4.8705 4.8705 5.0418 5.0418 5.0418 5.0418 5.3031 5.3031 5.3031 5.3031 5.4134 5.4134 5.4134 5.4134 5.5254 5.5254 5.5254 5.5254 5.6151 5.6151 5.6151 5.6151 5.6873 5.6873 5.6873 5.6873 5.8864 5.8864 5.8864 5.8864 6.0681 6.0681 6.0681 6.0681 7.0218 7.0218 7.0218 7.0218 7.3267 7.3267 7.3267 7.3267 8.0906 8.0906 8.0906 8.0906 9.1078 9.1078 9.1078 9.1078 9.4963 9.4963 9.4963 9.4963 9.8894 9.8894 9.8894 9.8894 11.8250 11.8250 11.8250 11.8250 12.4284 12.4284 k = 0.0417 0.5000-0.0000 ( 10248 PWs) bands (ev): -4.7212 -4.7212 -4.7212 -4.7212 -3.6318 -3.6318 -3.6318 -3.6318 -2.3332 -2.3332 -2.3332 -2.3332 -2.1161 -2.1161 -2.1161 -2.1161 2.3835 2.3835 2.3835 2.3835 3.0055 3.0055 3.0055 3.0055 3.2711 3.2711 3.2711 3.2711 4.2739 4.2739 4.2739 4.2739 4.4114 4.4114 4.4114 4.4114 4.7869 4.7869 4.7869 4.7869 4.8388 4.8388 4.8388 4.8388 4.8656 4.8656 4.8656 4.8656 5.0681 5.0681 5.0681 5.0681 5.3035 5.3035 5.3035 5.3035 5.4141 5.4141 5.4141 5.4141 5.5245 5.5245 5.5245 5.5245 5.6172 5.6172 5.6172 5.6172 5.6913 5.6913 5.6913 5.6913 5.8889 5.8889 5.8889 5.8889 6.0694 6.0694 6.0694 6.0694 7.0231 7.0231 7.0231 7.0231 7.3241 7.3241 7.3241 7.3241 8.0859 8.0859 8.0859 8.0859 9.0754 9.0754 9.0754 9.0754 9.4925 9.4925 9.4925 9.4925 9.9148 9.9148 9.9148 9.9148 11.8274 11.8274 11.8274 11.8274 12.3980 12.3980 k = 0.0625 0.5000-0.0000 ( 10244 PWs) bands (ev): -4.7163 -4.7163 -4.7163 -4.7163 -3.6382 -3.6382 -3.6382 -3.6382 -2.3324 -2.3324 -2.3324 -2.3324 -2.1195 -2.1195 -2.1195 -2.1195 2.4005 2.4005 2.4005 2.4005 2.9956 2.9956 2.9956 2.9956 3.2532 3.2532 3.2532 3.2532 4.2889 4.2889 4.2889 4.2889 4.4024 4.4024 4.4024 4.4024 4.7794 4.7794 4.7794 4.7794 4.8376 4.8376 4.8376 4.8376 4.8625 4.8625 4.8625 4.8625 5.1034 5.1034 5.1034 5.1034 5.3043 5.3043 5.3043 5.3043 5.4152 5.4152 5.4152 5.4152 5.5230 5.5230 5.5230 5.5230 5.6205 5.6205 5.6205 5.6205 5.6976 5.6976 5.6976 5.6976 5.8938 5.8938 5.8938 5.8938 6.0715 6.0715 6.0715 6.0715 7.0255 7.0255 7.0255 7.0255 7.3197 7.3197 7.3197 7.3197 8.0783 8.0783 8.0783 8.0783 9.0241 9.0241 9.0241 9.0241 9.4902 9.4902 9.4902 9.4902 9.9503 9.9503 9.9503 9.9503 11.8317 11.8317 11.8317 11.8317 12.3512 12.3512 k = 0.0833 0.5000-0.0000 ( 10248 PWs) bands (ev): -4.7093 -4.7093 -4.7093 -4.7093 -3.6472 -3.6472 -3.6472 -3.6472 -2.3313 -2.3313 -2.3313 -2.3313 -2.1241 -2.1241 -2.1241 -2.1241 2.4236 2.4236 2.4236 2.4236 2.9820 2.9820 2.9820 2.9820 3.2302 3.2302 3.2302 3.2302 4.3043 4.3043 4.3043 4.3043 4.3954 4.3954 4.3954 4.3954 4.7710 4.7710 4.7710 4.7710 4.8370 4.8370 4.8370 4.8370 4.8619 4.8619 4.8619 4.8619 5.1420 5.1420 5.1420 5.1420 5.3058 5.3058 5.3058 5.3058 5.4168 5.4168 5.4168 5.4168 5.5211 5.5211 5.5211 5.5211 5.6248 5.6248 5.6248 5.6248 5.7058 5.7058 5.7058 5.7058 5.9022 5.9022 5.9022 5.9022 6.0746 6.0746 6.0746 6.0746 7.0293 7.0293 7.0293 7.0293 7.3133 7.3133 7.3133 7.3133 8.0681 8.0681 8.0681 8.0681 8.9578 8.9578 8.9578 8.9578 9.4912 9.4912 9.4912 9.4912 9.9897 9.9897 9.9897 9.9897 11.8383 11.8383 11.8383 11.8383 12.2923 12.2923 k = 0.1042 0.5000-0.0000 ( 10248 PWs) bands (ev): -4.7004 -4.7004 -4.7004 -4.7004 -3.6588 -3.6588 -3.6588 -3.6588 -2.3298 -2.3298 -2.3298 -2.3298 -2.1298 -2.1298 -2.1298 -2.1298 2.4522 2.4522 2.4522 2.4522 2.9652 2.9652 2.9652 2.9652 3.2039 3.2039 3.2039 3.2039 4.3121 4.3121 4.3121 4.3121 4.3981 4.3981 4.3981 4.3981 4.7633 4.7633 4.7633 4.7633 4.8371 4.8371 4.8371 4.8371 4.8637 4.8637 4.8637 4.8637 5.1791 5.1791 5.1791 5.1791 5.3086 5.3086 5.3086 5.3086 5.4190 5.4190 5.4190 5.4190 5.5188 5.5188 5.5188 5.5188 5.6296 5.6296 5.6296 5.6296 5.7146 5.7146 5.7146 5.7146 5.9160 5.9160 5.9160 5.9160 6.0787 6.0787 6.0787 6.0787 7.0349 7.0349 7.0349 7.0349 7.3047 7.3047 7.3047 7.3047 8.0557 8.0557 8.0557 8.0557 8.8807 8.8807 8.8807 8.8807 9.4955 9.4955 9.4955 9.4955 10.0286 10.0286 10.0286 10.0286 11.8473 11.8473 11.8473 11.8473 12.2260 12.2260 k = 0.1250 0.5000-0.0000 ( 10248 PWs) bands (ev): -4.6896 -4.6896 -4.6896 -4.6896 -3.6728 -3.6728 -3.6728 -3.6728 -2.3282 -2.3282 -2.3282 -2.3282 -2.1364 -2.1364 -2.1364 -2.1364 2.4852 2.4852 2.4852 2.4852 2.9455 2.9455 2.9455 2.9455 3.1763 3.1763 3.1763 3.1763 4.3072 4.3072 4.3072 4.3072 4.4153 4.4153 4.4153 4.4153 4.7568 4.7568 4.7568 4.7568 4.8377 4.8377 4.8377 4.8377 4.8675 4.8675 4.8675 4.8675 5.2114 5.2114 5.2114 5.2114 5.3133 5.3133 5.3133 5.3133 5.4218 5.4218 5.4218 5.4218 5.5165 5.5165 5.5165 5.5165 5.6347 5.6347 5.6347 5.6347 5.7225 5.7225 5.7225 5.7225 5.9371 5.9371 5.9371 5.9371 6.0843 6.0843 6.0843 6.0843 7.0429 7.0429 7.0429 7.0429 7.2937 7.2937 7.2937 7.2937 8.0415 8.0415 8.0415 8.0415 8.7968 8.7968 8.7968 8.7968 9.5020 9.5020 9.5020 9.5020 10.0639 10.0639 10.0639 10.0639 11.8584 11.8584 11.8584 11.8584 12.1567 12.1567 k = 0.1458 0.5000-0.0000 ( 10248 PWs) bands (ev): -4.6769 -4.6769 -4.6769 -4.6769 -3.6893 -3.6893 -3.6893 -3.6893 -2.3262 -2.3262 -2.3262 -2.3262 -2.1438 -2.1438 -2.1438 -2.1438 2.5212 2.5212 2.5212 2.5212 2.9235 2.9235 2.9235 2.9235 3.1495 3.1495 3.1495 3.1495 4.2944 4.2944 4.2944 4.2944 4.4420 4.4420 4.4420 4.4420 4.7519 4.7519 4.7519 4.7519 4.8388 4.8388 4.8388 4.8388 4.8731 4.8731 4.8731 4.8731 5.2361 5.2361 5.2361 5.2361 5.3203 5.3203 5.3203 5.3203 5.4251 5.4251 5.4251 5.4251 5.5142 5.5142 5.5142 5.5142 5.6395 5.6395 5.6395 5.6395 5.7280 5.7280 5.7280 5.7280 5.9663 5.9663 5.9663 5.9663 6.0922 6.0922 6.0922 6.0922 7.0535 7.0535 7.0535 7.0535 7.2801 7.2801 7.2801 7.2801 8.0260 8.0260 8.0260 8.0260 8.7094 8.7094 8.7094 8.7094 9.5097 9.5097 9.5097 9.5097 10.0934 10.0934 10.0934 10.0934 11.8699 11.8699 11.8699 11.8699 12.0892 12.0892 k = 0.1667 0.5000-0.0000 ( 10232 PWs) bands (ev): -4.6623 -4.6623 -4.6623 -4.6623 -3.7081 -3.7081 -3.7081 -3.7081 -2.3240 -2.3240 -2.3240 -2.3240 -2.1518 -2.1518 -2.1518 -2.1518 2.5581 2.5581 2.5581 2.5581 2.8998 2.8998 2.8998 2.8998 3.1263 3.1263 3.1263 3.1263 4.2789 4.2789 4.2789 4.2789 4.4723 4.4723 4.4723 4.4723 4.7482 4.7482 4.7482 4.7482 4.8404 4.8404 4.8404 4.8404 4.8805 4.8805 4.8805 4.8805 5.2530 5.2530 5.2530 5.2530 5.3291 5.3291 5.3291 5.3291 5.4288 5.4288 5.4288 5.4288 5.5122 5.5122 5.5122 5.5122 5.6435 5.6435 5.6435 5.6435 5.7301 5.7301 5.7301 5.7301 6.0014 6.0014 6.0014 6.0014 6.1052 6.1052 6.1052 6.1052 7.0672 7.0672 7.0672 7.0672 7.2640 7.2640 7.2640 7.2640 8.0094 8.0094 8.0094 8.0094 8.6211 8.6211 8.6211 8.6211 9.5174 9.5174 9.5174 9.5174 10.1157 10.1157 10.1157 10.1157 11.8755 11.8755 11.8755 11.8755 12.0323 12.0323 k = 0.1875 0.5000-0.0000 ( 10240 PWs) bands (ev): -4.6458 -4.6458 -4.6458 -4.6458 -3.7292 -3.7292 -3.7292 -3.7292 -2.3215 -2.3215 -2.3215 -2.3215 -2.1602 -2.1602 -2.1602 -2.1602 2.5928 2.5928 2.5928 2.5928 2.8747 2.8747 2.8747 2.8747 3.1099 3.1099 3.1099 3.1099 4.2629 4.2629 4.2629 4.2629 4.5032 4.5032 4.5032 4.5032 4.7457 4.7457 4.7457 4.7457 4.8426 4.8426 4.8426 4.8426 4.8894 4.8894 4.8894 4.8894 5.2639 5.2639 5.2639 5.2639 5.3377 5.3377 5.3377 5.3377 5.4322 5.4322 5.4322 5.4322 5.5107 5.5107 5.5107 5.5107 5.6465 5.6465 5.6465 5.6465 5.7288 5.7288 5.7288 5.7288 6.0346 6.0346 6.0346 6.0346 6.1300 6.1300 6.1300 6.1300 7.0837 7.0837 7.0837 7.0837 7.2460 7.2460 7.2460 7.2460 7.9920 7.9920 7.9920 7.9920 8.5342 8.5342 8.5342 8.5342 9.5243 9.5243 9.5243 9.5243 10.1298 10.1298 10.1298 10.1298 11.8597 11.8597 11.8597 11.8597 12.0025 12.0025 k = 0.2083 0.5000-0.0000 ( 10228 PWs) bands (ev): -4.6275 -4.6275 -4.6275 -4.6275 -3.7524 -3.7524 -3.7524 -3.7524 -2.3188 -2.3188 -2.3188 -2.3188 -2.1688 -2.1688 -2.1688 -2.1688 2.6218 2.6218 2.6218 2.6218 2.8489 2.8489 2.8489 2.8489 3.1044 3.1044 3.1044 3.1044 4.2475 4.2475 4.2475 4.2475 4.5331 4.5331 4.5331 4.5331 4.7440 4.7440 4.7440 4.7440 4.8459 4.8459 4.8459 4.8459 4.8997 4.8997 4.8997 4.8997 5.2711 5.2711 5.2711 5.2711 5.3446 5.3446 5.3446 5.3446 5.4345 5.4345 5.4345 5.4345 5.5101 5.5101 5.5101 5.5101 5.6481 5.6481 5.6481 5.6481 5.7245 5.7245 5.7245 5.7245 6.0568 6.0568 6.0568 6.0568 6.1736 6.1736 6.1736 6.1736 7.1015 7.1015 7.1015 7.1015 7.2279 7.2279 7.2279 7.2279 7.9740 7.9740 7.9740 7.9740 8.4508 8.4508 8.4508 8.4508 9.5298 9.5298 9.5298 9.5298 10.1352 10.1352 10.1352 10.1352 11.8167 11.8167 11.8167 11.8167 12.0061 12.0061 k = 0.2292 0.5000-0.0000 ( 10232 PWs) bands (ev): -4.6075 -4.6075 -4.6075 -4.6075 -3.7777 -3.7777 -3.7777 -3.7777 -2.3160 -2.3160 -2.3160 -2.3160 -2.1775 -2.1775 -2.1775 -2.1775 2.6414 2.6414 2.6414 2.6414 2.8226 2.8226 2.8226 2.8226 3.1137 3.1137 3.1137 3.1137 4.2329 4.2329 4.2329 4.2329 4.5608 4.5608 4.5608 4.5608 4.7429 4.7429 4.7429 4.7429 4.8503 4.8503 4.8503 4.8503 4.9114 4.9114 4.9114 4.9114 5.2763 5.2763 5.2763 5.2763 5.3493 5.3493 5.3493 5.3493 5.4348 5.4348 5.4348 5.4348 5.5103 5.5103 5.5103 5.5103 5.6479 5.6479 5.6479 5.6479 5.7179 5.7179 5.7179 5.7179 6.0692 6.0692 6.0692 6.0692 6.2318 6.2318 6.2318 6.2318 7.1151 7.1151 7.1151 7.1151 7.2162 7.2162 7.2162 7.2162 7.9555 7.9555 7.9555 7.9555 8.3725 8.3725 8.3725 8.3725 9.5337 9.5337 9.5337 9.5337 10.1316 10.1316 10.1316 10.1316 11.7630 11.7630 11.7630 11.7630 12.0259 12.0259 k = 0.2500 0.5000-0.0000 ( 10234 PWs) bands (ev): -4.5857 -4.5857 -4.5857 -4.5857 -3.8049 -3.8049 -3.8049 -3.8049 -2.3129 -2.3129 -2.3129 -2.3129 -2.1861 -2.1861 -2.1861 -2.1861 2.6497 2.6497 2.6497 2.6497 2.7960 2.7960 2.7960 2.7960 3.1399 3.1399 3.1399 3.1399 4.2190 4.2190 4.2190 4.2190 4.5859 4.5859 4.5859 4.5859 4.7423 4.7423 4.7423 4.7423 4.8561 4.8561 4.8561 4.8561 4.9242 4.9242 4.9242 4.9242 5.2804 5.2804 5.2804 5.2804 5.3521 5.3521 5.3521 5.3521 5.4326 5.4326 5.4326 5.4326 5.5114 5.5114 5.5114 5.5114 5.6459 5.6459 5.6459 5.6459 5.7097 5.7097 5.7097 5.7097 6.0771 6.0771 6.0771 6.0771 6.2960 6.2960 6.2960 6.2960 7.1143 7.1143 7.1143 7.1143 7.2222 7.2222 7.2222 7.2222 7.9364 7.9364 7.9364 7.9364 8.3006 8.3006 8.3006 8.3006 9.5358 9.5358 9.5358 9.5358 10.1191 10.1191 10.1191 10.1191 11.7089 11.7089 11.7089 11.7089 12.0491 12.0491 k = 0.2708 0.5000-0.0000 ( 10234 PWs) bands (ev): -4.5623 -4.5623 -4.5623 -4.5623 -3.8339 -3.8339 -3.8339 -3.8339 -2.3097 -2.3097 -2.3097 -2.3097 -2.1946 -2.1946 -2.1946 -2.1946 2.6478 2.6478 2.6478 2.6478 2.7693 2.7693 2.7693 2.7693 3.1820 3.1820 3.1820 3.1820 4.2056 4.2056 4.2056 4.2056 4.6079 4.6079 4.6079 4.6079 4.7420 4.7420 4.7420 4.7420 4.8636 4.8636 4.8636 4.8636 4.9380 4.9380 4.9380 4.9380 5.2833 5.2833 5.2833 5.2833 5.3538 5.3538 5.3538 5.3538 5.4277 5.4277 5.4277 5.4277 5.5127 5.5127 5.5127 5.5127 5.6420 5.6420 5.6420 5.6420 5.7009 5.7009 5.7009 5.7009 6.0832 6.0832 6.0832 6.0832 6.3596 6.3596 6.3596 6.3596 7.0992 7.0992 7.0992 7.0992 7.2481 7.2481 7.2481 7.2481 7.9166 7.9166 7.9166 7.9166 8.2358 8.2358 8.2358 8.2358 9.5362 9.5362 9.5362 9.5362 10.0983 10.0983 10.0983 10.0983 11.6585 11.6585 11.6585 11.6585 12.0684 12.0684 k = 0.2917 0.5000-0.0000 ( 10238 PWs) bands (ev): -4.5372 -4.5372 -4.5372 -4.5372 -3.8645 -3.8645 -3.8645 -3.8645 -2.3063 -2.3063 -2.3063 -2.3063 -2.2029 -2.2029 -2.2029 -2.2029 2.6384 2.6384 2.6384 2.6384 2.7428 2.7428 2.7428 2.7428 3.2371 3.2371 3.2371 3.2371 4.1923 4.1923 4.1923 4.1923 4.6267 4.6267 4.6267 4.6267 4.7418 4.7418 4.7418 4.7418 4.8728 4.8728 4.8728 4.8728 4.9526 4.9526 4.9526 4.9526 5.2848 5.2848 5.2848 5.2848 5.3550 5.3550 5.3550 5.3550 5.4203 5.4203 5.4203 5.4203 5.5138 5.5138 5.5138 5.5138 5.6362 5.6362 5.6362 5.6362 5.6918 5.6918 5.6918 5.6918 6.0889 6.0889 6.0889 6.0889 6.4165 6.4165 6.4165 6.4165 7.0815 7.0815 7.0815 7.0815 7.2859 7.2859 7.2859 7.2859 7.8959 7.8959 7.8959 7.8959 8.1784 8.1784 8.1784 8.1784 9.5352 9.5352 9.5352 9.5352 10.0697 10.0697 10.0697 10.0697 11.6135 11.6135 11.6135 11.6135 12.0776 12.0776 k = 0.3125 0.5000-0.0000 ( 10250 PWs) bands (ev): -4.5107 -4.5107 -4.5107 -4.5107 -3.8966 -3.8966 -3.8966 -3.8966 -2.3029 -2.3029 -2.3029 -2.3029 -2.2108 -2.2108 -2.2108 -2.2108 2.6245 2.6245 2.6245 2.6245 2.7170 2.7170 2.7170 2.7170 3.3015 3.3015 3.3015 3.3015 4.1786 4.1786 4.1786 4.1786 4.6426 4.6426 4.6426 4.6426 4.7416 4.7416 4.7416 4.7416 4.8836 4.8836 4.8836 4.8836 4.9676 4.9676 4.9676 4.9676 5.2844 5.2844 5.2844 5.2844 5.3562 5.3562 5.3562 5.3562 5.4106 5.4106 5.4106 5.4106 5.5140 5.5140 5.5140 5.5140 5.6292 5.6292 5.6292 5.6292 5.6830 5.6830 5.6830 5.6830 6.0950 6.0950 6.0950 6.0950 6.4603 6.4603 6.4603 6.4603 7.0714 7.0714 7.0714 7.0714 7.3302 7.3302 7.3302 7.3302 7.8742 7.8742 7.8742 7.8742 8.1283 8.1283 8.1283 8.1283 9.5333 9.5333 9.5333 9.5333 10.0345 10.0345 10.0345 10.0345 11.5747 11.5747 11.5747 11.5747 12.0716 12.0716 k = 0.3333 0.5000-0.0000 ( 10254 PWs) bands (ev): -4.4827 -4.4827 -4.4827 -4.4827 -3.9298 -3.9298 -3.9298 -3.9298 -2.2993 -2.2993 -2.2993 -2.2993 -2.2184 -2.2184 -2.2184 -2.2184 2.6085 2.6085 2.6085 2.6085 2.6925 2.6925 2.6925 2.6925 3.3720 3.3720 3.3720 3.3720 4.1639 4.1639 4.1639 4.1639 4.6558 4.6558 4.6558 4.6558 4.7413 4.7413 4.7413 4.7413 4.8962 4.8962 4.8962 4.8962 4.9829 4.9829 4.9829 4.9829 5.2815 5.2815 5.2815 5.2815 5.3574 5.3574 5.3574 5.3574 5.3997 5.3997 5.3997 5.3997 5.5125 5.5125 5.5125 5.5125 5.6220 5.6220 5.6220 5.6220 5.6747 5.6747 5.6747 5.6747 6.1023 6.1023 6.1023 6.1023 6.4851 6.4851 6.4851 6.4851 7.0762 7.0762 7.0762 7.0762 7.3784 7.3784 7.3784 7.3784 7.8514 7.8514 7.8514 7.8514 8.0848 8.0848 8.0848 8.0848 9.5311 9.5311 9.5311 9.5311 9.9939 9.9939 9.9939 9.9939 11.5429 11.5429 11.5429 11.5429 12.0475 12.0475 k = 0.3542 0.5000-0.0000 ( 10246 PWs) bands (ev): -4.4533 -4.4533 -4.4533 -4.4533 -3.9642 -3.9642 -3.9642 -3.9642 -2.2956 -2.2956 -2.2956 -2.2956 -2.2256 -2.2256 -2.2256 -2.2256 2.5921 2.5921 2.5921 2.5921 2.6698 2.6698 2.6698 2.6698 3.4460 3.4460 3.4460 3.4460 4.1475 4.1475 4.1475 4.1475 4.6669 4.6669 4.6669 4.6669 4.7408 4.7408 4.7408 4.7408 4.9105 4.9105 4.9105 4.9105 4.9982 4.9982 4.9982 4.9982 5.2759 5.2759 5.2759 5.2759 5.3557 5.3557 5.3557 5.3557 5.3906 5.3906 5.3906 5.3906 5.5089 5.5089 5.5089 5.5089 5.6158 5.6158 5.6158 5.6158 5.6668 5.6668 5.6668 5.6668 6.1112 6.1112 6.1112 6.1112 6.4883 6.4883 6.4883 6.4883 7.0995 7.0995 7.0995 7.0995 7.4283 7.4283 7.4283 7.4283 7.8274 7.8274 7.8274 7.8274 8.0469 8.0469 8.0469 8.0469 9.5294 9.5294 9.5294 9.5294 9.9494 9.9494 9.9494 9.9494 11.5187 11.5187 11.5187 11.5187 12.0059 12.0059 k = 0.3750 0.5000-0.0000 ( 10262 PWs) bands (ev): -4.4226 -4.4226 -4.4226 -4.4226 -3.9993 -3.9993 -3.9993 -3.9993 -2.2917 -2.2917 -2.2917 -2.2917 -2.2324 -2.2324 -2.2324 -2.2324 2.5765 2.5765 2.5765 2.5765 2.6493 2.6493 2.6493 2.6493 3.5214 3.5214 3.5214 3.5214 4.1289 4.1289 4.1289 4.1289 4.6762 4.6762 4.6762 4.6762 4.7399 4.7399 4.7399 4.7399 4.9261 4.9261 4.9261 4.9261 5.0130 5.0130 5.0130 5.0130 5.2679 5.2679 5.2679 5.2679 5.3463 5.3463 5.3463 5.3463 5.3884 5.3884 5.3884 5.3884 5.5029 5.5029 5.5029 5.5029 5.6113 5.6113 5.6113 5.6113 5.6593 5.6593 5.6593 5.6593 6.1222 6.1222 6.1222 6.1222 6.4724 6.4724 6.4724 6.4724 7.1394 7.1394 7.1394 7.1394 7.4779 7.4779 7.4779 7.4779 7.8027 7.8027 7.8027 7.8027 8.0133 8.0133 8.0133 8.0133 9.5288 9.5288 9.5288 9.5288 9.9024 9.9024 9.9024 9.9024 11.5025 11.5025 11.5025 11.5025 11.9510 11.9510 k = 0.3958 0.5000-0.0000 ( 10256 PWs) bands (ev): -4.3908 -4.3908 -4.3908 -4.3908 -4.0352 -4.0352 -4.0352 -4.0352 -2.2878 -2.2878 -2.2878 -2.2878 -2.2388 -2.2388 -2.2388 -2.2388 2.5624 2.5624 2.5624 2.5624 2.6314 2.6314 2.6314 2.6314 3.5965 3.5965 3.5965 3.5965 4.1072 4.1072 4.1072 4.1072 4.6842 4.6842 4.6842 4.6842 4.7385 4.7385 4.7385 4.7385 4.9430 4.9430 4.9430 4.9430 5.0268 5.0268 5.0268 5.0268 5.2580 5.2580 5.2580 5.2580 5.3296 5.3296 5.3296 5.3296 5.3930 5.3930 5.3930 5.3930 5.4950 5.4950 5.4950 5.4950 5.6089 5.6089 5.6089 5.6089 5.6521 5.6521 5.6521 5.6521 6.1359 6.1359 6.1359 6.1359 6.4432 6.4432 6.4432 6.4432 7.1907 7.1907 7.1907 7.1907 7.5243 7.5243 7.5243 7.5243 7.7787 7.7787 7.7787 7.7787 7.9828 7.9828 7.9828 7.9828 9.5302 9.5302 9.5302 9.5302 9.8549 9.8549 9.8549 9.8549 11.4947 11.4947 11.4947 11.4947 11.8879 11.8879 k = 0.4167 0.5000-0.0000 ( 10248 PWs) bands (ev): -4.3579 -4.3579 -4.3579 -4.3579 -4.0715 -4.0715 -4.0715 -4.0715 -2.2838 -2.2838 -2.2838 -2.2838 -2.2449 -2.2449 -2.2449 -2.2449 2.5503 2.5503 2.5503 2.5503 2.6164 2.6164 2.6164 2.6164 3.6696 3.6696 3.6696 3.6696 4.0817 4.0817 4.0817 4.0817 4.6913 4.6913 4.6913 4.6913 4.7367 4.7367 4.7367 4.7367 4.9609 4.9609 4.9609 4.9609 5.0387 5.0387 5.0387 5.0387 5.2474 5.2474 5.2474 5.2474 5.3097 5.3097 5.3097 5.3097 5.4007 5.4007 5.4007 5.4007 5.4855 5.4855 5.4855 5.4855 5.6085 5.6085 5.6085 5.6085 5.6454 5.6454 5.6454 5.6454 6.1525 6.1525 6.1525 6.1525 6.4066 6.4066 6.4066 6.4066 7.2477 7.2477 7.2477 7.2477 7.5624 7.5624 7.5624 7.5624 7.7590 7.7590 7.7590 7.7590 7.9539 7.9539 7.9539 7.9539 9.5341 9.5341 9.5341 9.5341 9.8088 9.8088 9.8088 9.8088 11.4958 11.4958 11.4958 11.4958 11.8218 11.8218 k = 0.4375 0.5000-0.0000 ( 10232 PWs) bands (ev): -4.3240 -4.3240 -4.3240 -4.3240 -4.1081 -4.1081 -4.1081 -4.1081 -2.2797 -2.2797 -2.2797 -2.2797 -2.2505 -2.2505 -2.2505 -2.2505 2.5406 2.5406 2.5406 2.5406 2.6044 2.6044 2.6044 2.6044 3.7392 3.7392 3.7392 3.7392 4.0517 4.0517 4.0517 4.0517 4.6974 4.6974 4.6974 4.6974 4.7345 4.7345 4.7345 4.7345 4.9794 4.9794 4.9794 4.9794 5.0474 5.0474 5.0474 5.0474 5.2374 5.2374 5.2374 5.2374 5.2895 5.2895 5.2895 5.2895 5.4099 5.4099 5.4099 5.4099 5.4753 5.4753 5.4753 5.4753 5.6097 5.6097 5.6097 5.6097 5.6391 5.6391 5.6391 5.6391 6.1724 6.1724 6.1724 6.1724 6.3671 6.3671 6.3671 6.3671 7.3055 7.3055 7.3055 7.3055 7.5838 7.5838 7.5838 7.5838 7.7512 7.7512 7.7512 7.7512 7.9258 7.9258 7.9258 7.9258 9.5408 9.5408 9.5408 9.5408 9.7662 9.7662 9.7662 9.7662 11.5061 11.5061 11.5061 11.5061 11.7568 11.7568 k = 0.4583 0.5000-0.0000 ( 10234 PWs) bands (ev): -4.2893 -4.2893 -4.2893 -4.2893 -4.1448 -4.1448 -4.1448 -4.1448 -2.2754 -2.2754 -2.2754 -2.2754 -2.2559 -2.2559 -2.2559 -2.2559 2.5335 2.5335 2.5335 2.5335 2.5958 2.5958 2.5958 2.5958 3.8038 3.8038 3.8038 3.8038 4.0170 4.0170 4.0170 4.0170 4.7026 4.7026 4.7026 4.7026 4.7320 4.7320 4.7320 4.7320 4.9974 4.9974 4.9974 4.9974 5.0515 5.0515 5.0515 5.0515 5.2301 5.2301 5.2301 5.2301 5.2711 5.2711 5.2711 5.2711 5.4198 5.4198 5.4198 5.4198 5.4647 5.4647 5.4647 5.4647 5.6119 5.6119 5.6119 5.6119 5.6334 5.6334 5.6334 5.6334 6.1959 6.1959 6.1959 6.1959 6.3276 6.3276 6.3276 6.3276 7.3596 7.3596 7.3596 7.3596 7.5818 7.5818 7.5818 7.5818 7.7614 7.7614 7.7614 7.7614 7.8979 7.8979 7.8979 7.8979 9.5497 9.5497 9.5497 9.5497 9.7299 9.7299 9.7299 9.7299 11.5256 11.5256 11.5256 11.5256 11.6961 11.6961 k = 0.4792 0.5000-0.0000 ( 10248 PWs) bands (ev): -4.2539 -4.2539 -4.2539 -4.2539 -4.1815 -4.1815 -4.1815 -4.1815 -2.2712 -2.2712 -2.2712 -2.2712 -2.2608 -2.2608 -2.2608 -2.2608 2.5292 2.5292 2.5292 2.5292 2.5906 2.5906 2.5906 2.5906 3.8607 3.8607 3.8607 3.8607 3.9786 3.9786 3.9786 3.9786 4.7064 4.7064 4.7064 4.7064 4.7298 4.7298 4.7298 4.7298 5.0129 5.0129 5.0129 5.0129 5.0505 5.0505 5.0505 5.0505 5.2269 5.2269 5.2269 5.2269 5.2570 5.2570 5.2570 5.2570 5.4297 5.4297 5.4297 5.4297 5.4544 5.4544 5.4544 5.4544 5.6146 5.6146 5.6146 5.6146 5.6288 5.6288 5.6288 5.6288 6.2228 6.2228 6.2228 6.2228 6.2903 6.2903 6.2903 6.2903 7.4032 7.4032 7.4032 7.4032 7.5650 7.5650 7.5650 7.5650 7.7828 7.7828 7.7828 7.7828 7.8719 7.8719 7.8719 7.8719 9.5584 9.5584 9.5584 9.5584 9.7040 9.7040 9.7040 9.7040 11.5542 11.5542 11.5542 11.5542 11.6419 11.6419 k = 0.5000 0.5000-0.0000 ( 10280 PWs) bands (ev): -4.2189 -4.2189 -4.2189 -4.2189 -4.2168 -4.2168 -4.2168 -4.2168 -2.2682 -2.2682 -2.2682 -2.2682 -2.2640 -2.2640 -2.2640 -2.2640 2.5278 2.5278 2.5278 2.5278 2.5889 2.5889 2.5889 2.5889 3.8939 3.8939 3.8939 3.8939 3.9516 3.9516 3.9516 3.9516 4.7078 4.7078 4.7078 4.7078 4.7289 4.7289 4.7289 4.7289 5.0201 5.0201 5.0201 5.0201 5.0483 5.0483 5.0483 5.0483 5.2266 5.2266 5.2266 5.2266 5.2512 5.2512 5.2512 5.2512 5.4361 5.4361 5.4361 5.4361 5.4477 5.4477 5.4477 5.4477 5.6161 5.6161 5.6161 5.6161 5.6266 5.6266 5.6266 5.6266 6.2474 6.2474 6.2474 6.2474 6.2622 6.2622 6.2622 6.2622 7.4221 7.4221 7.4221 7.4221 7.5542 7.5542 7.5542 7.5542 7.7961 7.7961 7.7961 7.7961 7.8580 7.8580 7.8580 7.8580 9.5624 9.5624 9.5624 9.5624 9.6941 9.6941 9.6941 9.6941 11.5834 11.5834 11.5834 11.5834 11.6040 11.6040 k = 0.5000 0.5000-0.0000 ( 10280 PWs) bands (ev): -4.2189 -4.2189 -4.2189 -4.2189 -4.2168 -4.2168 -4.2168 -4.2168 -2.2682 -2.2682 -2.2682 -2.2682 -2.2640 -2.2640 -2.2640 -2.2640 2.5278 2.5278 2.5278 2.5278 2.5889 2.5889 2.5889 2.5889 3.8939 3.8939 3.8939 3.8939 3.9516 3.9516 3.9516 3.9516 4.7078 4.7078 4.7078 4.7078 4.7289 4.7289 4.7289 4.7289 5.0201 5.0201 5.0201 5.0201 5.0483 5.0483 5.0483 5.0483 5.2266 5.2266 5.2266 5.2266 5.2512 5.2512 5.2512 5.2512 5.4361 5.4361 5.4361 5.4361 5.4477 5.4477 5.4477 5.4477 5.6161 5.6161 5.6161 5.6161 5.6266 5.6266 5.6266 5.6266 6.2474 6.2474 6.2474 6.2474 6.2622 6.2622 6.2622 6.2622 7.4221 7.4221 7.4221 7.4221 7.5542 7.5542 7.5542 7.5542 7.7961 7.7961 7.7961 7.7961 7.8580 7.8580 7.8580 7.8580 9.5624 9.5624 9.5624 9.5624 9.6941 9.6941 9.6941 9.6941 11.5834 11.5834 11.5834 11.5834 11.6040 11.6040 k = 0.4853 0.4853-0.0000 ( 10242 PWs) bands (ev): -4.2695 -4.2695 -4.2172 -4.2172 -4.2168 -4.2168 -4.1670 -4.1670 -2.2803 -2.2803 -2.2725 -2.2725 -2.2596 -2.2596 -2.2514 -2.2514 2.5046 2.5046 2.5532 2.5532 2.5616 2.5616 2.6194 2.6194 3.8503 3.8503 3.8984 3.8984 3.9425 3.9425 3.9918 3.9918 4.6961 4.6961 4.7164 4.7164 4.7194 4.7194 4.7391 4.7391 5.0089 5.0089 5.0200 5.0200 5.0424 5.0424 5.0557 5.0557 5.2100 5.2100 5.2379 5.2379 5.2471 5.2471 5.2687 5.2687 5.4289 5.4289 5.4366 5.4366 5.4484 5.4484 5.4554 5.4554 5.6124 5.6124 5.6181 5.6181 5.6228 5.6228 5.6332 5.6332 6.1972 6.1972 6.2427 6.2427 6.2649 6.2649 6.3178 6.3178 7.3671 7.3671 7.4568 7.4568 7.5285 7.5285 7.5844 7.5844 7.7771 7.7771 7.8081 7.8081 7.8328 7.8328 7.9012 7.9012 9.5467 9.5467 9.5739 9.5739 9.6703 9.6703 9.7276 9.7276 11.5380 11.5380 11.5888 11.5888 11.5998 11.5998 k = 0.4706 0.4706-0.0000 ( 10251 PWs) bands (ev): -4.3218 -4.3218 -4.2148 -4.2148 -4.2141 -4.2141 -4.1173 -4.1173 -2.2930 -2.2930 -2.2798 -2.2798 -2.2525 -2.2525 -2.2370 -2.2370 2.4841 2.4841 2.5367 2.5367 2.5819 2.5819 2.6530 2.6530 3.7870 3.7870 3.8876 3.8876 3.9469 3.9469 4.0366 4.0366 4.6794 4.6794 4.7113 4.7113 4.7255 4.7255 4.7474 4.7474 4.9907 4.9907 5.0077 5.0077 5.0409 5.0409 5.0598 5.0598 5.1966 5.1966 5.2335 5.2335 5.2643 5.2643 5.2913 5.2913 5.4197 5.4197 5.4346 5.4346 5.4525 5.4525 5.4670 5.4670 5.6079 5.6079 5.6177 5.6177 5.6232 5.6232 5.6412 5.6412 6.1455 6.1455 6.2301 6.2301 6.2741 6.2741 6.3824 6.3824 7.2993 7.2993 7.4639 7.4639 7.5174 7.5174 7.6005 7.6005 7.7671 7.7671 7.8084 7.8084 7.8322 7.8322 7.9536 7.9536 9.5256 9.5256 9.5829 9.5829 9.6593 9.6593 9.7668 9.7668 11.4906 11.4906 11.5905 11.5905 11.6101 11.6101 k = 0.4559 0.4559-0.0000 ( 10241 PWs) bands (ev): -4.3743 -4.3743 -4.2108 -4.2108 -4.2097 -4.2097 -4.0691 -4.0691 -2.3055 -2.3055 -2.2866 -2.2866 -2.2461 -2.2461 -2.2217 -2.2217 2.4663 2.4663 2.5154 2.5154 2.6122 2.6122 2.6895 2.6895 3.7183 3.7183 3.8727 3.8727 3.9517 3.9517 4.0735 4.0735 4.6578 4.6578 4.7080 4.7080 4.7322 4.7322 4.7538 4.7538 4.9697 4.9697 4.9883 4.9883 5.0364 5.0364 5.0652 5.0652 5.1835 5.1835 5.2365 5.2365 5.2806 5.2806 5.3157 5.3157 5.4107 5.4107 5.4332 5.4332 5.4575 5.4575 5.4796 5.4796 5.6039 5.6039 5.6166 5.6166 5.6255 5.6255 5.6500 5.6500 6.0987 6.0987 6.2200 6.2200 6.2775 6.2775 6.4504 6.4504 7.2251 7.2251 7.4453 7.4453 7.5210 7.5210 7.5884 7.5884 7.7682 7.7682 7.8156 7.8156 7.8478 7.8478 8.0100 8.0100 9.5002 9.5002 9.5897 9.5897 9.6613 9.6613 9.8094 9.8094 11.4503 11.4503 11.5958 11.5958 11.6251 11.6251 k = 0.4412 0.4412-0.0000 ( 10249 PWs) bands (ev): -4.4269 -4.4269 -4.2051 -4.2051 -4.2036 -4.2036 -4.0227 -4.0227 -2.3176 -2.3176 -2.2929 -2.2929 -2.2403 -2.2403 -2.2056 -2.2056 2.4515 2.4515 2.4973 2.4973 2.6445 2.6445 2.7289 2.7289 3.6478 3.6478 3.8554 3.8554 3.9540 3.9540 4.0994 4.0994 4.6327 4.6327 4.7076 4.7076 4.7366 4.7366 4.7587 4.7587 4.9479 4.9479 4.9660 4.9660 5.0280 5.0280 5.0740 5.0740 5.1697 5.1697 5.2439 5.2439 5.2961 5.2961 5.3384 5.3384 5.4021 5.4021 5.4332 5.4332 5.4631 5.4631 5.4922 5.4922 5.6011 5.6011 5.6160 5.6160 5.6286 5.6286 5.6591 5.6591 6.0570 6.0570 6.2126 6.2126 6.2732 6.2732 6.5208 6.5208 7.1484 7.1484 7.4143 7.4143 7.5243 7.5243 7.5635 7.5635 7.7614 7.7614 7.8312 7.8312 7.8846 7.8846 8.0684 8.0684 9.4731 9.4731 9.5947 9.5947 9.6736 9.6736 9.8537 9.8537 11.4174 11.4174 11.6050 11.6050 11.6446 11.6446 k = 0.4265 0.4265-0.0000 ( 10237 PWs) bands (ev): -4.4792 -4.4792 -4.1977 -4.1977 -4.1959 -4.1959 -3.9783 -3.9783 -2.3294 -2.3294 -2.2986 -2.2986 -2.2354 -2.2354 -2.1886 -2.1886 2.4395 2.4395 2.4826 2.4826 2.6782 2.6782 2.7710 2.7710 3.5773 3.5773 3.8362 3.8362 3.9522 3.9522 4.1139 4.1139 4.6055 4.6055 4.7083 4.7083 4.7376 4.7376 4.7634 4.7634 4.9254 4.9254 4.9460 4.9460 5.0165 5.0165 5.0859 5.0859 5.1566 5.1566 5.2523 5.2523 5.3104 5.3104 5.3570 5.3570 5.3941 5.3941 5.4354 5.4354 5.4690 5.4690 5.5039 5.5039 5.6004 5.6004 5.6160 5.6160 5.6325 5.6325 5.6682 5.6682 6.0208 6.0208 6.2079 6.2079 6.2601 6.2601 6.5925 6.5925 7.0717 7.0717 7.3748 7.3748 7.5118 7.5118 7.5510 7.5510 7.7498 7.7498 7.8464 7.8464 7.9362 7.9362 8.1277 8.1277 9.4468 9.4468 9.5978 9.5978 9.6933 9.6933 9.8986 9.8986 11.3918 11.3918 11.6184 11.6184 11.6688 11.6688 k = 0.4118 0.4118-0.0000 ( 10243 PWs) bands (ev): -4.5312 -4.5312 -4.1887 -4.1887 -4.1866 -4.1866 -3.9363 -3.9363 -2.3407 -2.3407 -2.3038 -2.3038 -2.2314 -2.2314 -2.1706 -2.1706 2.4303 2.4303 2.4712 2.4712 2.7132 2.7132 2.8161 2.8161 3.5081 3.5081 3.8150 3.8150 3.9447 3.9447 4.1185 4.1185 4.5777 4.5777 4.7075 4.7075 4.7349 4.7349 4.7679 4.7679 4.9033 4.9033 4.9309 4.9309 5.0014 5.0014 5.1001 5.1001 5.1460 5.1460 5.2601 5.2601 5.3230 5.3230 5.3688 5.3688 5.3879 5.3879 5.4403 5.4403 5.4749 5.4749 5.5133 5.5133 5.6021 5.6021 5.6170 5.6170 5.6374 5.6374 5.6768 5.6768 5.9898 5.9898 6.2048 6.2048 6.2381 6.2381 6.6642 6.6642 6.9972 6.9972 7.3280 7.3280 7.4863 7.4863 7.5517 7.5517 7.7365 7.7365 7.8669 7.8669 7.9910 7.9910 8.1872 8.1872 9.4226 9.4226 9.5988 9.5988 9.7185 9.7185 9.9435 9.9435 11.3731 11.3731 11.6362 11.6362 11.6978 11.6978 k = 0.3971 0.3971-0.0000 ( 10257 PWs) bands (ev): -4.5826 -4.5826 -4.1781 -4.1781 -4.1756 -4.1756 -3.8970 -3.8970 -2.3517 -2.3517 -2.3083 -2.3083 -2.2285 -2.2285 -2.1515 -2.1515 2.4239 2.4239 2.4634 2.4634 2.7488 2.7488 2.8638 2.8638 3.4412 3.4412 3.7919 3.7919 3.9302 3.9302 4.1162 4.1162 4.5503 4.5503 4.7022 4.7022 4.7304 4.7304 4.7710 4.7710 4.8836 4.8836 4.9207 4.9207 4.9825 4.9825 5.1127 5.1127 5.1421 5.1421 5.2669 5.2669 5.3334 5.3334 5.3703 5.3703 5.3870 5.3870 5.4473 5.4473 5.4807 5.4807 5.5197 5.5197 5.6061 5.6061 5.6194 5.6194 5.6431 5.6431 5.6845 5.6845 5.9638 5.9638 6.1959 6.1959 6.2137 6.2137 6.7330 6.7330 6.9281 6.9281 7.2758 7.2758 7.4595 7.4595 7.5525 7.5525 7.7234 7.7234 7.8967 7.8967 8.0445 8.0445 8.2463 8.2463 9.4013 9.4013 9.5976 9.5976 9.7472 9.7472 9.9879 9.9879 11.3605 11.3605 11.6592 11.6592 11.7318 11.7318 k = 0.3824 0.3824-0.0000 ( 10259 PWs) bands (ev): -4.6333 -4.6333 -4.1659 -4.1659 -4.1631 -4.1631 -3.8605 -3.8605 -2.3624 -2.3624 -2.3121 -2.3121 -2.2269 -2.2269 -2.1311 -2.1311 2.4201 2.4201 2.4592 2.4592 2.7846 2.7846 2.9143 2.9143 3.3775 3.3775 3.7668 3.7668 3.9076 3.9076 4.1100 4.1100 4.5246 4.5246 4.6914 4.6914 4.7257 4.7257 4.7713 4.7713 4.8671 4.8671 4.9151 4.9151 4.9602 4.9602 5.1154 5.1154 5.1520 5.1520 5.2726 5.2726 5.3412 5.3412 5.3649 5.3649 5.3898 5.3898 5.4550 5.4550 5.4860 5.4860 5.5229 5.5229 5.6104 5.6104 5.6254 5.6254 5.6495 5.6495 5.6910 5.6910 5.9425 5.9425 6.1616 6.1616 6.2058 6.2058 6.7868 6.7868 6.8770 6.8770 7.2208 7.2208 7.4319 7.4319 7.5505 7.5505 7.7128 7.7128 7.9366 7.9366 8.0950 8.0950 8.3048 8.3048 9.3832 9.3832 9.5948 9.5948 9.7776 9.7776 10.0317 10.0317 11.3527 11.3527 11.6880 11.6880 11.7711 11.7711 k = 0.3676 0.3676-0.0000 ( 10249 PWs) bands (ev): -4.6829 -4.6829 -4.1521 -4.1521 -4.1492 -4.1492 -3.8272 -3.8272 -2.3727 -2.3727 -2.3155 -2.3155 -2.2267 -2.2267 -2.1094 -2.1094 2.4187 2.4187 2.4589 2.4589 2.8201 2.8201 2.9673 2.9673 3.3178 3.3178 3.7397 3.7397 3.8772 3.8772 4.1020 4.1020 4.5011 4.5011 4.6766 4.6766 4.7201 4.7201 4.7678 4.7678 4.8528 4.8528 4.9127 4.9127 4.9365 4.9365 5.1119 5.1119 5.1700 5.1700 5.2771 5.2771 5.3463 5.3463 5.3585 5.3585 5.3922 5.3922 5.4620 5.4620 5.4908 5.4908 5.5235 5.5235 5.6125 5.6125 5.6360 5.6360 5.6562 5.6562 5.6960 5.6960 5.9253 5.9253 6.1167 6.1167 6.1994 6.1994 6.7743 6.7743 6.8938 6.8938 7.1661 7.1661 7.4016 7.4016 7.5462 7.5462 7.7086 7.7086 7.9843 7.9843 8.1422 8.1422 8.3625 8.3625 9.3685 9.3685 9.5914 9.5914 9.8081 9.8081 10.0749 10.0749 11.3484 11.3484 11.7234 11.7234 11.8158 11.8158 k = 0.3529 0.3529-0.0000 ( 10237 PWs) bands (ev): -4.7315 -4.7315 -4.1369 -4.1369 -4.1337 -4.1337 -3.7971 -3.7971 -2.3827 -2.3827 -2.3185 -2.3185 -2.2279 -2.2279 -2.0862 -2.0862 2.4197 2.4197 2.4625 2.4625 2.8548 2.8548 3.0225 3.0225 3.2630 3.2630 3.7103 3.7103 3.8403 3.8403 4.0931 4.0931 4.4805 4.4805 4.6603 4.6603 4.7129 4.7129 4.7602 4.7602 4.8398 4.8398 4.9035 4.9035 4.9219 4.9219 5.1074 5.1074 5.1888 5.1888 5.2799 5.2799 5.3473 5.3473 5.3546 5.3546 5.3942 5.3942 5.4674 5.4674 5.4947 5.4947 5.5221 5.5221 5.6128 5.6128 5.6487 5.6487 5.6630 5.6630 5.6996 5.6996 5.9114 5.9114 6.0678 6.0678 6.1886 6.1886 6.7295 6.7295 6.9401 6.9401 7.1169 7.1169 7.3666 7.3666 7.5411 7.5411 7.7156 7.7156 8.0350 8.0350 8.1867 8.1867 8.4193 8.4193 9.3570 9.3570 9.5895 9.5895 9.8365 9.8365 10.1178 10.1178 11.3461 11.3461 11.7662 11.7662 11.8660 11.8660 k = 0.3382 0.3382-0.0000 ( 10229 PWs) bands (ev): -4.7789 -4.7789 -4.1203 -4.1203 -4.1169 -4.1169 -3.7704 -3.7704 -2.3923 -2.3923 -2.3213 -2.3213 -2.2307 -2.2307 -2.0615 -2.0615 2.4229 2.4229 2.4700 2.4700 2.8880 2.8880 3.0791 3.0791 3.2142 3.2142 3.6786 3.6786 3.7994 3.7994 4.0832 4.0832 4.4630 4.4630 4.6443 4.6443 4.7032 4.7032 4.7492 4.7492 4.8266 4.8266 4.8808 4.8808 4.9243 4.9243 5.1027 5.1027 5.2055 5.2055 5.2802 5.2802 5.3440 5.3440 5.3543 5.3543 5.3958 5.3958 5.4709 5.4709 5.4978 5.4978 5.5196 5.5196 5.6115 5.6115 5.6593 5.6593 5.6702 5.6702 5.7022 5.7022 5.8992 5.8992 6.0184 6.0184 6.1727 6.1727 6.6881 6.6881 6.9631 6.9631 7.0885 7.0885 7.3258 7.3258 7.5386 7.5386 7.7373 7.7373 8.0824 8.0824 8.2302 8.2302 8.4753 8.4753 9.3491 9.3491 9.5909 9.5909 9.8613 9.8613 10.1606 10.1606 11.3444 11.3444 11.8168 11.8168 11.9219 11.9219 k = 0.3235 0.3235-0.0000 ( 10229 PWs) bands (ev): -4.8250 -4.8250 -4.1024 -4.1024 -4.0988 -4.0988 -3.7469 -3.7469 -2.4016 -2.4016 -2.3242 -2.3242 -2.2351 -2.2351 -2.0352 -2.0352 2.4283 2.4283 2.4816 2.4816 2.9191 2.9191 3.1311 3.1311 3.1777 3.1777 3.6445 3.6445 3.7568 3.7568 4.0717 4.0717 4.4485 4.4485 4.6294 4.6294 4.6902 4.6902 4.7355 4.7355 4.8120 4.8120 4.8585 4.8585 4.9301 4.9301 5.0975 5.0975 5.2189 5.2189 5.2774 5.2774 5.3411 5.3411 5.3543 5.3543 5.3970 5.3970 5.4726 5.4726 5.4998 5.4998 5.5164 5.5164 5.6084 5.6084 5.6649 5.6649 5.6766 5.6766 5.7049 5.7049 5.8855 5.8855 5.9730 5.9730 6.1537 6.1537 6.6540 6.6540 6.9405 6.9405 7.0948 7.0948 7.2788 7.2788 7.5450 7.5450 7.7742 7.7742 8.1204 8.1204 8.2741 8.2741 8.5308 8.5308 9.3448 9.3448 9.5979 9.5979 9.8811 9.8811 10.2034 10.2034 11.3423 11.3423 11.8754 11.8754 11.9834 11.9834 k = 0.3088 0.3088-0.0000 ( 10243 PWs) bands (ev): -4.8696 -4.8696 -4.0831 -4.0831 -4.0794 -4.0794 -3.7268 -3.7268 -2.4105 -2.4105 -2.3273 -2.3273 -2.2410 -2.2410 -2.0074 -2.0074 2.4360 2.4360 2.4970 2.4970 2.9471 2.9471 3.1254 3.1254 3.2069 3.2069 3.6079 3.6079 3.7153 3.7153 4.0581 4.0581 4.4370 4.4370 4.6163 4.6163 4.6735 4.6735 4.7208 4.7208 4.7953 4.7953 4.8398 4.8398 4.9368 4.9368 5.0914 5.0914 5.2278 5.2278 5.2717 5.2717 5.3397 5.3397 5.3540 5.3540 5.3979 5.3979 5.4726 5.4726 5.5002 5.5002 5.5129 5.5129 5.6035 5.6035 5.6665 5.6665 5.6766 5.6766 5.7086 5.7086 5.8643 5.8643 5.9393 5.9393 6.1357 6.1357 6.6264 6.6264 6.8950 6.8950 7.1078 7.1078 7.2265 7.2265 7.5676 7.5676 7.8249 7.8249 8.1455 8.1455 8.3182 8.3182 8.5859 8.5859 9.3445 9.3445 9.6120 9.6120 9.8952 9.8952 10.2463 10.2463 11.3390 11.3390 11.9415 11.9415 12.0508 12.0508 k = 0.2941 0.2941-0.0000 ( 10265 PWs) bands (ev): -4.9127 -4.9127 -4.0627 -4.0627 -4.0588 -4.0588 -3.7098 -3.7098 -2.4192 -2.4192 -2.3308 -2.3308 -2.2486 -2.2486 -1.9781 -1.9781 2.4460 2.4460 2.5163 2.5163 2.9701 2.9701 3.0998 3.0998 3.2641 3.2641 3.5695 3.5695 3.6771 3.6771 4.0421 4.0421 4.4279 4.4279 4.6045 4.6045 4.6532 4.6532 4.7059 4.7059 4.7768 4.7768 4.8247 4.8247 4.9429 4.9429 5.0838 5.0838 5.2308 5.2308 5.2652 5.2652 5.3386 5.3386 5.3539 5.3539 5.3981 5.3981 5.4712 5.4712 5.4986 5.4986 5.5096 5.5096 5.5965 5.5965 5.6627 5.6627 5.6699 5.6699 5.7120 5.7120 5.8324 5.8324 5.9226 5.9226 6.1232 6.1232 6.6040 6.6040 6.8445 6.8445 7.1061 7.1061 7.1706 7.1706 7.6107 7.6107 7.8869 7.8869 8.1580 8.1580 8.3600 8.3600 8.6404 8.6404 9.3480 9.3480 9.6346 9.6346 9.9033 9.9033 10.2891 10.2891 11.3346 11.3346 12.0142 12.0142 12.1242 12.1242 k = 0.2794 0.2794-0.0000 ( 10267 PWs) bands (ev): -4.9541 -4.9541 -4.0412 -4.0412 -4.0372 -4.0372 -3.6958 -3.6958 -2.4275 -2.4275 -2.3351 -2.3351 -2.2577 -2.2577 -1.9476 -1.9476 2.4585 2.4585 2.5393 2.5393 2.9850 2.9850 3.0843 3.0843 3.3196 3.3196 3.5308 3.5308 3.6446 3.6446 4.0235 4.0235 4.4204 4.4204 4.5925 4.5925 4.6320 4.6320 4.6915 4.6915 4.7577 4.7577 4.8121 4.8121 4.9475 4.9475 5.0742 5.0742 5.2266 5.2266 5.2611 5.2611 5.3367 5.3367 5.3542 5.3542 5.3975 5.3975 5.4685 5.4685 5.4938 5.4938 5.5070 5.5070 5.5873 5.5873 5.6457 5.6457 5.6661 5.6661 5.7133 5.7133 5.7972 5.7972 5.9180 5.9180 6.1186 6.1186 6.5851 6.5851 6.7939 6.7939 7.0814 7.0814 7.1183 7.1183 7.6732 7.6732 7.9576 7.9576 8.1600 8.1600 8.3967 8.3967 8.6941 8.6941 9.3539 9.3539 9.6662 9.6662 9.9060 9.9060 10.3314 10.3314 11.3292 11.3292 12.0923 12.0923 12.2034 12.2034 k = 0.2647 0.2647-0.0000 ( 10273 PWs) bands (ev): -4.9938 -4.9938 -4.0187 -4.0187 -4.0147 -4.0147 -3.6845 -3.6845 -2.4354 -2.4354 -2.3402 -2.3402 -2.2684 -2.2684 -1.9161 -1.9161 2.4736 2.4736 2.5659 2.5659 2.9889 2.9889 3.0830 3.0830 3.3643 3.3643 3.4965 3.4965 3.6214 3.6214 4.0024 4.0024 4.4134 4.4134 4.5763 4.5763 4.6156 4.6156 4.6772 4.6772 4.7387 4.7387 4.8009 4.8009 4.9489 4.9489 5.0614 5.0614 5.2177 5.2177 5.2581 5.2581 5.3333 5.3333 5.3544 5.3544 5.3958 5.3958 5.4639 5.4639 5.4854 5.4854 5.5048 5.5048 5.5757 5.5757 5.6222 5.6222 5.6628 5.6628 5.7105 5.7105 5.7673 5.7673 5.9203 5.9203 6.1216 6.1216 6.5687 6.5687 6.7451 6.7451 7.0280 7.0280 7.0797 7.0797 7.7507 7.7507 8.0338 8.0338 8.1547 8.1547 8.4272 8.4272 8.7462 8.7462 9.3603 9.3603 9.7062 9.7062 9.9048 9.9048 10.3728 10.3728 11.3237 11.3237 12.1743 12.1743 12.2885 12.2885 k = 0.2500 0.2500-0.0000 ( 10249 PWs) bands (ev): -5.0318 -5.0318 -3.9953 -3.9953 -3.9913 -3.9913 -3.6758 -3.6758 -2.4430 -2.4430 -2.3463 -2.3463 -2.2806 -2.2806 -1.8838 -1.8838 2.4916 2.4916 2.5961 2.5961 2.9850 2.9850 3.0927 3.0927 3.3812 3.3812 3.4761 3.4761 3.6153 3.6153 3.9793 3.9793 4.4050 4.4050 4.5546 4.5546 4.6073 4.6073 4.6629 4.6629 4.7202 4.7202 4.7906 4.7906 4.9457 4.9457 5.0444 5.0444 5.2092 5.2092 5.2523 5.2523 5.3281 5.3281 5.3533 5.3533 5.3928 5.3928 5.4557 5.4557 5.4754 5.4754 5.5027 5.5027 5.5616 5.5616 5.6003 5.6003 5.6592 5.6592 5.7006 5.7006 5.7485 5.7485 5.9273 5.9273 6.1300 6.1300 6.5538 6.5538 6.6988 6.6988 6.9634 6.9634 7.0432 7.0432 7.8386 7.8386 8.1060 8.1060 8.1513 8.1513 8.4520 8.4520 8.7959 8.7959 9.3647 9.3647 9.7514 9.7514 9.9032 9.9032 10.4129 10.4129 11.3188 11.3188 12.2587 12.2587 12.3790 12.3790 k = 0.2353 0.2353-0.0000 ( 10269 PWs) bands (ev): -5.0678 -5.0678 -3.9712 -3.9712 -3.9672 -3.9672 -3.6693 -3.6693 -2.4503 -2.4503 -2.3535 -2.3535 -2.2941 -2.2941 -1.8511 -1.8511 2.5127 2.5127 2.6296 2.6296 2.9795 2.9795 3.1067 3.1067 3.3637 3.3637 3.4678 3.4678 3.6346 3.6346 3.9548 3.9548 4.3929 4.3929 4.5322 4.5322 4.6043 4.6043 4.6483 4.6483 4.7023 4.7023 4.7810 4.7810 4.9360 4.9360 5.0230 5.0230 5.2043 5.2043 5.2382 5.2382 5.3211 5.3211 5.3502 5.3502 5.3884 5.3884 5.4431 5.4431 5.4680 5.4680 5.5006 5.5006 5.5459 5.5459 5.5847 5.5847 5.6552 5.6552 5.6856 5.6856 5.7398 5.7398 5.9377 5.9377 6.1413 6.1413 6.5398 6.5398 6.6554 6.6554 6.8966 6.8966 7.0038 7.0038 7.9323 7.9323 8.1179 8.1179 8.2063 8.2063 8.4729 8.4729 8.8426 8.8426 9.3647 9.3647 9.7928 9.7928 9.9100 9.9100 10.4516 10.4516 11.3155 11.3155 12.3437 12.3437 12.4739 12.4739 k = 0.2206 0.2206-0.0000 ( 10249 PWs) bands (ev): -5.1019 -5.1019 -3.9466 -3.9466 -3.9426 -3.9426 -3.6647 -3.6647 -2.4572 -2.4572 -2.3619 -2.3619 -2.3089 -2.3089 -1.8183 -1.8183 2.5372 2.5372 2.6664 2.6664 2.9759 2.9759 3.1211 3.1211 3.3326 3.3326 3.4556 3.4556 3.6734 3.6734 3.9303 3.9303 4.3748 4.3748 4.5134 4.5134 4.6037 4.6037 4.6338 4.6338 4.6855 4.6855 4.7718 4.7718 4.9186 4.9186 4.9982 4.9982 5.2022 5.2022 5.2124 5.2124 5.3140 5.3140 5.3461 5.3461 5.3840 5.3840 5.4313 5.4313 5.4634 5.4634 5.4983 5.4983 5.5301 5.5301 5.5751 5.5751 5.6508 5.6508 5.6718 5.6718 5.7348 5.7348 5.9510 5.9510 6.1538 6.1538 6.5260 6.5260 6.6151 6.6151 6.8309 6.8309 6.9624 6.9624 8.0245 8.0245 8.1083 8.1083 8.2831 8.2831 8.4936 8.4936 8.8853 8.8853 9.3588 9.3588 9.8149 9.8149 9.9402 9.9402 10.4887 10.4887 11.3145 11.3145 12.4277 12.4277 12.5708 12.5708 k = 0.2059 0.2059-0.0000 ( 10251 PWs) bands (ev): -5.1341 -5.1341 -3.9216 -3.9216 -3.9177 -3.9177 -3.6618 -3.6618 -2.4637 -2.4637 -2.3713 -2.3713 -2.3247 -2.3247 -1.7857 -1.7857 2.5652 2.5652 2.7063 2.7063 2.9751 2.9751 3.1338 3.1338 3.3002 3.3002 3.4397 3.4397 3.7168 3.7168 3.9086 3.9086 4.3499 4.3499 4.4994 4.4994 4.6023 4.6023 4.6210 4.6210 4.6702 4.6702 4.7629 4.7629 4.8932 4.8932 4.9714 4.9714 5.1644 5.1644 5.2115 5.2115 5.3089 5.3089 5.3425 5.3425 5.3805 5.3805 5.4228 5.4228 5.4600 5.4600 5.4956 5.4956 5.5152 5.5152 5.5698 5.5698 5.6459 5.6459 5.6618 5.6618 5.7297 5.7297 5.9669 5.9669 6.1660 6.1660 6.5111 6.5111 6.5785 6.5785 6.7684 6.7684 6.9198 6.9198 8.0667 8.0667 8.1475 8.1475 8.3517 8.3517 8.5207 8.5207 8.9234 8.9234 9.3465 9.3465 9.8183 9.8183 9.9925 9.9925 10.5244 10.5244 11.3163 11.3163 12.5086 12.5086 12.6497 12.6497 k = 0.1912 0.1912-0.0000 ( 10245 PWs) bands (ev): -5.1642 -5.1642 -3.8964 -3.8964 -3.8925 -3.8925 -3.6603 -3.6603 -2.4698 -2.4698 -2.3819 -2.3819 -2.3414 -2.3414 -1.7538 -1.7538 2.5969 2.5969 2.7491 2.7491 2.9772 2.9772 3.1432 3.1432 3.2708 3.2708 3.4242 3.4242 3.7508 3.7508 3.8962 3.8962 4.3191 4.3191 4.4890 4.4890 4.5929 4.5929 4.6159 4.6159 4.6572 4.6572 4.7543 4.7543 4.8616 4.8616 4.9433 4.9433 5.1106 5.1106 5.2202 5.2202 5.3064 5.3064 5.3398 5.3398 5.3777 5.3777 5.4165 5.4165 5.4570 5.4570 5.4919 5.4919 5.5027 5.5027 5.5671 5.5671 5.6409 5.6409 5.6554 5.6554 5.7235 5.7235 5.9852 5.9852 6.1773 6.1773 6.4937 6.4937 6.5461 6.5461 6.7109 6.7109 6.8769 6.8769 8.0570 8.0570 8.2369 8.2369 8.4005 8.4005 8.5642 8.5642 8.9567 8.9567 9.3278 9.3278 9.8170 9.8170 10.0531 10.0531 10.5586 10.5586 11.3209 11.3209 12.5848 12.5848 12.7027 12.7027 k = 0.1765 0.1765-0.0000 ( 10241 PWs) bands (ev): -5.1923 -5.1923 -3.8713 -3.8713 -3.8675 -3.8675 -3.6599 -3.6599 -2.4755 -2.4755 -2.3934 -2.3934 -2.3588 -2.3588 -1.7229 -1.7229 2.6323 2.6323 2.7947 2.7947 2.9819 2.9819 3.1475 3.1475 3.2472 3.2472 3.4116 3.4116 3.7615 3.7615 3.9022 3.9022 4.2844 4.2844 4.4795 4.4795 4.5763 4.5763 4.6170 4.6170 4.6468 4.6468 4.7458 4.7458 4.8273 4.8273 4.9133 4.9133 5.0530 5.0530 5.2313 5.2313 5.3057 5.3057 5.3380 5.3380 5.3752 5.3752 5.4112 5.4112 5.4535 5.4535 5.4855 5.4855 5.4951 5.4951 5.5661 5.5661 5.6366 5.6366 5.6514 5.6514 5.7159 5.7159 6.0058 6.0058 6.1875 6.1875 6.4723 6.4723 6.5186 6.5186 6.6603 6.6603 6.8342 6.8342 8.0447 8.0447 8.3245 8.3245 8.4271 8.4271 8.6262 8.6262 8.9851 8.9851 9.3040 9.3040 9.8188 9.8188 10.1144 10.1144 10.5914 10.5914 11.3279 11.3279 12.6571 12.6571 12.7643 12.7643 k = 0.1618 0.1618-0.0000 ( 10243 PWs) bands (ev): -5.2182 -5.2182 -3.8464 -3.8464 -3.8427 -3.8427 -3.6605 -3.6605 -2.4809 -2.4809 -2.4057 -2.4057 -2.3766 -2.3766 -1.6932 -1.6932 2.6715 2.6715 2.8427 2.8427 2.9884 2.9884 3.1445 3.1445 3.2318 3.2318 3.4034 3.4034 3.7496 3.7496 3.9229 3.9229 4.2471 4.2471 4.4686 4.4686 4.5566 4.5566 4.6195 4.6195 4.6392 4.6392 4.7371 4.7371 4.7944 4.7944 4.8812 4.8812 4.9969 4.9969 5.2434 5.2434 5.3063 5.3063 5.3367 5.3367 5.3729 5.3729 5.4064 5.4064 5.4484 5.4484 5.4784 5.4784 5.4914 5.4914 5.5662 5.5662 5.6336 5.6336 5.6487 5.6487 5.7070 5.7070 6.0283 6.0283 6.1966 6.1966 6.4471 6.4471 6.4951 6.4951 6.6174 6.6174 6.7920 6.7920 8.0355 8.0355 8.3995 8.3995 8.4405 8.4405 8.6989 8.6989 9.0078 9.0078 9.2787 9.2787 9.8276 9.8276 10.1735 10.1735 10.6229 10.6229 11.3363 11.3363 12.7277 12.7277 12.8319 12.8319 k = 0.1471 0.1471-0.0000 ( 10233 PWs) bands (ev): -5.2421 -5.2421 -3.8221 -3.8221 -3.8184 -3.8184 -3.6616 -3.6616 -2.4858 -2.4858 -2.4186 -2.4186 -2.3946 -2.3946 -1.6652 -1.6652 2.7141 2.7141 2.8926 2.8926 2.9963 2.9963 3.1345 3.1345 3.2246 3.2246 3.4010 3.4010 3.7269 3.7269 3.9434 3.9434 4.2079 4.2079 4.4545 4.4545 4.5344 4.5344 4.6224 4.6224 4.6336 4.6336 4.7281 4.7281 4.7664 4.7664 4.8473 4.8473 4.9464 4.9464 5.2556 5.2556 5.3080 5.3080 5.3358 5.3358 5.3709 5.3709 5.4020 5.4020 5.4408 5.4408 5.4742 5.4742 5.4888 5.4888 5.5671 5.5671 5.6319 5.6319 5.6467 5.6467 5.6975 5.6975 6.0523 6.0523 6.2048 6.2048 6.4205 6.4205 6.4731 6.4731 6.5827 6.5827 6.7506 6.7506 8.0312 8.0312 8.4412 8.4412 8.4627 8.4627 8.7754 8.7754 9.0218 9.0218 9.2587 9.2587 9.8448 9.8448 10.2295 10.2295 10.6528 10.6528 11.3448 11.3448 12.7948 12.7948 12.9023 12.9023 k = 0.1324 0.1324-0.0000 ( 10231 PWs) bands (ev): -5.2637 -5.2637 -3.7987 -3.7987 -3.7949 -3.7949 -3.6633 -3.6633 -2.4903 -2.4903 -2.4318 -2.4318 -2.4124 -2.4124 -1.6390 -1.6390 2.7597 2.7597 2.9436 2.9436 3.0052 3.0052 3.1213 3.1213 3.2227 3.2227 3.4049 3.4049 3.7005 3.7005 3.9545 3.9545 4.1671 4.1671 4.4358 4.4358 4.5088 4.5088 4.6246 4.6246 4.6305 4.6305 4.7190 4.7190 4.7450 4.7450 4.8137 4.8137 4.9046 4.9046 5.2669 5.2669 5.3106 5.3106 5.3351 5.3351 5.3692 5.3692 5.3981 5.3981 5.4315 5.4315 5.4725 5.4725 5.4867 5.4867 5.5685 5.5685 5.6314 5.6314 5.6455 5.6455 5.6878 5.6878 6.0773 6.0773 6.2125 6.2125 6.3949 6.3949 6.4509 6.4509 6.5551 6.5551 6.7100 6.7100 8.0329 8.0329 8.4458 8.4458 8.4975 8.4975 8.8482 8.8482 9.0246 9.0246 9.2538 9.2538 9.8706 9.8706 10.2829 10.2829 10.6807 10.6807 11.3513 11.3513 12.8495 12.8495 12.9785 12.9785 k = 0.1176 0.1176-0.0000 ( 10237 PWs) bands (ev): -5.2831 -5.2831 -3.7763 -3.7763 -3.7726 -3.7726 -3.6652 -3.6652 -2.4944 -2.4944 -2.4450 -2.4450 -2.4297 -2.4297 -1.6149 -1.6149 2.8072 2.8072 2.9917 2.9917 3.0163 3.0163 3.1093 3.1093 3.2244 3.2244 3.4149 3.4149 3.6735 3.6735 3.9527 3.9527 4.1238 4.1238 4.4125 4.4125 4.4792 4.4792 4.6215 4.6215 4.6338 4.6338 4.7088 4.7088 4.7301 4.7301 4.7834 4.7834 4.8739 4.8739 5.2771 5.2771 5.3141 5.3141 5.3346 5.3346 5.3680 5.3680 5.3948 5.3948 5.4216 5.4216 5.4724 5.4724 5.4848 5.4848 5.5704 5.5704 5.6318 5.6318 5.6447 5.6447 5.6785 5.6785 6.1025 6.1025 6.2201 6.2201 6.3717 6.3717 6.4285 6.4285 6.5332 6.5332 6.6704 6.6704 8.0411 8.0411 8.4466 8.4466 8.5143 8.5143 8.8924 8.8924 9.0346 9.0346 9.2681 9.2681 9.9034 9.9034 10.3352 10.3352 10.7062 10.7062 11.3537 11.3537 12.8843 12.8843 13.0618 13.0618 k = 0.1029 0.1029-0.0000 ( 10243 PWs) bands (ev): -5.3003 -5.3003 -3.7555 -3.7555 -3.7518 -3.7518 -3.6673 -3.6673 -2.4980 -2.4980 -2.4579 -2.4579 -2.4463 -2.4463 -1.5932 -1.5932 2.8552 2.8552 3.0156 3.0156 3.0444 3.0444 3.1058 3.1058 3.2299 3.2299 3.4303 3.4303 3.6476 3.6476 3.9377 3.9377 4.0769 4.0769 4.3856 4.3856 4.4455 4.4455 4.6175 4.6175 4.6383 4.6383 4.6939 4.6939 4.7226 4.7226 4.7597 4.7597 4.8561 4.8561 5.2858 5.2858 5.3180 5.3180 5.3341 5.3341 5.3676 5.3676 5.3921 5.3921 5.4120 5.4120 5.4730 5.4730 5.4833 5.4833 5.5727 5.5727 5.6330 5.6330 5.6443 5.6443 5.6700 5.6700 6.1273 6.1273 6.2277 6.2277 6.3516 6.3516 6.4062 6.4062 6.5155 6.5155 6.6320 6.6320 8.0564 8.0564 8.4462 8.4462 8.5161 8.5161 8.8751 8.8751 9.0869 9.0869 9.2953 9.2953 9.9406 9.9406 10.3885 10.3885 10.7290 10.7290 11.3496 11.3496 12.9017 12.9017 13.1248 13.1248 k = 0.0882 0.0882-0.0000 ( 10235 PWs) bands (ev): -5.3152 -5.3152 -3.7365 -3.7365 -3.7328 -3.7328 -3.6693 -3.6693 -2.5011 -2.5011 -2.4702 -2.4702 -2.4616 -2.4616 -1.5740 -1.5740 2.9018 2.9018 3.0237 3.0237 3.0603 3.0603 3.1299 3.1299 3.2416 3.2416 3.4502 3.4502 3.6239 3.6239 3.9116 3.9116 4.0254 4.0254 4.3571 4.3571 4.4088 4.4088 4.6145 4.6145 4.6402 4.6402 4.6761 4.6761 4.7197 4.7197 4.7430 4.7430 4.8516 4.8516 5.2931 5.2931 5.3221 5.3221 5.3337 5.3337 5.3680 5.3680 5.3900 5.3900 5.4036 5.4036 5.4740 5.4740 5.4821 5.4821 5.5754 5.5754 5.6345 5.6345 5.6444 5.6444 5.6628 5.6628 6.1509 6.1509 6.2358 6.2358 6.3348 6.3348 6.3843 6.3843 6.5009 6.5009 6.5951 6.5951 8.0791 8.0791 8.4450 8.4450 8.5081 8.5081 8.8218 8.8218 9.1602 9.1602 9.3272 9.3272 9.9789 9.9789 10.4454 10.4454 10.7485 10.7485 11.3366 11.3366 12.9073 12.9073 13.1090 13.1090 k = 0.0735 0.0735-0.0000 ( 10247 PWs) bands (ev): -5.3279 -5.3279 -3.7197 -3.7197 -3.7159 -3.7159 -3.6712 -3.6712 -2.5039 -2.5039 -2.4814 -2.4814 -2.4753 -2.4753 -1.5575 -1.5575 2.9443 2.9443 3.0290 3.0290 3.0575 3.0575 3.1721 3.1721 3.2634 3.2634 3.4734 3.4734 3.6035 3.6035 3.8770 3.8770 3.9688 3.9688 4.3292 4.3292 4.3709 4.3709 4.6124 4.6124 4.6370 4.6370 4.6604 4.6604 4.7184 4.7184 4.7322 4.7322 4.8575 4.8575 5.2990 5.2990 5.3256 5.3256 5.3332 5.3332 5.3694 5.3694 5.3878 5.3878 5.3972 5.3972 5.4752 5.4752 5.4812 5.4812 5.5783 5.5783 5.6363 5.6363 5.6446 5.6446 5.6570 5.6570 6.1726 6.1726 6.2444 6.2444 6.3212 6.3212 6.3634 6.3634 6.4887 6.4887 6.5604 6.5604 8.1094 8.1094 8.4433 8.4433 8.4950 8.4950 8.7551 8.7551 9.2339 9.2339 9.3582 9.3582 10.0149 10.0149 10.5076 10.5076 10.7647 10.7647 11.3132 11.3132 12.9056 12.9056 13.0590 13.0590 k = 0.0588 0.0588-0.0000 ( 10255 PWs) bands (ev): -5.3383 -5.3383 -3.7053 -3.7053 -3.7016 -3.7016 -3.6728 -3.6728 -2.5061 -2.5061 -2.4913 -2.4913 -2.4870 -2.4870 -1.5439 -1.5439 2.9797 2.9797 3.0328 3.0328 3.0523 3.0523 3.2116 3.2116 3.2986 3.2986 3.4991 3.4991 3.5875 3.5875 3.8367 3.8367 3.9078 3.9078 4.3039 4.3039 4.3343 4.3343 4.6108 4.6108 4.6290 4.6290 4.6496 4.6496 4.7177 4.7177 4.7259 4.7259 4.8691 4.8691 5.3036 5.3036 5.3283 5.3283 5.3328 5.3328 5.3714 5.3714 5.3849 5.3849 5.3940 5.3940 5.4764 5.4764 5.4805 5.4805 5.5813 5.5813 5.6380 5.6380 5.6448 5.6448 5.6530 5.6530 6.1919 6.1919 6.2533 6.2533 6.3104 6.3104 6.3441 6.3441 6.4787 6.4787 6.5287 6.5287 8.1470 8.1470 8.4411 8.4411 8.4808 8.4808 8.6830 8.6830 9.3009 9.3009 9.3852 9.3852 10.0455 10.0455 10.5756 10.5756 10.7776 10.7776 11.2785 11.2785 12.8986 12.8986 13.0073 13.0073 k = 0.0441 0.0441-0.0000 ( 10259 PWs) bands (ev): -5.3464 -5.3464 -3.6938 -3.6938 -3.6903 -3.6903 -3.6739 -3.6739 -2.5079 -2.5079 -2.4994 -2.4994 -2.4964 -2.4964 -1.5331 -1.5331 3.0058 3.0058 3.0354 3.0354 3.0482 3.0482 3.2452 3.2452 3.3434 3.3434 3.5265 3.5265 3.5780 3.5780 3.7933 3.7933 3.8441 3.8441 4.2829 4.2829 4.3019 4.3019 4.6093 4.6093 4.6199 4.6199 4.6426 4.6426 4.7177 4.7177 4.7223 4.7223 4.8822 4.8822 5.3069 5.3069 5.3301 5.3301 5.3324 5.3324 5.3737 5.3737 5.3816 5.3816 5.3935 5.3935 5.4776 5.4776 5.4800 5.4800 5.5842 5.5842 5.6394 5.6394 5.6440 5.6440 5.6516 5.6516 6.2089 6.2089 6.2615 6.2615 6.3011 6.3011 6.3279 6.3279 6.4709 6.4709 6.5013 6.5013 8.1913 8.1913 8.4379 8.4379 8.4683 8.4683 8.6097 8.6097 9.3570 9.3570 9.4069 9.4069 10.0693 10.0693 10.6474 10.6474 10.7872 10.7872 11.2340 11.2340 12.8862 12.8862 12.9672 12.9672 k = 0.0294 0.0294-0.0000 ( 10269 PWs) bands (ev): -5.3522 -5.3522 -3.6854 -3.6854 -3.6825 -3.6825 -3.6743 -3.6743 -2.5093 -2.5093 -2.5057 -2.5057 -2.5030 -2.5030 -1.5254 -1.5254 3.0214 3.0214 3.0382 3.0382 3.0457 3.0457 3.2730 3.2730 3.3879 3.3879 3.5551 3.5551 3.5782 3.5782 3.7501 3.7501 3.7807 3.7807 4.2671 4.2671 4.2763 4.2763 4.6079 4.6079 4.6125 4.6125 4.6380 4.6380 4.7181 4.7181 4.7202 4.7202 4.8933 4.8933 5.3091 5.3091 5.3311 5.3311 5.3321 5.3321 5.3756 5.3756 5.3791 5.3791 5.3942 5.3942 5.4786 5.4786 5.4796 5.4796 5.5866 5.5866 5.6403 5.6403 5.6426 5.6426 5.6521 5.6521 6.2239 6.2239 6.2679 6.2679 6.2908 6.2908 6.3176 6.3176 6.4652 6.4652 6.4796 6.4796 8.2409 8.2409 8.4335 8.4335 8.4597 8.4597 8.5390 8.5390 9.3995 9.3995 9.4225 9.4225 10.0857 10.0857 10.7177 10.7177 10.7938 10.7938 11.1840 11.1840 12.8693 12.8693 12.9433 12.9433 k = 0.0147 0.0147-0.0000 ( 10265 PWs) bands (ev): -5.3556 -5.3556 -3.6802 -3.6802 -3.6791 -3.6791 -3.6731 -3.6731 -2.5105 -2.5105 -2.5097 -2.5097 -2.5067 -2.5067 -1.5207 -1.5207 3.0271 3.0271 3.0424 3.0424 3.0447 3.0447 3.2925 3.2925 3.4204 3.4204 3.5833 3.5833 3.5902 3.5902 3.7125 3.7125 3.7239 3.7239 4.2574 4.2574 4.2598 4.2598 4.6069 4.6069 4.6080 4.6080 4.6354 4.6354 4.7185 4.7185 4.7191 4.7191 4.9007 4.9007 5.3103 5.3103 5.3317 5.3317 5.3319 5.3319 5.3769 5.3769 5.3777 5.3777 5.3950 5.3950 5.4792 5.4792 5.4795 5.4795 5.5883 5.5883 5.6409 5.6409 5.6414 5.6414 5.6531 5.6531 6.2366 6.2366 6.2716 6.2716 6.2791 6.2791 6.3139 6.3139 6.4617 6.4617 6.4655 6.4655 8.2910 8.2910 8.4265 8.4265 8.4553 8.4553 8.4789 8.4789 9.4261 9.4261 9.4319 9.4319 10.0952 10.0952 10.7750 10.7750 10.7977 10.7977 11.1393 11.1393 12.8546 12.8546 12.9325 12.9325 k = 0.0000 0.0000 0.0000 ( 10251 PWs) bands (ev): -5.3568 -5.3568 -3.6785 -3.6785 -3.6785 -3.6785 -3.6722 -3.6722 -2.5110 -2.5110 -2.5110 -2.5110 -2.5077 -2.5077 -1.5192 -1.5192 3.0281 3.0281 3.0444 3.0444 3.0444 3.0444 3.2996 3.2996 3.4320 3.4320 3.6005 3.6005 3.6005 3.6005 3.6949 3.6949 3.6949 3.6949 4.2541 4.2541 4.2541 4.2541 4.6065 4.6065 4.6065 4.6065 4.6346 4.6346 4.7187 4.7187 4.7187 4.7187 4.9033 4.9033 5.3107 5.3107 5.3318 5.3318 5.3318 5.3318 5.3773 5.3773 5.3773 5.3773 5.3954 5.3954 5.4794 5.4794 5.4794 5.4794 5.5889 5.5889 5.6410 5.6410 5.6410 5.6410 5.6535 5.6535 6.2431 6.2431 6.2727 6.2727 6.2727 6.2727 6.3134 6.3134 6.4606 6.4606 6.4606 6.4606 8.3196 8.3196 8.4168 8.4168 8.4540 8.4540 8.4540 8.4540 9.4351 9.4351 9.4351 9.4351 10.0983 10.0983 10.7989 10.7989 10.7989 10.7989 11.1197 11.1197 12.8489 12.8489 12.9294 12.9294 k = 0.0000 0.0000 0.0000 ( 10251 PWs) bands (ev): -5.3568 -5.3568 -3.6785 -3.6785 -3.6785 -3.6785 -3.6722 -3.6722 -2.5110 -2.5110 -2.5110 -2.5110 -2.5077 -2.5077 -1.5192 -1.5192 3.0281 3.0281 3.0444 3.0444 3.0444 3.0444 3.2996 3.2996 3.4320 3.4320 3.6005 3.6005 3.6005 3.6005 3.6949 3.6949 3.6949 3.6949 4.2541 4.2541 4.2541 4.2541 4.6065 4.6065 4.6065 4.6065 4.6346 4.6346 4.7187 4.7187 4.7187 4.7187 4.9033 4.9033 5.3107 5.3107 5.3318 5.3318 5.3318 5.3318 5.3773 5.3773 5.3773 5.3773 5.3954 5.3954 5.4794 5.4794 5.4794 5.4794 5.5889 5.5889 5.6410 5.6410 5.6410 5.6410 5.6535 5.6535 6.2431 6.2431 6.2727 6.2727 6.2727 6.2727 6.3134 6.3134 6.4606 6.4606 6.4606 6.4606 8.3196 8.3196 8.4168 8.4168 8.4540 8.4540 8.4540 8.4540 9.4351 9.4351 9.4351 9.4351 10.0983 10.0983 10.7989 10.7989 10.7989 10.7989 11.1197 11.1197 12.8489 12.8489 12.9294 12.9294 k = 0.0119 0.0119 0.0119 ( 10257 PWs) bands (ev): -5.3557 -5.3557 -3.6796 -3.6796 -3.6794 -3.6794 -3.6733 -3.6733 -2.5104 -2.5104 -2.5098 -2.5098 -2.5067 -2.5067 -1.5207 -1.5207 3.0272 3.0272 3.0422 3.0422 3.0447 3.0447 3.2926 3.2926 3.4206 3.4206 3.5834 3.5834 3.5905 3.5905 3.7122 3.7122 3.7235 3.7235 4.2585 4.2585 4.2586 4.2586 4.6071 4.6071 4.6078 4.6078 4.6354 4.6354 4.7186 4.7186 4.7189 4.7189 4.9007 4.9007 5.3103 5.3103 5.3317 5.3317 5.3319 5.3319 5.3769 5.3769 5.3777 5.3777 5.3951 5.3951 5.4792 5.4792 5.4795 5.4795 5.5883 5.5883 5.6409 5.6409 5.6414 5.6414 5.6531 5.6531 6.2369 6.2369 6.2713 6.2713 6.2792 6.2792 6.3140 6.3140 6.4634 6.4634 6.4637 6.4637 8.2915 8.2915 8.4261 8.4261 8.4550 8.4550 8.4789 8.4789 9.4290 9.4290 9.4292 9.4292 10.0952 10.0952 10.7748 10.7748 10.7983 10.7983 11.1390 11.1390 12.8546 12.8546 12.9340 12.9347 k = 0.0238 0.0238 0.0238 ( 10275 PWs) bands (ev): -5.3522 -5.3522 -3.6831 -3.6831 -3.6823 -3.6823 -3.6764 -3.6764 -2.5086 -2.5086 -2.5070 -2.5070 -2.5026 -2.5026 -1.5253 -1.5253 3.0236 3.0236 3.0357 3.0357 3.0461 3.0461 3.2734 3.2734 3.3890 3.3890 3.5503 3.5503 3.5846 3.5846 3.7460 3.7460 3.7816 3.7816 4.2713 4.2713 4.2716 4.2716 4.6088 4.6088 4.6117 4.6117 4.6376 4.6376 4.7185 4.7185 4.7198 4.7198 4.8934 4.8934 5.3091 5.3091 5.3312 5.3312 5.3320 5.3320 5.3758 5.3758 5.3789 5.3789 5.3942 5.3942 5.4786 5.4786 5.4796 5.4796 5.5866 5.5866 5.6403 5.6403 5.6426 5.6426 5.6521 5.6521 6.2256 6.2256 6.2673 6.2673 6.2887 6.2887 6.3186 6.3186 6.4716 6.4716 6.4729 6.4729 8.2428 8.2428 8.4321 8.4321 8.4580 8.4580 8.5396 8.5396 9.4111 9.4111 9.4118 9.4118 10.0857 10.0857 10.7169 10.7169 10.7962 10.7962 11.1828 11.1828 12.8715 12.8715 12.9475 12.9475 k = 0.0357 0.0357 0.0357 ( 10269 PWs) bands (ev): -5.3466 -5.3466 -3.6889 -3.6889 -3.6871 -3.6871 -3.6815 -3.6815 -2.5056 -2.5056 -2.5037 -2.5037 -2.4948 -2.4948 -1.5329 -1.5329 3.0157 3.0157 3.0246 3.0246 3.0493 3.0493 3.2448 3.2448 3.3479 3.3479 3.5162 3.5162 3.5916 3.5916 3.7821 3.7821 3.8478 3.8478 4.2917 4.2917 4.2918 4.2918 4.6118 4.6118 4.6183 4.6183 4.6412 4.6412 4.7186 4.7186 4.7216 4.7216 4.8821 4.8821 5.3069 5.3069 5.3302 5.3302 5.3323 5.3323 5.3745 5.3745 5.3811 5.3811 5.3934 5.3934 5.4777 5.4777 5.4799 5.4799 5.5843 5.5843 5.6391 5.6391 5.6446 5.6446 5.6513 5.6513 6.2139 6.2139 6.2614 6.2614 6.2917 6.2917 6.3324 6.3324 6.4847 6.4847 6.4868 6.4868 8.1955 8.1955 8.4370 8.4370 8.4629 8.4629 8.6107 8.6107 9.3820 9.3820 9.3839 9.3839 10.0689 10.0689 10.6455 10.6455 10.7926 10.7926 11.2314 11.2314 12.8985 12.8985 12.9708 12.9708 k = 0.0476 0.0476 0.0476 ( 10251 PWs) bands (ev): -5.3386 -5.3386 -3.6970 -3.6970 -3.6936 -3.6936 -3.6884 -3.6884 -2.5017 -2.5017 -2.4996 -2.4996 -2.4838 -2.4838 -1.5435 -1.5435 3.0022 3.0022 3.0085 3.0085 3.0533 3.0533 3.2090 3.2090 3.3101 3.3101 3.4860 3.4860 3.6057 3.6057 3.8164 3.8164 3.9149 3.9149 4.3176 4.3176 4.3185 4.3185 4.6157 4.6157 4.6276 4.6276 4.6455 4.6455 4.7193 4.7193 4.7251 4.7251 4.8685 4.8685 5.3034 5.3034 5.3286 5.3286 5.3326 5.3326 5.3735 5.3735 5.3841 5.3841 5.3934 5.3934 5.4766 5.4766 5.4804 5.4804 5.5814 5.5814 5.6372 5.6372 5.6475 5.6475 5.6512 5.6512 6.2026 6.2026 6.2544 6.2544 6.2899 6.2899 6.3531 6.3531 6.5023 6.5023 6.5041 6.5041 8.1539 8.1539 8.4427 8.4427 8.4694 8.4694 8.6837 8.6837 9.3426 9.3426 9.3471 9.3471 10.0435 10.0435 10.5728 10.5728 10.7868 10.7868 11.2738 11.2738 12.9339 12.9339 13.0040 13.0040 k = 0.0595 0.0595 0.0595 ( 10230 PWs) bands (ev): -5.3284 -5.3284 -3.7071 -3.7071 -3.7018 -3.7018 -3.6969 -3.6969 -2.4968 -2.4968 -2.4947 -2.4947 -2.4700 -2.4700 -1.5570 -1.5570 2.9825 2.9825 2.9875 2.9875 3.0555 3.0555 3.1695 3.1695 3.2828 3.2828 3.4619 3.4619 3.6230 3.6230 3.8479 3.8479 3.9782 3.9782 4.3467 4.3467 4.3496 4.3496 4.6202 4.6202 4.6392 4.6392 4.6497 4.6497 4.7215 4.7215 4.7313 4.7313 4.8551 4.8551 5.2986 5.2986 5.3264 5.3264 5.3330 5.3330 5.3732 5.3732 5.3881 5.3881 5.3946 5.3946 5.4756 5.4756 5.4810 5.4810 5.5783 5.5783 5.6348 5.6348 5.6513 5.6513 5.6521 5.6521 6.1917 6.1917 6.2467 6.2467 6.2866 6.2866 6.3776 6.3776 6.5236 6.5236 6.5238 6.5238 8.1193 8.1193 8.4492 8.4492 8.4771 8.4771 8.7538 8.7538 9.2943 9.2943 9.3036 9.3036 10.0089 10.0089 10.5052 10.5052 10.7786 10.7786 11.3049 11.3049 12.9748 12.9748 13.0461 13.0461 k = 0.0714 0.0714 0.0714 ( 10230 PWs) bands (ev): -5.3159 -5.3159 -3.7191 -3.7191 -3.7115 -3.7115 -3.7068 -3.7068 -2.4913 -2.4913 -2.4891 -2.4891 -2.4538 -2.4538 -1.5733 -1.5733 2.9569 2.9569 2.9620 2.9620 3.0474 3.0474 3.1376 3.1376 3.2671 3.2671 3.4447 3.4447 3.6417 3.6417 3.8766 3.8766 4.0335 4.0335 4.3770 4.3770 4.3826 4.3826 4.6247 4.6247 4.6522 4.6522 4.6532 4.6532 4.7266 4.7266 4.7417 4.7417 4.8456 4.8456 5.2926 5.2926 5.3238 5.3238 5.3334 5.3334 5.3735 5.3735 5.3928 5.3928 5.3973 5.3973 5.4746 5.4746 5.4819 5.4819 5.5754 5.5754 5.6320 5.6320 5.6540 5.6540 5.6562 5.6562 6.1807 6.1807 6.2390 6.2390 6.2831 6.2831 6.4048 6.4048 6.5443 6.5443 6.5490 6.5490 8.0918 8.0918 8.4565 8.4565 8.4857 8.4857 8.8156 8.8156 9.2386 9.2386 9.2564 9.2564 9.9660 9.9660 10.4461 10.4461 10.7675 10.7675 11.3226 11.3226 13.0159 13.0159 13.0923 13.0923 k = 0.0833 0.0833 0.0833 ( 10245 PWs) bands (ev): -5.3013 -5.3013 -3.7326 -3.7326 -3.7226 -3.7226 -3.7181 -3.7181 -2.4852 -2.4852 -2.4831 -2.4831 -2.4357 -2.4357 -1.5923 -1.5923 2.9267 2.9267 2.9329 2.9329 3.0182 3.0182 3.1273 3.1273 3.2610 3.2610 3.4344 3.4344 3.6610 3.6610 3.9032 3.9032 4.0762 4.0762 4.4067 4.4067 4.4151 4.4151 4.6280 4.6280 4.6561 4.6561 4.6647 4.6647 4.7370 4.7370 4.7578 4.7578 4.8440 4.8440 5.2861 5.2861 5.3210 5.3210 5.3337 5.3337 5.3741 5.3741 5.3982 5.3982 5.4017 5.4017 5.4740 5.4740 5.4829 5.4829 5.5726 5.5726 5.6290 5.6290 5.6568 5.6568 5.6622 5.6622 6.1693 6.1693 6.2317 6.2317 6.2801 6.2801 6.4346 6.4346 6.5659 6.5659 6.5780 6.5780 8.0708 8.0708 8.4640 8.4640 8.4943 8.4943 8.8623 8.8623 9.1770 9.1770 9.2103 9.2103 9.9179 9.9179 10.3961 10.3961 10.7532 10.7532 11.3269 11.3269 13.0436 13.0436 13.1281 13.1281 k = 0.0952 0.0952 0.0952 ( 10233 PWs) bands (ev): -5.2844 -5.2844 -3.7474 -3.7474 -3.7348 -3.7348 -3.7304 -3.7304 -2.4789 -2.4789 -2.4768 -2.4768 -2.4159 -2.4159 -1.6140 -1.6140 2.8938 2.8938 2.9016 2.9016 2.9750 2.9750 3.1333 3.1333 3.2622 3.2622 3.4303 3.4303 3.6807 3.6807 3.9283 3.9283 4.1024 4.1024 4.4345 4.4345 4.4450 4.4450 4.6297 4.6297 4.6595 4.6595 4.6749 4.6749 4.7550 4.7550 4.7810 4.7810 4.8525 4.8525 5.2799 5.2799 5.3182 5.3182 5.3342 5.3342 5.3747 5.3747 5.4042 5.4042 5.4075 5.4075 5.4740 5.4740 5.4842 5.4842 5.5703 5.5703 5.6261 5.6261 5.6607 5.6607 5.6693 5.6693 6.1571 6.1571 6.2251 6.2251 6.2778 6.2778 6.4666 6.4666 6.5885 6.5885 6.6110 6.6110 8.0555 8.0555 8.4713 8.4713 8.5020 8.5020 8.8849 8.8849 9.1114 9.1114 9.1715 9.1715 9.8695 9.8695 10.3537 10.3537 10.7353 10.7353 11.3189 11.3189 13.0292 13.0292 13.1239 13.1239 k = 0.1071 0.1071 0.1071 ( 10248 PWs) bands (ev): -5.2653 -5.2653 -3.7632 -3.7632 -3.7481 -3.7481 -3.7438 -3.7438 -2.4725 -2.4725 -2.4703 -2.4703 -2.3951 -2.3951 -1.6381 -1.6381 2.8598 2.8598 2.8692 2.8692 2.9284 2.9284 3.1459 3.1459 3.2689 3.2689 3.4316 3.4316 3.7005 3.7005 3.9526 3.9526 4.1100 4.1100 4.4595 4.4595 4.4708 4.4708 4.6307 4.6307 4.6638 4.6638 4.6827 4.6827 4.7801 4.7801 4.8111 4.8111 4.8718 4.8718 5.2746 5.2746 5.3154 5.3154 5.3347 5.3347 5.3751 5.3751 5.4106 5.4106 5.4139 5.4139 5.4750 5.4750 5.4859 5.4859 5.5683 5.5683 5.6231 5.6231 5.6656 5.6656 5.6774 5.6774 6.1439 6.1439 6.2196 6.2196 6.2763 6.2763 6.5002 6.5002 6.6132 6.6132 6.6482 6.6482 8.0443 8.0443 8.4774 8.4774 8.5074 8.5074 8.8765 8.8765 9.0439 9.0439 9.1449 9.1449 9.8264 9.8264 10.3170 10.3170 10.7137 10.7137 11.3009 11.3009 12.9681 12.9681 13.0850 13.0850 k = 0.1190 0.1190 0.1190 ( 10242 PWs) bands (ev): -5.2440 -5.2440 -3.7798 -3.7798 -3.7621 -3.7621 -3.7580 -3.7580 -2.4662 -2.4662 -2.4641 -2.4641 -2.3735 -2.3735 -1.6646 -1.6646 2.8262 2.8262 2.8371 2.8371 2.8825 2.8825 3.1615 3.1615 3.2799 3.2799 3.4374 3.4374 3.7200 3.7200 3.9766 3.9766 4.1004 4.1004 4.4810 4.4810 4.4918 4.4918 4.6329 4.6329 4.6697 4.6697 4.6900 4.6900 4.8102 4.8102 4.8446 4.8446 4.9026 4.9026 5.2706 5.2706 5.3126 5.3126 5.3353 5.3353 5.3757 5.3757 5.4171 5.4171 5.4198 5.4198 5.4773 5.4773 5.4879 5.4879 5.5667 5.5667 5.6201 5.6201 5.6715 5.6715 5.6864 5.6864 6.1296 6.1296 6.2153 6.2153 6.2759 6.2759 6.5343 6.5343 6.6417 6.6417 6.6899 6.6899 8.0352 8.0352 8.4811 8.4811 8.5085 8.5085 8.8406 8.8406 8.9771 8.9771 9.1265 9.1265 9.7923 9.7923 10.2837 10.2837 10.6885 10.6885 11.2755 11.2755 12.8908 12.8908 13.0227 13.0227 k = 0.1310 0.1310 0.1310 ( 10242 PWs) bands (ev): -5.2206 -5.2206 -3.7969 -3.7969 -3.7769 -3.7769 -3.7728 -3.7728 -2.4603 -2.4603 -2.4582 -2.4582 -2.3516 -2.3516 -1.6932 -1.6932 2.7940 2.7940 2.8063 2.8063 2.8387 2.8387 3.1783 3.1783 3.2944 3.2944 3.4469 3.4469 3.7384 3.7384 4.0009 4.0009 4.0784 4.0784 4.4983 4.4983 4.5079 4.5079 4.6374 4.6374 4.6773 4.6773 4.6984 4.6984 4.8425 4.8425 4.8764 4.8764 4.9448 4.9448 5.2683 5.2683 5.3099 5.3099 5.3361 5.3361 5.3763 5.3763 5.4235 5.4235 5.4244 5.4244 5.4813 5.4813 5.4904 5.4904 5.5655 5.5655 5.6174 5.6174 5.6784 5.6784 5.6958 5.6958 6.1142 6.1142 6.2124 6.2124 6.2763 6.2763 6.5667 6.5667 6.6770 6.6770 6.7366 6.7366 8.0262 8.0262 8.4803 8.4803 8.5022 8.5022 8.7889 8.7889 8.9143 8.9143 9.1080 9.1080 9.7676 9.7676 10.2523 10.2523 10.6595 10.6595 11.2454 11.2454 12.8120 12.8120 12.9466 12.9466 k = 0.1429 0.1429 0.1429 ( 10236 PWs) bands (ev): -5.1951 -5.1951 -3.8143 -3.8143 -3.7921 -3.7921 -3.7881 -3.7881 -2.4550 -2.4550 -2.4528 -2.4528 -2.3298 -2.3298 -1.7237 -1.7237 2.7641 2.7641 2.7776 2.7776 2.7977 2.7977 3.1952 3.1952 3.3116 3.3116 3.4594 3.4594 3.7542 3.7542 4.0258 4.0258 4.0504 4.0504 4.5109 4.5109 4.5192 4.5192 4.6446 4.6446 4.6870 4.6870 4.7091 4.7091 4.8751 4.8751 4.9049 4.9049 4.9943 4.9943 5.2682 5.2682 5.3075 5.3075 5.3371 5.3371 5.3773 5.3773 5.4271 5.4271 5.4295 5.4295 5.4870 5.4870 5.4934 5.4934 5.5646 5.5646 5.6148 5.6148 5.6858 5.6858 5.7053 5.7053 6.0977 6.0977 6.2111 6.2111 6.2776 6.2776 6.5957 6.5957 6.7211 6.7211 6.7885 6.7885 8.0148 8.0148 8.4714 8.4714 8.4845 8.4845 8.7332 8.7332 8.8599 8.8599 9.0861 9.0861 9.7492 9.7492 10.2217 10.2217 10.6270 10.6270 11.2132 11.2132 12.7359 12.7359 12.8638 12.8638 k = 0.1548 0.1548 0.1548 ( 10239 PWs) bands (ev): -5.1676 -5.1676 -3.8317 -3.8317 -3.8076 -3.8076 -3.8037 -3.8037 -2.4503 -2.4503 -2.4482 -2.4482 -2.3087 -2.3087 -1.7561 -1.7561 2.7367 2.7367 2.7517 2.7517 2.7599 2.7599 3.2113 3.2113 3.3311 3.3311 3.4743 3.4743 3.7648 3.7648 4.0240 4.0240 4.0517 4.0517 4.5188 4.5188 4.5264 4.5264 4.6547 4.6547 4.6990 4.6990 4.7225 4.7225 4.9064 4.9064 4.9306 4.9306 5.0447 5.0447 5.2708 5.2708 5.3059 5.3059 5.3383 5.3383 5.3787 5.3787 5.4279 5.4279 5.4352 5.4352 5.4938 5.4938 5.4968 5.4968 5.5641 5.5641 5.6129 5.6129 5.6935 5.6935 5.7143 5.7143 6.0806 6.0806 6.2113 6.2113 6.2797 6.2797 6.6214 6.6214 6.7748 6.7748 6.8458 6.8458 7.9991 7.9991 8.4486 8.4486 8.4517 8.4517 8.6834 8.6834 8.8176 8.8176 9.0630 9.0630 9.7322 9.7322 10.1912 10.1912 10.5911 10.5911 11.1809 11.1809 12.6629 12.6629 12.7783 12.7783 k = 0.1667 0.1667 0.1667 ( 10269 PWs) bands (ev): -5.1380 -5.1380 -3.8491 -3.8491 -3.8234 -3.8234 -3.8196 -3.8196 -2.4466 -2.4466 -2.4444 -2.4444 -2.2885 -2.2885 -1.7900 -1.7900 2.7119 2.7119 2.7263 2.7263 2.7291 2.7291 3.2254 3.2254 3.3525 3.3525 3.4910 3.4910 3.7669 3.7669 4.0067 4.0067 4.0788 4.0788 4.5227 4.5227 4.5300 4.5300 4.6675 4.6675 4.7131 4.7131 4.7386 4.7386 4.9358 4.9358 4.9540 4.9540 5.0904 5.0904 5.2756 5.2756 5.3066 5.3066 5.3398 5.3398 5.3808 5.3808 5.4273 5.4273 5.4404 5.4404 5.5008 5.5008 5.5009 5.5009 5.5636 5.5636 5.6119 5.6119 5.7008 5.7008 5.7221 5.7221 6.0633 6.0633 6.2130 6.2130 6.2822 6.2822 6.6443 6.6443 6.8369 6.8369 6.9086 6.9086 7.9775 7.9775 8.4027 8.4027 8.4065 8.4065 8.6470 8.6470 8.7886 8.7886 9.0426 9.0426 9.7119 9.7119 10.1604 10.1604 10.5520 10.5520 11.1500 11.1500 12.5913 12.5913 12.6928 12.6928 k = 0.1786 0.1786 0.1786 ( 10239 PWs) bands (ev): -5.1064 -5.1064 -3.8662 -3.8662 -3.8392 -3.8392 -3.8354 -3.8354 -2.4438 -2.4438 -2.4416 -2.4416 -2.2697 -2.2697 -1.8253 -1.8253 2.6872 2.6872 2.6993 2.6993 2.7101 2.7101 3.2363 3.2363 3.3754 3.3754 3.5091 3.5091 3.7592 3.7592 4.0037 4.0037 4.1073 4.1073 4.5234 4.5234 4.5310 4.5310 4.6827 4.6827 4.7292 4.7292 4.7573 4.7573 4.9627 4.9627 4.9753 4.9753 5.1269 5.1269 5.2802 5.2802 5.3130 5.3130 5.3416 5.3416 5.3839 5.3839 5.4256 5.4256 5.4451 5.4451 5.5054 5.5054 5.5077 5.5077 5.5631 5.5631 5.6128 5.6128 5.7075 5.7075 5.7284 5.7284 6.0465 6.0465 6.2162 6.2162 6.2852 6.2852 6.6653 6.6653 6.9064 6.9064 6.9766 6.9766 7.9496 7.9496 8.3402 8.3402 8.3459 8.3459 8.6243 8.6243 8.7703 8.7703 9.0284 9.0284 9.6856 9.6856 10.1291 10.1291 10.5100 10.5100 11.1213 11.1213 12.5182 12.5182 12.6097 12.6097 k = 0.1905 0.1905 0.1905 ( 10245 PWs) bands (ev): -5.0729 -5.0729 -3.8830 -3.8830 -3.8549 -3.8549 -3.8512 -3.8512 -2.4421 -2.4421 -2.4399 -2.4399 -2.2528 -2.2528 -1.8617 -1.8617 2.6611 2.6611 2.6809 2.6809 2.6950 2.6950 3.2428 3.2428 3.3991 3.3991 3.5282 3.5282 3.7448 3.7448 4.0151 4.0151 4.1373 4.1373 4.5220 4.5220 4.5302 4.5302 4.6998 4.6998 4.7470 4.7470 4.7781 4.7781 4.9870 4.9870 4.9948 4.9948 5.1523 5.1523 5.2811 5.2811 5.3268 5.3268 5.3436 5.3436 5.3883 5.3883 5.4230 5.4230 5.4493 5.4493 5.5107 5.5107 5.5134 5.5134 5.5622 5.5622 5.6161 5.6161 5.7130 5.7130 5.7326 5.7326 6.0311 6.0311 6.2205 6.2205 6.2882 6.2882 6.6842 6.6842 6.9818 6.9818 7.0493 7.0493 7.9161 7.9161 8.2681 8.2681 8.2724 8.2724 8.6100 8.6100 8.7586 8.7586 9.0221 9.0221 9.6521 9.6521 10.0971 10.0971 10.4654 10.4654 11.0953 11.0953 12.4409 12.4409 12.5308 12.5308 k = 0.2024 0.2024 0.2024 ( 10257 PWs) bands (ev): -5.0375 -5.0375 -3.8993 -3.8993 -3.8705 -3.8705 -3.8669 -3.8669 -2.4416 -2.4416 -2.4394 -2.4394 -2.2381 -2.2381 -1.8990 -1.8990 2.6366 2.6366 2.6681 2.6681 2.6839 2.6839 3.2435 3.2435 3.4232 3.4232 3.5481 3.5481 3.7300 3.7300 4.0373 4.0373 4.1690 4.1690 4.5192 4.5192 4.5283 4.5283 4.7185 4.7185 4.7664 4.7664 4.8003 4.8003 5.0088 5.0088 5.0125 5.0125 5.1683 5.1683 5.2793 5.2793 5.3432 5.3432 5.3458 5.3458 5.3942 5.3942 5.4202 5.4202 5.4532 5.4532 5.5168 5.5168 5.5174 5.5174 5.5609 5.5609 5.6222 5.6222 5.7171 5.7171 5.7346 5.7346 6.0179 6.0179 6.2258 6.2258 6.2910 6.2910 6.7004 6.7004 7.0617 7.0617 7.1259 7.1259 7.8787 7.8787 8.1903 8.1903 8.1918 8.1918 8.5988 8.5988 8.7498 8.7498 9.0239 9.0239 9.6123 9.6123 10.0645 10.0645 10.4187 10.4187 11.0719 11.0719 12.3585 12.3585 12.4558 12.4558 k = 0.2143 0.2143 0.2143 ( 10248 PWs) bands (ev): -5.0004 -5.0004 -3.9150 -3.9150 -3.8858 -3.8858 -3.8822 -3.8822 -2.4423 -2.4423 -2.4401 -2.4401 -2.2260 -2.2260 -1.9369 -1.9369 2.6149 2.6149 2.6596 2.6596 2.6768 2.6768 3.2376 3.2376 3.4471 3.4471 3.5684 3.5684 3.7202 3.7202 4.0669 4.0669 4.2022 4.2022 4.5157 4.5157 4.5258 4.5258 4.7386 4.7386 4.7869 4.7869 4.8237 4.8237 5.0284 5.0284 5.0287 5.0287 5.1777 5.1777 5.2764 5.2764 5.3483 5.3483 5.3572 5.3572 5.4001 5.4001 5.4188 5.4188 5.4566 5.4566 5.5192 5.5192 5.5238 5.5238 5.5596 5.5596 5.6302 5.6302 5.7198 5.7198 5.7347 5.7347 6.0080 6.0080 6.2317 6.2317 6.2936 6.2936 6.7125 6.7125 7.1449 7.1449 7.2051 7.2051 7.8399 7.8399 8.1074 8.1074 8.1094 8.1094 8.5874 8.5874 8.7413 8.7413 9.0329 9.0329 9.5681 9.5681 10.0313 10.0313 10.3701 10.3701 11.0512 11.0512 12.2728 12.2728 12.3825 12.3825 k = 0.2262 0.2262 0.2262 ( 10252 PWs) bands (ev): -4.9615 -4.9615 -3.9300 -3.9300 -3.9007 -3.9007 -3.8972 -3.8972 -2.4442 -2.4442 -2.4420 -2.4420 -2.2169 -2.2169 -1.9751 -1.9751 2.5965 2.5965 2.6552 2.6552 2.6737 2.6737 3.2253 3.2253 3.4707 3.4707 3.5890 3.5890 3.7182 3.7182 4.1014 4.1014 4.2368 4.2368 4.5121 4.5121 4.5234 4.5234 4.7600 4.7600 4.8084 4.8084 4.8476 4.8476 5.0435 5.0435 5.0462 5.0462 5.1827 5.1827 5.2730 5.2730 5.3509 5.3509 5.3673 5.3673 5.4008 5.4008 5.4228 5.4228 5.4596 5.4596 5.5186 5.5186 5.5320 5.5320 5.5589 5.5589 5.6382 5.6382 5.7212 5.7212 5.7330 5.7330 6.0023 6.0023 6.2379 6.2379 6.2957 6.2957 6.7189 6.7189 7.2296 7.2296 7.2852 7.2852 7.8019 7.8019 8.0216 8.0216 8.0276 8.0276 8.5741 8.5741 8.7313 8.7313 9.0473 9.0473 9.5223 9.5223 9.9976 9.9976 10.3200 10.3200 11.0331 11.0331 12.1858 12.1858 12.3092 12.3092 k = 0.2381 0.2381 0.2381 ( 10243 PWs) bands (ev): -4.9209 -4.9209 -3.9443 -3.9443 -3.9151 -3.9151 -3.9117 -3.9117 -2.4474 -2.4474 -2.4451 -2.4451 -2.2113 -2.2113 -2.0133 -2.0133 2.5813 2.5813 2.6546 2.6546 2.6746 2.6746 3.2074 3.2074 3.4937 3.4937 3.6096 3.6096 3.7248 3.7248 4.1392 4.1392 4.2725 4.2725 4.5089 4.5089 4.5215 4.5215 4.7826 4.7826 4.8304 4.8304 4.8715 4.8715 5.0571 5.0571 5.0626 5.0626 5.1843 5.1843 5.2694 5.2694 5.3536 5.3536 5.3745 5.3745 5.3962 5.3962 5.4308 5.4308 5.4622 5.4622 5.5159 5.5159 5.5414 5.5414 5.5592 5.5592 5.6442 5.6442 5.7217 5.7217 5.7300 5.7300 6.0013 6.0013 6.2442 6.2442 6.2973 6.2973 6.7182 6.7182 7.3139 7.3139 7.3639 7.3639 7.7665 7.7665 7.9362 7.9362 7.9472 7.9472 8.5579 8.5579 8.7189 8.7189 9.0652 9.0652 9.4782 9.4782 9.9634 9.9634 10.2689 10.2689 11.0175 11.0175 12.0994 12.0994 12.2352 12.2352 k = 0.2500 0.2500 0.2500 ( 10231 PWs) bands (ev): -4.8788 -4.8788 -3.9578 -3.9578 -3.9291 -3.9291 -3.9258 -3.9258 -2.4517 -2.4517 -2.4494 -2.4494 -2.2095 -2.2095 -2.0510 -2.0510 2.5696 2.5696 2.6577 2.6577 2.6792 2.6792 3.1857 3.1857 3.5162 3.5162 3.6303 3.6303 3.7389 3.7389 4.1792 4.1792 4.3087 4.3087 4.5065 4.5065 4.5209 4.5209 4.8060 4.8060 4.8527 4.8527 4.8949 4.8949 5.0694 5.0694 5.0780 5.0780 5.1828 5.1828 5.2664 5.2664 5.3563 5.3563 5.3800 5.3800 5.3899 5.3899 5.4389 5.4389 5.4643 5.4643 5.5117 5.5117 5.5520 5.5520 5.5607 5.5607 5.6467 5.6467 5.7215 5.7215 5.7264 5.7264 6.0051 6.0051 6.2504 6.2504 6.2981 6.2981 6.7093 6.7093 7.3954 7.3954 7.4371 7.4371 7.7341 7.7341 7.8533 7.8533 7.8715 7.8715 8.5382 8.5382 8.7033 8.7033 9.0842 9.0842 9.4391 9.4391 9.9290 9.9290 10.2171 10.2171 11.0044 11.0044 12.0150 12.0150 12.1608 12.1608 k = 0.2619 0.2619 0.2619 ( 10234 PWs) bands (ev): -4.8353 -4.8353 -3.9705 -3.9705 -3.9425 -3.9425 -3.9392 -3.9392 -2.4571 -2.4571 -2.4547 -2.4547 -2.2122 -2.2122 -2.0877 -2.0877 2.5614 2.5614 2.6643 2.6643 2.6874 2.6874 3.1622 3.1622 3.5385 3.5385 3.6509 3.6509 3.7587 3.7587 4.2203 4.2203 4.3443 4.3443 4.5054 4.5054 4.5225 4.5225 4.8299 4.8299 4.8747 4.8747 4.9172 4.9172 5.0799 5.0799 5.0931 5.0931 5.1784 5.1784 5.2642 5.2642 5.3589 5.3589 5.3804 5.3804 5.3871 5.3871 5.4461 5.4461 5.4658 5.4658 5.5068 5.5068 5.5631 5.5631 5.5636 5.5636 5.6450 5.6450 5.7210 5.7210 5.7232 5.7232 6.0131 6.0131 6.2564 6.2564 6.2983 6.2983 6.6920 6.6920 7.4692 7.4692 7.4962 7.4962 7.7024 7.7024 7.7783 7.7783 7.8081 7.8081 8.5150 8.5150 8.6842 8.6842 9.1026 9.1026 9.4084 9.4084 9.8944 9.8944 10.1649 10.1649 10.9937 10.9937 11.9340 11.9340 12.0873 12.0873 k = 0.2738 0.2738 0.2738 ( 10240 PWs) bands (ev): -4.7904 -4.7904 -3.9823 -3.9823 -3.9553 -3.9553 -3.9521 -3.9521 -2.4635 -2.4635 -2.4611 -2.4611 -2.2201 -2.2201 -2.1224 -2.1224 2.5569 2.5569 2.6740 2.6740 2.6989 2.6989 3.1383 3.1383 3.5609 3.5609 3.6714 3.6714 3.7827 3.7827 4.2611 4.2611 4.3776 4.3776 4.5061 4.5061 4.5278 4.5278 4.8534 4.8534 4.8963 4.8963 4.9378 4.9378 5.0874 5.0874 5.1083 5.1083 5.1725 5.1725 5.2632 5.2632 5.3612 5.3612 5.3741 5.3741 5.3908 5.3908 5.4523 5.4523 5.4667 5.4667 5.5021 5.5021 5.5666 5.5666 5.5753 5.5753 5.6397 5.6397 5.7206 5.7206 5.7217 5.7217 6.0244 6.0244 6.2621 6.2621 6.2976 6.2976 6.6672 6.6672 7.5220 7.5220 7.5220 7.5220 7.6650 7.6650 7.7278 7.7278 7.7751 7.7751 8.4883 8.4883 8.6617 8.6617 9.1189 9.1189 9.3887 9.3887 9.8597 9.8597 10.1124 10.1124 10.9852 10.9852 11.8577 11.8577 12.0164 12.0164 k = 0.2857 0.2857 0.2857 ( 10222 PWs) bands (ev): -4.7444 -4.7444 -3.9933 -3.9933 -3.9675 -3.9675 -3.9643 -3.9643 -2.4708 -2.4708 -2.4684 -2.4684 -2.2342 -2.2342 -2.1543 -2.1543 2.5561 2.5561 2.6865 2.6865 2.7134 2.7134 3.1154 3.1154 3.5834 3.5834 3.6920 3.6920 3.8093 3.8093 4.3001 4.3001 4.4059 4.4059 4.5096 4.5096 4.5389 4.5389 4.8744 4.8744 4.9177 4.9177 4.9564 4.9564 5.0899 5.0899 5.1243 5.1243 5.1684 5.1684 5.2636 5.2636 5.3634 5.3634 5.3681 5.3681 5.3947 5.3947 5.4571 5.4571 5.4671 5.4671 5.4986 5.4986 5.5710 5.5710 5.5862 5.5862 5.6318 5.6318 5.7206 5.7206 5.7238 5.7238 6.0380 6.0380 6.2675 6.2675 6.2962 6.2962 6.6365 6.6365 7.4973 7.4973 7.5181 7.5181 7.6325 7.6325 7.7231 7.7231 7.7885 7.7885 8.4585 8.4585 8.6358 8.6358 9.1328 9.1328 9.3809 9.3809 9.8250 9.8250 10.0598 10.0598 10.9787 10.9787 11.7876 11.7876 11.9503 11.9503 k = 0.2976 0.2976 0.2976 ( 10249 PWs) bands (ev): -4.6974 -4.6974 -4.0034 -4.0034 -3.9790 -3.9790 -3.9759 -3.9759 -2.4789 -2.4789 -2.4764 -2.4764 -2.2548 -2.2548 -2.1825 -2.1825 2.5592 2.5592 2.7015 2.7015 2.7306 2.7306 3.0942 3.0942 3.6063 3.6063 3.7127 3.7127 3.8373 3.8373 4.3354 4.3354 4.4267 4.4267 4.5167 4.5167 4.5575 4.5575 4.8885 4.8885 4.9403 4.9403 4.9729 4.9729 5.0861 5.0861 5.1411 5.1411 5.1699 5.1699 5.2650 5.2650 5.3634 5.3634 5.3652 5.3652 5.3983 5.3983 5.4592 5.4592 5.4668 5.4668 5.4976 5.4976 5.5761 5.5761 5.5948 5.5948 5.6227 5.6227 5.7213 5.7213 5.7313 5.7313 6.0530 6.0530 6.2727 6.2727 6.2941 6.2941 6.6020 6.6020 7.4389 7.4389 7.4594 7.4594 7.6040 7.6040 7.7594 7.7594 7.8301 7.8301 8.4259 8.4259 8.6068 8.6068 9.1452 9.1452 9.3837 9.3837 9.7902 9.7902 10.0070 10.0070 10.9741 10.9741 11.7253 11.7253 11.8915 11.8915 k = 0.3095 0.3095 0.3095 ( 10237 PWs) bands (ev): -4.6494 -4.6494 -4.0126 -4.0126 -3.9898 -3.9898 -3.9868 -3.9868 -2.4877 -2.4877 -2.4851 -2.4851 -2.2811 -2.2811 -2.2079 -2.2079 2.5664 2.5664 2.7186 2.7186 2.7500 2.7500 3.0753 3.0753 3.6298 3.6298 3.7337 3.7337 3.8658 3.8658 4.3648 4.3648 4.4399 4.4399 4.5285 4.5285 4.5829 4.5829 4.8900 4.8900 4.9654 4.9654 4.9878 4.9878 5.0804 5.0804 5.1589 5.1589 5.1776 5.1776 5.2672 5.2672 5.3604 5.3604 5.3667 5.3667 5.4016 5.4016 5.4579 5.4579 5.4659 5.4659 5.5003 5.5003 5.5801 5.5801 5.6005 5.6005 5.6155 5.6155 5.7234 5.7234 5.7453 5.7453 6.0688 6.0688 6.2778 6.2778 6.2914 6.2914 6.5659 6.5659 7.3675 7.3675 7.3849 7.3849 7.5660 7.5660 7.8080 7.8080 7.8782 7.8782 8.3911 8.3911 8.5753 8.5753 9.1574 9.1574 9.3945 9.3945 9.7551 9.7551 9.9539 9.9539 10.9716 10.9716 11.6720 11.6720 11.8358 11.8358 k = 0.3214 0.3214 0.3214 ( 10225 PWs) bands (ev): -4.6009 -4.6009 -4.0210 -4.0210 -4.0000 -4.0000 -3.9970 -3.9970 -2.4970 -2.4970 -2.4943 -2.4943 -2.3106 -2.3106 -2.2324 -2.2324 2.5776 2.5776 2.7374 2.7374 2.7712 2.7712 3.0589 3.0589 3.6541 3.6541 3.7553 3.7553 3.8941 3.8941 4.3871 4.3871 4.4475 4.4475 4.5447 4.5447 4.6114 4.6114 4.8752 4.8752 4.9927 4.9927 5.0021 5.0021 5.0796 5.0796 5.1774 5.1774 5.1893 5.1893 5.2696 5.2696 5.3591 5.3591 5.3679 5.3679 5.4047 5.4047 5.4536 5.4536 5.4646 5.4646 5.5058 5.5058 5.5783 5.5783 5.6037 5.6037 5.6160 5.6160 5.7272 5.7272 5.7659 5.7659 6.0850 6.0850 6.2829 6.2829 6.2882 6.2882 6.5301 6.5301 7.2915 7.2915 7.3071 7.3071 7.5188 7.5188 7.8545 7.8545 7.9235 7.9235 8.3546 8.3546 8.5417 8.5417 9.1700 9.1700 9.4099 9.4099 9.7195 9.7195 9.9002 9.9002 10.9720 10.9720 11.6288 11.6288 11.7884 11.7884 k = 0.3333 0.3333 0.3333 ( 10213 PWs) bands (ev): -4.5519 -4.5519 -4.0285 -4.0285 -4.0094 -4.0094 -4.0064 -4.0064 -2.5066 -2.5066 -2.5039 -2.5039 -2.3414 -2.3414 -2.2576 -2.2576 2.5929 2.5929 2.7573 2.7573 2.7938 2.7938 3.0451 3.0451 3.6792 3.6792 3.7775 3.7775 3.9218 3.9218 4.4026 4.4026 4.4518 4.4518 4.5631 4.5631 4.6388 4.6388 4.8443 4.8443 5.0170 5.0170 5.0217 5.0217 5.0872 5.0872 5.1962 5.1962 5.2030 5.2030 5.2723 5.2723 5.3592 5.3592 5.3687 5.3687 5.4075 5.4075 5.4479 5.4479 5.4630 5.4630 5.5125 5.5125 5.5705 5.5705 5.6057 5.6057 5.6262 5.6262 5.7332 5.7332 5.7917 5.7917 6.1010 6.1010 6.2847 6.2847 6.2882 6.2882 6.4964 6.4964 7.2142 7.2142 7.2289 7.2289 7.4632 7.4632 7.8942 7.8942 7.9619 7.9619 8.3169 8.3169 8.5067 8.5067 9.1829 9.1829 9.4266 9.4266 9.6830 9.6830 9.8455 9.8455 10.9773 10.9773 11.5968 11.5968 11.7536 11.7536 k = 0.3452 0.3452 0.3452 ( 10213 PWs) bands (ev): -4.5029 -4.5029 -4.0353 -4.0353 -4.0181 -4.0181 -4.0151 -4.0151 -2.5164 -2.5164 -2.5137 -2.5137 -2.3722 -2.3722 -2.2843 -2.2843 2.6121 2.6121 2.7781 2.7781 2.8173 2.8173 3.0338 3.0338 3.7054 3.7054 3.8007 3.8007 3.9483 3.9483 4.4129 4.4129 4.4543 4.4543 4.5799 4.5799 4.6616 4.6616 4.8014 4.8014 5.0341 5.0341 5.0519 5.0519 5.1017 5.1017 5.2150 5.2150 5.2172 5.2172 5.2753 5.2753 5.3605 5.3605 5.3692 5.3692 5.4098 5.4098 5.4423 5.4423 5.4614 5.4614 5.5182 5.5182 5.5620 5.5620 5.6078 5.6078 5.6424 5.6424 5.7417 5.7417 5.8212 5.8212 6.1164 6.1164 6.2811 6.2811 6.2941 6.2941 6.4661 6.4661 7.1367 7.1367 7.1514 7.1514 7.4000 7.4000 7.9258 7.9258 7.9920 7.9920 8.2787 8.2787 8.4710 8.4710 9.1951 9.1951 9.4412 9.4412 9.6454 9.6454 9.7897 9.7897 10.9900 10.9900 11.5764 11.5764 11.7322 11.7322 k = 0.3571 0.3571 0.3571 ( 10237 PWs) bands (ev): -4.4539 -4.4539 -4.0413 -4.0413 -4.0260 -4.0260 -4.0232 -4.0232 -2.5262 -2.5262 -2.5235 -2.5235 -2.4022 -2.4022 -2.3127 -2.3127 2.6351 2.6351 2.7992 2.7992 2.8412 2.8412 3.0249 3.0249 3.7327 3.7327 3.8251 3.8251 3.9735 3.9735 4.4198 4.4198 4.4559 4.4559 4.5908 4.5908 4.6771 4.6771 4.7517 4.7517 5.0547 5.0547 5.0831 5.0831 5.1208 5.1208 5.2307 5.2307 5.2333 5.2333 5.2790 5.2790 5.3625 5.3625 5.3694 5.3694 5.4107 5.4107 5.4384 5.4384 5.4602 5.4602 5.5198 5.5198 5.5585 5.5585 5.6112 5.6112 5.6626 5.6626 5.7531 5.7531 5.8530 5.8530 6.1308 6.1308 6.2777 6.2777 6.3009 6.3009 6.4402 6.4402 7.0598 7.0598 7.0752 7.0752 7.3306 7.3306 7.9489 7.9489 8.0132 8.0132 8.2402 8.2402 8.4352 8.4352 9.2059 9.2059 9.4506 9.4506 9.6066 9.6066 9.7327 9.7327 11.0133 11.0133 11.5679 11.5679 11.7247 11.7247 k = 0.3690 0.3690 0.3690 ( 10231 PWs) bands (ev): -4.4056 -4.4056 -4.0465 -4.0465 -4.0333 -4.0333 -4.0305 -4.0305 -2.5360 -2.5360 -2.5332 -2.5332 -2.4309 -2.4309 -2.3427 -2.3427 2.6616 2.6616 2.8203 2.8203 2.8650 2.8650 3.0181 3.0181 3.7613 3.7613 3.8508 3.8508 3.9970 3.9970 4.4246 4.4246 4.4571 4.4571 4.5899 4.5899 4.6840 4.6840 4.7015 4.7015 5.0790 5.0790 5.1148 5.1148 5.1422 5.1422 5.2422 5.2422 5.2508 5.2508 5.2843 5.2843 5.3650 5.3650 5.3695 5.3695 5.4096 5.4096 5.4378 5.4378 5.4600 5.4600 5.5157 5.5157 5.5628 5.5628 5.6170 5.6170 5.6861 5.6861 5.7677 5.7677 5.8857 5.8857 6.1436 6.1436 6.2748 6.2748 6.3090 6.3090 6.4194 6.4194 6.9840 6.9840 7.0005 7.0005 7.2564 7.2564 7.9639 7.9639 8.0254 8.0254 8.2019 8.2019 8.3999 8.3999 9.2148 9.2148 9.4519 9.4519 9.5668 9.5668 9.6747 9.6747 11.0499 11.0499 11.5711 11.5711 11.7307 11.7307 k = 0.3810 0.3810 0.3810 ( 10222 PWs) bands (ev): -4.3581 -4.3581 -4.0511 -4.0511 -4.0399 -4.0399 -4.0371 -4.0371 -2.5454 -2.5454 -2.5426 -2.5426 -2.4579 -2.4579 -2.3740 -2.3740 2.6911 2.6911 2.8410 2.8410 2.8883 2.8883 3.0133 3.0133 3.7912 3.7912 3.8781 3.8781 4.0189 4.0189 4.4280 4.4280 4.4579 4.4579 4.5682 4.5682 4.6612 4.6612 4.6820 4.6820 5.1059 5.1059 5.1448 5.1448 5.1652 5.1652 5.2509 5.2509 5.2675 5.2675 5.2922 5.2922 5.3677 5.3677 5.3695 5.3695 5.4074 5.4074 5.4404 5.4404 5.4611 5.4611 5.5092 5.5092 5.5730 5.5730 5.6259 5.6259 5.7118 5.7118 5.7858 5.7858 5.9179 5.9179 6.1540 6.1540 6.2727 6.2727 6.3187 6.3187 6.4043 6.4043 6.9096 6.9096 6.9280 6.9280 7.1786 7.1786 7.9717 7.9717 8.0294 8.0294 8.1642 8.1642 8.3657 8.3657 9.2216 9.2216 9.4436 9.4436 9.5266 9.5266 9.6162 9.6162 11.1012 11.1012 11.5852 11.5852 11.7490 11.7490 k = 0.3929 0.3929 0.3929 ( 10195 PWs) bands (ev): -4.3121 -4.3121 -4.0550 -4.0550 -4.0458 -4.0458 -4.0429 -4.0429 -2.5545 -2.5545 -2.5516 -2.5516 -2.4830 -2.4830 -2.4059 -2.4059 2.7228 2.7228 2.8612 2.8612 2.9105 2.9105 3.0103 3.0103 3.8223 3.8223 3.9069 3.9069 4.0389 4.0389 4.4303 4.4303 4.4586 4.4586 4.5226 4.5226 4.6357 4.6357 4.6719 4.6719 5.1335 5.1335 5.1694 5.1694 5.1895 5.1895 5.2566 5.2566 5.2835 5.2835 5.3032 5.3032 5.3695 5.3695 5.3698 5.3698 5.4069 5.4069 5.4452 5.4452 5.4637 5.4637 5.5032 5.5032 5.5872 5.5872 5.6386 5.6386 5.7385 5.7385 5.8081 5.8081 5.9484 5.9484 6.1615 6.1615 6.2715 6.2715 6.3301 6.3301 6.3947 6.3947 6.8372 6.8372 6.8579 6.8579 7.0985 7.0985 7.9735 7.9735 8.0263 8.0263 8.1273 8.1273 8.3331 8.3331 9.2265 9.2265 9.4254 9.4254 9.4869 9.4869 9.5583 9.5583 11.1669 11.1669 11.6088 11.6088 11.7778 11.7778 k = 0.4048 0.4048 0.4048 ( 10195 PWs) bands (ev): -4.2681 -4.2681 -4.0584 -4.0584 -4.0510 -4.0510 -4.0481 -4.0481 -2.5630 -2.5630 -2.5601 -2.5601 -2.5060 -2.5060 -2.4378 -2.4378 2.7559 2.7559 2.8807 2.8807 2.9314 2.9314 3.0088 3.0088 3.8543 3.8543 3.9372 3.9372 4.0571 4.0571 4.4299 4.4299 4.4592 4.4592 4.4666 4.4666 4.6153 4.6153 4.6548 4.6548 5.1594 5.1594 5.1878 5.1878 5.2114 5.2114 5.2605 5.2605 5.2988 5.2988 5.3165 5.3165 5.3697 5.3697 5.3701 5.3701 5.4111 5.4111 5.4509 5.4509 5.4679 5.4679 5.4989 5.4989 5.6054 5.6054 5.6557 5.6557 5.7643 5.7643 5.8354 5.8354 5.9763 5.9763 6.1659 6.1659 6.2709 6.2709 6.3429 6.3429 6.3902 6.3902 6.7675 6.7675 6.7913 6.7913 7.0175 7.0175 7.9705 7.9705 8.0173 8.0173 8.0915 8.0915 8.3024 8.3024 9.2297 9.2297 9.3990 9.3990 9.4481 9.4481 9.5018 9.5018 11.2451 11.2451 11.6405 11.6405 11.8144 11.8144 k = 0.4167 0.4167 0.4167 ( 10201 PWs) bands (ev): -4.2267 -4.2267 -4.0612 -4.0612 -4.0555 -4.0555 -4.0527 -4.0527 -2.5708 -2.5708 -2.5679 -2.5679 -2.5266 -2.5266 -2.4691 -2.4691 2.7888 2.7888 2.8999 2.8999 2.9506 2.9506 3.0085 3.0085 3.8868 3.8868 3.9690 3.9690 4.0735 4.0735 4.3972 4.3972 4.4394 4.4394 4.4595 4.4595 4.5934 4.5934 4.6322 4.6322 5.1817 5.1817 5.2018 5.2018 5.2264 5.2264 5.2640 5.2640 5.3136 5.3136 5.3301 5.3301 5.3689 5.3689 5.3701 5.3701 5.4216 5.4216 5.4571 5.4571 5.4734 5.4734 5.4967 5.4967 5.6284 5.6284 5.6776 5.6776 5.7873 5.7873 5.8690 5.8690 6.0011 6.0011 6.1676 6.1676 6.2700 6.2700 6.3558 6.3558 6.3894 6.3894 6.7018 6.7018 6.7292 6.7292 6.9366 6.9366 7.9642 7.9642 8.0040 8.0040 8.0574 8.0574 8.2739 8.2739 9.2315 9.2315 9.3678 9.3678 9.4103 9.4103 9.4482 9.4482 11.3315 11.3315 11.6796 11.6796 11.8560 11.8560 k = 0.4286 0.4286 0.4286 ( 10201 PWs) bands (ev): -4.1885 -4.1885 -4.0636 -4.0636 -4.0594 -4.0594 -4.0565 -4.0565 -2.5779 -2.5779 -2.5750 -2.5750 -2.5448 -2.5448 -2.4987 -2.4987 2.8197 2.8197 2.9193 2.9193 2.9676 2.9676 3.0092 3.0092 3.9191 3.9191 4.0018 4.0018 4.0882 4.0882 4.3389 4.3389 4.4389 4.4389 4.4596 4.4596 4.5688 4.5688 4.6058 4.6058 5.1992 5.1992 5.2122 5.2122 5.2340 5.2340 5.2676 5.2676 5.3275 5.3275 5.3416 5.3416 5.3673 5.3673 5.3706 5.3706 5.4366 5.4366 5.4635 5.4635 5.4799 5.4799 5.4965 5.4965 5.6571 5.6571 5.7044 5.7044 5.8064 5.8064 5.9088 5.9088 6.0229 6.0229 6.1674 6.1674 6.2673 6.2673 6.3657 6.3657 6.3904 6.3904 6.6426 6.6426 6.6738 6.6738 6.8573 6.8573 7.9559 7.9559 7.9882 7.9882 8.0253 8.0253 8.2479 8.2479 9.2320 9.2320 9.3355 9.3355 9.3737 9.3737 9.3987 9.3987 11.4202 11.4202 11.7260 11.7260 11.8995 11.8995 k = 0.4405 0.4405 0.4405 ( 10201 PWs) bands (ev): -4.1543 -4.1543 -4.0655 -4.0655 -4.0627 -4.0627 -4.0597 -4.0597 -2.5840 -2.5840 -2.5812 -2.5812 -2.5604 -2.5604 -2.5260 -2.5260 2.8465 2.8465 2.9398 2.9398 2.9824 2.9824 3.0106 3.0106 3.9498 3.9498 4.0350 4.0350 4.1016 4.1016 4.2833 4.2833 4.4397 4.4397 4.4594 4.4594 4.5419 4.5419 4.5770 4.5770 5.2120 5.2120 5.2198 5.2198 5.2365 5.2365 5.2706 5.2706 5.3400 5.3400 5.3501 5.3501 5.3660 5.3660 5.3714 5.3714 5.4514 5.4514 5.4710 5.4710 5.4867 5.4867 5.4978 5.4978 5.6918 5.6918 5.7351 5.7351 5.8215 5.8215 5.9537 5.9537 6.0426 6.0426 6.1660 6.1660 6.2611 6.2611 6.3671 6.3671 6.3904 6.3904 6.5947 6.5947 6.6276 6.6276 6.7809 6.7809 7.9469 7.9469 7.9713 7.9713 7.9960 7.9960 8.2248 8.2248 9.2312 9.2312 9.3052 9.3052 9.3392 9.3392 9.3546 9.3546 11.5030 11.5030 11.7816 11.7816 11.9418 11.9418 k = 0.4524 0.4524 0.4524 ( 10180 PWs) bands (ev): -4.1249 -4.1249 -4.0671 -4.0671 -4.0654 -4.0654 -4.0622 -4.0622 -2.5891 -2.5891 -2.5864 -2.5864 -2.5733 -2.5733 -2.5498 -2.5498 2.8674 2.8674 2.9614 2.9614 2.9947 2.9947 3.0124 3.0124 3.9771 3.9771 4.0677 4.0677 4.1140 4.1140 4.2344 4.2344 4.4406 4.4406 4.4585 4.4585 4.5140 4.5140 4.5480 4.5480 5.2208 5.2208 5.2252 5.2252 5.2364 5.2364 5.2727 5.2727 5.3504 5.3504 5.3561 5.3561 5.3654 5.3654 5.3725 5.3725 5.4611 5.4611 5.4810 5.4810 5.4932 5.4932 5.5001 5.5001 5.7312 5.7312 5.7679 5.7679 5.8330 5.8330 6.0021 6.0021 6.0615 6.0615 6.1639 6.1639 6.2492 6.2492 6.3528 6.3528 6.3871 6.3871 6.5642 6.5642 6.5933 6.5933 6.7096 6.7096 7.9381 7.9381 7.9550 7.9550 7.9702 7.9702 8.2050 8.2050 9.2288 9.2288 9.2797 9.2797 9.3081 9.3081 9.3169 9.3169 11.5716 11.5716 11.8476 11.8476 11.9803 11.9803 k = 0.4643 0.4643 0.4643 ( 10159 PWs) bands (ev): -4.1011 -4.1011 -4.0684 -4.0684 -4.0674 -4.0674 -4.0640 -4.0640 -2.5932 -2.5932 -2.5909 -2.5909 -2.5833 -2.5833 -2.5694 -2.5694 2.8822 2.8822 2.9826 2.9826 3.0044 3.0044 3.0141 3.0141 3.9986 3.9986 4.0982 4.0982 4.1258 4.1258 4.1952 4.1952 4.4413 4.4413 4.4562 4.4562 4.4873 4.4873 4.5215 4.5215 5.2267 5.2267 5.2288 5.2288 5.2354 5.2354 5.2738 5.2738 5.3579 5.3579 5.3604 5.3604 5.3652 5.3652 5.3740 5.3740 5.4660 5.4660 5.4916 5.4916 5.4989 5.4989 5.5027 5.5027 5.7726 5.7726 5.7996 5.7996 5.8413 5.8413 6.0518 6.0518 6.0817 6.0817 6.1614 6.1614 6.2310 6.2310 6.3213 6.3213 6.3791 6.3791 6.5518 6.5518 6.5716 6.5716 6.6467 6.6467 7.9305 7.9305 7.9406 7.9406 7.9489 7.9489 8.1888 8.1888 9.2238 9.2238 9.2615 9.2615 9.2821 9.2821 9.2866 9.2866 11.6218 11.6218 11.9202 11.9202 12.0124 12.0124 k = 0.4762 0.4762 0.4762 ( 10129 PWs) bands (ev): -4.0836 -4.0836 -4.0693 -4.0693 -4.0689 -4.0689 -4.0652 -4.0652 -2.5962 -2.5962 -2.5946 -2.5946 -2.5906 -2.5906 -2.5834 -2.5834 2.8917 2.8917 3.0006 3.0006 3.0114 3.0114 3.0156 3.0156 4.0121 4.0121 4.1241 4.1241 4.1368 4.1368 4.1681 4.1681 4.4419 4.4419 4.4517 4.4517 4.4642 4.4642 4.5011 4.5011 5.2303 5.2303 5.2312 5.2312 5.2342 5.2342 5.2743 5.2743 5.3626 5.3626 5.3633 5.3633 5.3653 5.3653 5.3758 5.3758 5.4686 5.4686 5.5001 5.5001 5.5033 5.5033 5.5049 5.5049 5.8111 5.8111 5.8265 5.8265 5.8468 5.8468 6.0989 6.0989 6.1054 6.1054 6.1581 6.1581 6.2102 6.2102 6.2794 6.2794 6.3662 6.3662 6.5505 6.5505 6.5600 6.5600 6.5966 6.5966 7.9246 7.9246 7.9293 7.9293 7.9329 7.9329 8.1769 8.1769 9.2162 9.2162 9.2516 9.2516 9.2626 9.2626 9.2644 9.2644 11.6546 11.6546 11.9885 11.9885 12.0366 12.0366 k = 0.4881 0.4881 0.4881 ( 10144 PWs) bands (ev): -4.0731 -4.0731 -4.0699 -4.0699 -4.0698 -4.0698 -4.0656 -4.0656 -2.5979 -2.5979 -2.5974 -2.5974 -2.5961 -2.5961 -2.5904 -2.5904 2.8970 2.8970 3.0127 3.0127 3.0156 3.0156 3.0166 3.0166 4.0179 4.0179 4.1421 4.1421 4.1454 4.1454 4.1532 4.1532 4.4422 4.4422 4.4454 4.4454 4.4481 4.4481 4.4897 4.4897 5.2322 5.2322 5.2324 5.2324 5.2332 5.2332 5.2745 5.2745 5.3648 5.3648 5.3649 5.3649 5.3654 5.3654 5.3774 5.3774 5.4700 5.4700 5.5052 5.5052 5.5060 5.5060 5.5064 5.5064 5.8399 5.8399 5.8445 5.8445 5.8499 5.8499 6.1326 6.1326 6.1360 6.1360 6.1534 6.1534 6.1946 6.1946 6.2373 6.2373 6.3510 6.3510 6.5525 6.5525 6.5550 6.5550 6.5645 6.5645 7.9209 7.9209 7.9221 7.9221 7.9230 7.9230 8.1696 8.1696 9.2094 9.2094 9.2475 9.2475 9.2505 9.2505 9.2509 9.2509 11.6729 11.6729 12.0382 12.0382 12.0515 12.0515 k = 0.5000 0.5000 0.5000 ( 10144 PWs) bands (ev): -4.0701 -4.0701 -4.0701 -4.0701 -4.0701 -4.0701 -4.0652 -4.0652 -2.5985 -2.5985 -2.5985 -2.5985 -2.5985 -2.5985 -2.5920 -2.5920 2.8987 2.8987 3.0170 3.0170 3.0170 3.0170 3.0170 3.0170 4.0192 4.0192 4.1487 4.1487 4.1487 4.1487 4.1487 4.1487 4.4423 4.4423 4.4423 4.4423 4.4423 4.4423 4.4865 4.4865 5.2328 5.2328 5.2328 5.2328 5.2328 5.2328 5.2745 5.2745 5.3655 5.3655 5.3655 5.3655 5.3655 5.3655 5.3780 5.3780 5.4704 5.4704 5.5069 5.5069 5.5069 5.5069 5.5069 5.5069 5.8509 5.8509 5.8509 5.8509 5.8509 5.8509 6.1505 6.1505 6.1505 6.1505 6.1505 6.1505 6.1901 6.1901 6.2138 6.2138 6.3431 6.3431 6.5536 6.5536 6.5536 6.5536 6.5536 6.5536 7.9196 7.9196 7.9196 7.9196 7.9196 7.9196 8.1672 8.1672 9.2068 9.2068 9.2464 9.2464 9.2464 9.2464 9.2464 9.2464 11.6788 11.6788 12.0565 12.0565 12.0565 12.0565 k = 0.5000 0.5000 0.5000 ( 10144 PWs) bands (ev): -4.0701 -4.0701 -4.0701 -4.0701 -4.0701 -4.0701 -4.0652 -4.0652 -2.5985 -2.5985 -2.5985 -2.5985 -2.5985 -2.5985 -2.5920 -2.5920 2.8987 2.8987 3.0170 3.0170 3.0170 3.0170 3.0170 3.0170 4.0192 4.0192 4.1487 4.1487 4.1487 4.1487 4.1487 4.1487 4.4423 4.4423 4.4423 4.4423 4.4423 4.4423 4.4865 4.4865 5.2328 5.2328 5.2328 5.2328 5.2328 5.2328 5.2745 5.2745 5.3655 5.3655 5.3655 5.3655 5.3655 5.3655 5.3780 5.3780 5.4704 5.4704 5.5069 5.5069 5.5069 5.5069 5.5069 5.5069 5.8509 5.8509 5.8509 5.8509 5.8509 5.8509 6.1505 6.1505 6.1505 6.1505 6.1505 6.1505 6.1901 6.1901 6.2138 6.2138 6.3431 6.3431 6.5536 6.5536 6.5536 6.5536 6.5536 6.5536 7.9196 7.9196 7.9196 7.9196 7.9196 7.9196 8.1672 8.1672 9.2068 9.2068 9.2464 9.2464 9.2464 9.2464 9.2464 9.2464 11.6788 11.6788 12.0565 12.0565 12.0565 12.0565 k = 0.4853 0.5000 0.4853 ( 10144 PWs) bands (ev): -4.0723 -4.0723 -4.0712 -4.0712 -4.0693 -4.0693 -4.0655 -4.0655 -2.5980 -2.5980 -2.5972 -2.5972 -2.5962 -2.5962 -2.5905 -2.5905 2.8970 2.8970 3.0131 3.0131 3.0150 3.0150 3.0167 3.0167 4.0179 4.0179 4.1418 4.1418 4.1470 4.1470 4.1517 4.1517 4.4427 4.4427 4.4453 4.4453 4.4480 4.4480 4.4897 4.4897 5.2322 5.2322 5.2326 5.2326 5.2331 5.2331 5.2745 5.2745 5.3647 5.3647 5.3652 5.3652 5.3653 5.3653 5.3774 5.3774 5.4699 5.4699 5.5054 5.5054 5.5055 5.5055 5.5065 5.5065 5.8402 5.8402 5.8447 5.8447 5.8490 5.8490 6.1264 6.1264 6.1441 6.1441 6.1516 6.1516 6.1947 6.1947 6.2368 6.2368 6.3514 6.3514 6.5513 6.5513 6.5583 6.5583 6.5625 6.5625 7.9213 7.9213 7.9215 7.9215 7.9232 7.9232 8.1697 8.1697 9.2095 9.2095 9.2479 9.2479 9.2499 9.2499 9.2512 9.2512 11.6729 11.6729 12.0400 12.0400 12.0474 12.0474 k = 0.4706 0.5000 0.4706 ( 10130 PWs) bands (ev): -4.0789 -4.0789 -4.0770 -4.0770 -4.0671 -4.0671 -4.0642 -4.0642 -2.5963 -2.5963 -2.5943 -2.5943 -2.5891 -2.5891 -2.5847 -2.5847 2.8917 2.8917 3.0019 3.0019 3.0092 3.0092 3.0160 3.0160 4.0124 4.0124 4.1226 4.1226 4.1447 4.1447 4.1604 4.1604 4.4439 4.4439 4.4519 4.4519 4.4638 4.4638 4.5007 4.5007 5.2301 5.2301 5.2318 5.2318 5.2337 5.2337 5.2743 5.2743 5.3623 5.3623 5.3641 5.3641 5.3647 5.3647 5.3757 5.3757 5.4686 5.4686 5.5011 5.5011 5.5016 5.5016 5.5054 5.5054 5.8120 5.8120 5.8271 5.8271 5.8436 5.8436 6.0840 6.0840 6.1295 6.1295 6.1479 6.1479 6.2131 6.2131 6.2762 6.2762 6.3689 6.3689 6.5451 6.5451 6.5743 6.5743 6.5878 6.5878 7.9263 7.9263 7.9273 7.9273 7.9337 7.9337 8.1771 8.1771 9.2169 9.2169 9.2523 9.2523 9.2610 9.2610 9.2656 9.2656 11.6547 11.6547 11.9934 11.9934 12.0224 12.0224 k = 0.4559 0.5000 0.4559 ( 10152 PWs) bands (ev): -4.0897 -4.0897 -4.0876 -4.0876 -4.0634 -4.0634 -4.0607 -4.0607 -2.5935 -2.5935 -2.5909 -2.5909 -2.5777 -2.5777 -2.5738 -2.5738 2.8824 2.8824 2.9838 2.9838 3.0006 3.0006 3.0148 3.0148 3.9990 3.9990 4.0942 4.0942 4.1471 4.1471 4.1743 4.1743 4.4459 4.4459 4.4579 4.4579 4.4870 4.4870 4.5201 4.5201 5.2263 5.2263 5.2301 5.2301 5.2346 5.2346 5.2738 5.2738 5.3584 5.3584 5.3611 5.3611 5.3637 5.3637 5.3740 5.3740 5.4661 5.4661 5.4936 5.4936 5.4953 5.4953 5.5035 5.5035 5.7736 5.7736 5.8009 5.8009 5.8348 5.8348 6.0384 6.0384 6.1131 6.1131 6.1368 6.1368 6.2426 6.2426 6.3155 6.3155 6.3859 6.3859 6.5366 6.5366 6.6051 6.6051 6.6264 6.6264 7.9343 7.9343 7.9362 7.9362 7.9504 7.9504 8.1890 8.1890 9.2276 9.2276 9.2594 9.2594 9.2803 9.2803 9.2890 9.2890 11.6236 11.6236 11.9236 11.9236 11.9872 11.9872 k = 0.4412 0.5000 0.4412 ( 10170 PWs) bands (ev): -4.1045 -4.1045 -4.1023 -4.1023 -4.0582 -4.0582 -4.0557 -4.0557 -2.5895 -2.5895 -2.5867 -2.5867 -2.5621 -2.5621 -2.5586 -2.5586 2.8688 2.8688 2.9602 2.9602 2.9906 2.9906 3.0131 3.0131 3.9762 3.9762 4.0597 4.0597 4.1572 4.1572 4.1922 4.1922 4.4487 4.4487 4.4623 4.4623 4.5148 4.5148 4.5458 4.5458 5.2201 5.2201 5.2273 5.2273 5.2354 5.2354 5.2727 5.2727 5.3531 5.3531 5.3551 5.3551 5.3624 5.3624 5.3735 5.3735 5.4616 5.4616 5.4834 5.4834 5.4879 5.4879 5.5009 5.5009 5.7315 5.7315 5.7698 5.7698 5.8232 5.8232 5.9931 5.9931 6.0971 6.0971 6.1222 6.1222 6.2749 6.2749 6.3412 6.3412 6.4087 6.4087 6.5290 6.5290 6.6504 6.6504 6.6747 6.6747 7.9450 7.9450 7.9477 7.9477 7.9723 7.9723 8.2048 8.2048 9.2407 9.2407 9.2691 9.2691 9.3076 9.3076 9.3206 9.3206 11.5799 11.5799 11.8387 11.8387 11.9482 11.9482 k = 0.4265 0.5000 0.4265 ( 10186 PWs) bands (ev): -4.1227 -4.1227 -4.1205 -4.1205 -4.0516 -4.0516 -4.0491 -4.0491 -2.5846 -2.5846 -2.5816 -2.5816 -2.5430 -2.5430 -2.5396 -2.5396 2.8507 2.8507 2.9321 2.9321 2.9803 2.9803 3.0109 3.0109 3.9458 3.9458 4.0212 4.0212 4.1740 4.1740 4.2130 4.2130 4.4524 4.4524 4.4659 4.4659 4.5452 4.5452 4.5749 4.5749 5.2105 5.2105 5.2228 5.2228 5.2358 5.2358 5.2705 5.2705 5.3460 5.3460 5.3466 5.3466 5.3609 5.3609 5.3740 5.3740 5.4538 5.4538 5.4708 5.4708 5.4812 5.4812 5.4978 5.4978 5.6904 5.6904 5.7377 5.7377 5.8094 5.8094 5.9497 5.9497 6.0813 6.0813 6.1062 6.1062 6.3026 6.3026 6.3438 6.3438 6.4482 6.4482 6.5271 6.5271 6.7061 6.7061 6.7301 6.7301 7.9577 7.9577 7.9606 7.9606 7.9981 7.9981 8.2237 8.2237 9.2560 9.2560 9.2810 9.2810 9.3418 9.3418 9.3593 9.3593 11.5254 11.5254 11.7461 11.7461 11.9102 11.9102 k = 0.4118 0.5000 0.4118 ( 10198 PWs) bands (ev): -4.1440 -4.1440 -4.1419 -4.1419 -4.0436 -4.0436 -4.0411 -4.0411 -2.5785 -2.5785 -2.5755 -2.5755 -2.5208 -2.5208 -2.5175 -2.5175 2.8284 2.8284 2.9008 2.9008 2.9705 2.9705 3.0082 3.0082 3.9103 3.9103 3.9802 3.9802 4.1947 4.1947 4.2356 4.2356 4.4569 4.4569 4.4690 4.4690 4.5766 4.5766 4.6051 4.6051 5.1960 5.1960 5.2152 5.2152 5.2351 5.2351 5.2667 5.2667 5.3346 5.3346 5.3394 5.3394 5.3593 5.3593 5.3754 5.3754 5.4422 5.4422 5.4567 5.4567 5.4767 5.4767 5.4943 5.4943 5.6534 5.6534 5.7077 5.7077 5.7941 5.7941 5.9090 5.9090 6.0649 6.0649 6.0896 6.0896 6.3202 6.3202 6.3341 6.3341 6.4965 6.4965 6.5364 6.5364 6.7681 6.7681 6.7905 6.7905 7.9718 7.9718 7.9740 7.9740 8.0266 8.0266 8.2446 8.2446 9.2735 9.2735 9.2947 9.2947 9.3809 9.3809 9.4037 9.4037 11.4642 11.4642 11.6520 11.6520 11.8755 11.8755 k = 0.3971 0.5000 0.3971 ( 10194 PWs) bands (ev): -4.1679 -4.1679 -4.1659 -4.1659 -4.0341 -4.0341 -4.0317 -4.0317 -2.5715 -2.5715 -2.5684 -2.5684 -2.4961 -2.4961 -2.4929 -2.4929 2.8028 2.8028 2.8675 2.8675 2.9613 2.9613 3.0051 3.0051 3.8717 3.8717 3.9377 3.9377 4.2169 4.2169 4.2586 4.2586 4.4623 4.4623 4.4718 4.4718 4.6079 4.6079 4.6349 4.6349 5.1751 5.1751 5.2030 5.2030 5.2330 5.2330 5.2605 5.2605 5.3224 5.3224 5.3321 5.3321 5.3578 5.3578 5.3773 5.3773 5.4286 5.4286 5.4431 5.4431 5.4741 5.4741 5.4907 5.4907 5.6228 5.6228 5.6818 5.6818 5.7783 5.7783 5.8715 5.8715 6.0474 6.0474 6.0724 6.0724 6.3204 6.3204 6.3253 6.3253 6.5481 6.5481 6.5595 6.5595 6.8339 6.8339 6.8544 6.8544 7.9862 7.9862 7.9868 7.9868 8.0567 8.0567 8.2666 8.2666 9.2930 9.2930 9.3097 9.3097 9.4228 9.4228 9.4522 9.4522 11.4017 11.4017 11.5618 11.5618 11.8442 11.8442 k = 0.3824 0.5000 0.3824 ( 10204 PWs) bands (ev): -4.1939 -4.1939 -4.1920 -4.1920 -4.0234 -4.0234 -4.0210 -4.0210 -2.5635 -2.5635 -2.5605 -2.5605 -2.4695 -2.4695 -2.4663 -2.4663 2.7751 2.7751 2.8332 2.8332 2.9527 2.9527 3.0015 3.0015 3.8313 3.8313 3.8942 3.8942 4.2385 4.2385 4.2811 4.2811 4.4684 4.4684 4.4742 4.4742 4.6383 4.6383 4.6634 4.6634 5.1467 5.1467 5.1840 5.1840 5.2288 5.2288 5.2520 5.2520 5.3111 5.3111 5.3252 5.3252 5.3565 5.3565 5.3792 5.3792 5.4160 5.4160 5.4315 5.4315 5.4726 5.4726 5.4871 5.4871 5.5992 5.5992 5.6608 5.6608 5.7626 5.7626 5.8373 5.8373 6.0285 6.0285 6.0542 6.0542 6.3059 6.3059 6.3209 6.3209 6.5941 6.5941 6.6009 6.6009 6.9019 6.9019 6.9209 6.9209 7.9976 7.9976 7.9995 7.9995 8.0874 8.0874 8.2885 8.2885 9.3145 9.3145 9.3254 9.3254 9.4654 9.4654 9.5029 9.5029 11.3435 11.3435 11.4798 11.4798 11.8161 11.8161 k = 0.3676 0.5000 0.3676 ( 10204 PWs) bands (ev): -4.2217 -4.2217 -4.2198 -4.2198 -4.0113 -4.0113 -4.0090 -4.0090 -2.5546 -2.5546 -2.5516 -2.5516 -2.4416 -2.4416 -2.4385 -2.4385 2.7463 2.7463 2.7988 2.7988 2.9444 2.9444 2.9977 2.9977 3.7900 3.7900 3.8502 3.8502 4.2581 4.2581 4.3021 4.3021 4.4752 4.4752 4.4761 4.4761 4.6670 4.6670 4.6895 4.6895 5.1112 5.1112 5.1572 5.1572 5.2225 5.2225 5.2417 5.2417 5.3016 5.3016 5.3193 5.3193 5.3555 5.3555 5.3802 5.3802 5.4067 5.4067 5.4232 5.4232 5.4719 5.4719 5.4840 5.4840 5.5825 5.5825 5.6443 5.6443 5.7475 5.7475 5.8067 5.8067 6.0083 6.0083 6.0351 6.0351 6.2923 6.2923 6.3116 6.3116 6.6360 6.6360 6.6540 6.6540 6.9713 6.9713 6.9893 6.9893 8.0051 8.0051 8.0102 8.0102 8.1182 8.1182 8.3095 8.3095 9.3376 9.3376 9.3410 9.3410 9.5067 9.5067 9.5540 9.5540 11.2943 11.2943 11.4099 11.4099 11.7908 11.7908 k = 0.3529 0.5000 0.3529 ( 10218 PWs) bands (ev): -4.2507 -4.2507 -4.2489 -4.2489 -3.9981 -3.9981 -3.9957 -3.9957 -2.5450 -2.5450 -2.5419 -2.5419 -2.4129 -2.4129 -2.4099 -2.4099 2.7174 2.7174 2.7650 2.7650 2.9362 2.9362 2.9935 2.9935 3.7484 3.7484 3.8062 3.8062 4.2744 4.2744 4.3209 4.3209 4.4773 4.4773 4.4823 4.4823 4.6935 4.6935 4.7123 4.7123 5.0705 5.0705 5.1244 5.1244 5.2136 5.2136 5.2299 5.2299 5.2937 5.2937 5.3146 5.3146 5.3545 5.3545 5.3797 5.3797 5.4022 5.4022 5.4186 5.4186 5.4716 5.4716 5.4818 5.4818 5.5723 5.5723 5.6316 5.6316 5.7337 5.7337 5.7798 5.7798 5.9876 5.9876 6.0151 6.0151 6.2800 6.2800 6.3008 6.3008 6.6817 6.6817 6.7067 6.7067 7.0415 7.0415 7.0593 7.0593 8.0074 8.0074 8.0160 8.0160 8.1488 8.1488 8.3289 8.3289 9.3562 9.3562 9.3620 9.3620 9.5450 9.5450 9.6038 9.6038 11.2579 11.2579 11.3552 11.3552 11.7686 11.7686 k = 0.3382 0.5000 0.3382 ( 10224 PWs) bands (ev): -4.2806 -4.2806 -4.2789 -4.2789 -3.9836 -3.9836 -3.9813 -3.9813 -2.5345 -2.5345 -2.5315 -2.5315 -2.3841 -2.3841 -2.3810 -2.3810 2.6893 2.6893 2.7324 2.7324 2.9281 2.9281 2.9892 2.9892 3.7069 3.7069 3.7624 3.7624 4.2868 4.2868 4.3368 4.3368 4.4778 4.4778 4.4896 4.4896 4.7170 4.7170 4.7312 4.7312 5.0271 5.0271 5.0884 5.0884 5.2023 5.2023 5.2165 5.2165 5.2868 5.2868 5.3110 5.3110 5.3536 5.3536 5.3784 5.3784 5.4018 5.4018 5.4170 5.4170 5.4715 5.4715 5.4811 5.4811 5.5679 5.5679 5.6221 5.6221 5.7214 5.7214 5.7567 5.7567 5.9669 5.9669 5.9946 5.9946 6.2692 6.2692 6.2903 6.2903 6.7292 6.7292 6.7587 6.7587 7.1122 7.1122 7.1304 7.1304 8.0027 8.0027 8.0150 8.0150 8.1795 8.1795 8.3467 8.3467 9.3702 9.3702 9.3872 9.3872 9.5793 9.5793 9.6508 9.6508 11.2368 11.2368 11.3179 11.3179 11.7499 11.7499 k = 0.3235 0.5000 0.3235 ( 10240 PWs) bands (ev): -4.3110 -4.3110 -4.3094 -4.3094 -3.9681 -3.9681 -3.9657 -3.9657 -2.5234 -2.5234 -2.5205 -2.5205 -2.3555 -2.3555 -2.3525 -2.3525 2.6625 2.6625 2.7015 2.7015 2.9199 2.9199 2.9850 2.9850 3.6658 3.6658 3.7191 3.7191 4.2946 4.2946 4.3492 4.3492 4.4778 4.4778 4.4966 4.4966 4.7370 4.7370 4.7453 4.7453 4.9835 4.9835 5.0521 5.0521 5.1883 5.1883 5.2013 5.2013 5.2804 5.2804 5.3085 5.3085 5.3527 5.3527 5.3775 5.3775 5.4039 5.4039 5.4173 5.4173 5.4716 5.4716 5.4821 5.4821 5.5685 5.5685 5.6153 5.6153 5.7111 5.7111 5.7374 5.7374 5.9470 5.9470 5.9742 5.9742 6.2596 6.2596 6.2807 6.2807 6.7771 6.7771 6.8095 6.8095 7.1832 7.1832 7.2026 7.2026 7.9893 7.9893 8.0048 8.0048 8.2107 8.2107 8.3630 8.3630 9.3830 9.3830 9.4125 9.4125 9.6092 9.6092 9.6942 9.6942 11.2317 11.2317 11.2987 11.2987 11.7354 11.7354 k = 0.3088 0.5000 0.3088 ( 10224 PWs) bands (ev): -4.3415 -4.3415 -4.3401 -4.3401 -3.9515 -3.9515 -3.9492 -3.9492 -2.5117 -2.5117 -2.5088 -2.5088 -2.3276 -2.3276 -2.3247 -2.3247 2.6375 2.6375 2.6724 2.6724 2.9118 2.9118 2.9810 2.9810 3.6253 3.6253 3.6765 3.6765 4.2977 4.2977 4.3575 4.3575 4.4779 4.4779 4.5031 4.5031 4.7528 4.7528 4.7542 4.7542 4.9422 4.9422 5.0179 5.0179 5.1721 5.1721 5.1842 5.1842 5.2743 5.2743 5.3069 5.3069 5.3525 5.3525 5.3773 5.3773 5.4075 5.4075 5.4182 5.4182 5.4722 5.4722 5.4852 5.4852 5.5733 5.5733 5.6109 5.6109 5.7031 5.7031 5.7219 5.7219 5.9289 5.9289 5.9545 5.9545 6.2510 6.2510 6.2722 6.2722 6.8243 6.8243 6.8587 6.8587 7.2543 7.2543 7.2754 7.2754 7.9657 7.9657 7.9840 7.9840 8.2427 8.2427 8.3785 8.3785 9.3946 9.3946 9.4375 9.4375 9.6353 9.6353 9.7334 9.7334 11.2421 11.2421 11.2973 11.2973 11.7261 11.7261 k = 0.2941 0.5000 0.2941 ( 10226 PWs) bands (ev): -4.3721 -4.3721 -4.3707 -4.3707 -3.9340 -3.9340 -3.9317 -3.9317 -2.4996 -2.4996 -2.4967 -2.4967 -2.3009 -2.3009 -2.2980 -2.2980 2.6146 2.6146 2.6455 2.6455 2.9039 2.9039 2.9775 2.9775 3.5857 3.5857 3.6349 3.6349 4.2960 4.2960 4.3609 4.3609 4.4787 4.4787 4.5090 4.5090 4.7573 4.7573 4.7632 4.7632 4.9055 4.9055 4.9876 4.9876 5.1538 5.1538 5.1656 5.1656 5.2684 5.2684 5.3056 5.3056 5.3529 5.3529 5.3770 5.3770 5.4125 5.4125 5.4191 5.4191 5.4735 5.4735 5.4898 5.4898 5.5811 5.5811 5.6086 5.6086 5.6975 5.6975 5.7100 5.7100 5.9130 5.9130 5.9362 5.9362 6.2430 6.2430 6.2646 6.2646 6.8700 6.8700 6.9059 6.9059 7.3250 7.3250 7.3484 7.3484 7.9317 7.9317 7.9519 7.9519 8.2758 8.2758 8.3938 8.3938 9.4051 9.4051 9.4613 9.4613 9.6585 9.6585 9.7685 9.7685 11.2658 11.2658 11.3116 11.3116 11.7227 11.7227 k = 0.2794 0.5000 0.2794 ( 10226 PWs) bands (ev): -4.4022 -4.4022 -4.4009 -4.4009 -3.9156 -3.9156 -3.9134 -3.9134 -2.4870 -2.4870 -2.4843 -2.4843 -2.2756 -2.2756 -2.2727 -2.2727 2.5938 2.5938 2.6207 2.6207 2.8965 2.8965 2.9749 2.9749 3.5471 3.5471 3.5946 3.5946 4.2895 4.2895 4.3594 4.3594 4.4807 4.4807 4.5142 4.5142 4.7548 4.7548 4.7668 4.7668 4.8761 4.8761 4.9622 4.9622 5.1340 5.1340 5.1456 5.1456 5.2627 5.2627 5.3040 5.3040 5.3542 5.3542 5.3760 5.3760 5.4184 5.4184 5.4196 5.4196 5.4757 5.4757 5.4953 5.4953 5.5906 5.5906 5.6085 5.6085 5.6948 5.6948 5.7016 5.7016 5.9001 5.9001 5.9198 5.9198 6.2352 6.2352 6.2576 6.2576 6.9134 6.9134 6.9506 6.9506 7.3949 7.3949 7.4206 7.4206 7.8883 7.8883 7.9086 7.9086 8.3103 8.3103 8.4095 8.4095 9.4149 9.4149 9.4833 9.4833 9.6798 9.6798 9.7995 9.7995 11.3002 11.3002 11.3390 11.3390 11.7261 11.7261 k = 0.2647 0.5000 0.2647 ( 10238 PWs) bands (ev): -4.4318 -4.4318 -4.4306 -4.4306 -3.8966 -3.8966 -3.8944 -3.8944 -2.4743 -2.4743 -2.4715 -2.4715 -2.2521 -2.2521 -2.2492 -2.2492 2.5752 2.5752 2.5979 2.5979 2.8897 2.8897 2.9734 2.9734 3.5096 3.5096 3.5558 3.5558 4.2787 4.2787 4.3532 4.3532 4.4839 4.4839 4.5189 4.5189 4.7472 4.7472 4.7619 4.7619 4.8565 4.8565 4.9419 4.9419 5.1130 5.1130 5.1247 5.1247 5.2572 5.2572 5.3017 5.3017 5.3560 5.3560 5.3742 5.3742 5.4199 5.4199 5.4244 5.4244 5.4789 5.4789 5.5009 5.5009 5.6008 5.6008 5.6103 5.6103 5.6952 5.6952 5.6963 5.6963 5.8906 5.8906 5.9059 5.9059 6.2273 6.2273 6.2509 6.2509 6.9538 6.9538 6.9925 6.9925 7.4631 7.4631 7.4893 7.4893 7.8392 7.8392 7.8558 7.8558 8.3464 8.3464 8.4257 8.4257 9.4244 9.4244 9.5029 9.5029 9.7003 9.7003 9.8268 9.8268 11.3424 11.3424 11.3760 11.3760 11.7363 11.7363 k = 0.2500 0.5000 0.2500 ( 10238 PWs) bands (ev): -4.4607 -4.4607 -4.4595 -4.4595 -3.8770 -3.8770 -3.8748 -3.8748 -2.4614 -2.4614 -2.4587 -2.4587 -2.2305 -2.2305 -2.2276 -2.2276 2.5585 2.5585 2.5770 2.5770 2.8839 2.8839 2.9736 2.9736 3.4735 3.4735 3.5187 3.5187 4.2643 4.2643 4.3433 4.3433 4.4878 4.4878 4.5231 4.5231 4.7361 4.7361 4.7492 4.7492 4.8465 4.8465 4.9262 4.9262 5.0915 5.0915 5.1033 5.1033 5.2519 5.2519 5.2985 5.2985 5.3578 5.3578 5.3716 5.3716 5.4202 5.4202 5.4296 5.4296 5.4830 5.4830 5.5059 5.5059 5.6107 5.6107 5.6138 5.6138 5.6937 5.6937 5.6984 5.6984 5.8848 5.8848 5.8951 5.8951 6.2191 6.2191 6.2440 6.2440 6.9902 6.9902 7.0310 7.0310 7.5278 7.5278 7.5476 7.5476 7.7933 7.7933 7.7963 7.7963 8.3845 8.3845 8.4428 8.4428 9.4337 9.4337 9.5193 9.5193 9.7205 9.7205 9.8503 9.8503 11.3899 11.3899 11.4198 11.4198 11.7531 11.7531 k = 0.2353 0.5000 0.2353 ( 10240 PWs) bands (ev): -4.4886 -4.4886 -4.4875 -4.4875 -3.8569 -3.8569 -3.8548 -3.8548 -2.4485 -2.4485 -2.4459 -2.4459 -2.2109 -2.2109 -2.2081 -2.2081 2.5434 2.5434 2.5575 2.5575 2.8796 2.8796 2.9758 2.9758 3.4387 3.4387 3.4836 3.4836 4.2472 4.2472 4.3312 4.3312 4.4917 4.4917 4.5267 4.5267 4.7233 4.7233 4.7329 4.7329 4.8425 4.8425 4.9142 4.9142 5.0697 5.0697 5.0818 5.0818 5.2466 5.2466 5.2942 5.2942 5.3591 5.3591 5.3683 5.3683 5.4206 5.4206 5.4335 5.4335 5.4876 5.4876 5.5102 5.5102 5.6183 5.6183 5.6197 5.6197 5.6934 5.6934 5.7038 5.7038 5.8829 5.8829 5.8878 5.8878 6.2101 6.2101 6.2365 6.2365 7.0216 7.0216 7.0656 7.0656 7.5759 7.5759 7.5836 7.5836 7.7375 7.7375 7.7726 7.7726 8.4249 8.4249 8.4611 8.4611 9.4427 9.4427 9.5324 9.5324 9.7407 9.7407 9.8702 9.8702 11.4407 11.4407 11.4679 11.4679 11.7751 11.7751 k = 0.2206 0.5000 0.2206 ( 10232 PWs) bands (ev): -4.5154 -4.5154 -4.5144 -4.5144 -3.8365 -3.8365 -3.8345 -3.8345 -2.4357 -2.4357 -2.4333 -2.4333 -2.1935 -2.1935 -2.1908 -2.1908 2.5296 2.5296 2.5394 2.5394 2.8772 2.8772 2.9803 2.9803 3.4056 3.4056 3.4508 3.4508 4.2286 4.2286 4.3179 4.3179 4.4947 4.4947 4.5298 4.5298 4.7106 4.7106 4.7165 4.7165 4.8410 4.8410 4.9046 4.9046 5.0482 5.0482 5.0604 5.0604 5.2414 5.2414 5.2889 5.2889 5.3595 5.3595 5.3646 5.3646 5.4210 5.4210 5.4361 5.4361 5.4922 5.4922 5.5137 5.5137 5.6229 5.6229 5.6279 5.6279 5.6950 5.6950 5.7102 5.7102 5.8845 5.8845 5.8848 5.8848 6.2001 6.2001 6.2280 6.2280 7.0466 7.0466 7.0954 7.0954 7.5557 7.5557 7.6020 7.6020 7.7102 7.7102 7.7983 7.7983 8.4679 8.4679 8.4811 8.4811 9.4512 9.4512 9.5418 9.5418 9.7609 9.7609 9.8865 9.8865 11.4940 11.4940 11.5190 11.5190 11.8004 11.8004 k = 0.2059 0.5000 0.2059 ( 10232 PWs) bands (ev): -4.5410 -4.5410 -4.5401 -4.5401 -3.8159 -3.8159 -3.8140 -3.8140 -2.4233 -2.4233 -2.4209 -2.4209 -2.1783 -2.1783 -2.1756 -2.1756 2.5164 2.5164 2.5221 2.5221 2.8771 2.8771 2.9872 2.9872 3.3742 3.3742 3.4205 3.4205 4.2098 4.2098 4.3047 4.3047 4.4959 4.4959 4.5319 4.5319 4.6998 4.6998 4.7021 4.7021 4.8404 4.8404 4.8965 4.8965 5.0272 5.0272 5.0394 5.0394 5.2361 5.2361 5.2824 5.2824 5.3590 5.3590 5.3603 5.3603 5.4214 5.4214 5.4375 5.4375 5.4963 5.4963 5.5166 5.5166 5.6268 5.6268 5.6351 5.6351 5.6981 5.6981 5.7163 5.7163 5.8852 5.8852 5.8898 5.8898 6.1886 6.1886 6.2178 6.2178 7.0634 7.0634 7.1193 7.1193 7.5101 7.5101 7.5575 7.5575 7.7428 7.7428 7.8504 7.8504 8.5038 8.5038 8.5141 8.5141 9.4589 9.4589 9.5475 9.5475 9.7807 9.7807 9.8995 9.8995 11.5494 11.5494 11.5724 11.5724 11.8269 11.8269 k = 0.1912 0.5000 0.1912 ( 10234 PWs) bands (ev): -4.5652 -4.5652 -4.5644 -4.5644 -3.7954 -3.7954 -3.7936 -3.7936 -2.4112 -2.4112 -2.4090 -2.4090 -2.1653 -2.1653 -2.1627 -2.1627 2.5035 2.5035 2.5055 2.5055 2.8795 2.8795 2.9966 2.9966 3.3449 3.3449 3.3931 3.3931 4.1918 4.1918 4.2924 4.2924 4.4946 4.4946 4.5326 4.5326 4.6907 4.6907 4.6921 4.6921 4.8398 4.8398 4.8893 4.8893 5.0071 5.0071 5.0191 5.0191 5.2305 5.2305 5.2746 5.2746 5.3555 5.3555 5.3576 5.3576 5.4217 5.4217 5.4378 5.4378 5.4997 5.4997 5.5190 5.5190 5.6295 5.6295 5.6413 5.6413 5.7023 5.7023 5.7212 5.7212 5.8894 5.8894 5.8972 5.8972 6.1756 6.1756 6.2055 6.2055 7.0700 7.0700 7.1356 7.1356 7.4632 7.4632 7.4987 7.4987 7.7901 7.7901 7.9078 7.9078 8.5305 8.5305 8.5637 8.5637 9.4654 9.4654 9.5498 9.5498 9.8000 9.8000 9.9092 9.9092 11.6068 11.6068 11.6279 11.6279 11.8527 11.8527 k = 0.1765 0.5000 0.1765 ( 10242 PWs) bands (ev): -4.5880 -4.5880 -4.5873 -4.5873 -3.7751 -3.7751 -3.7734 -3.7734 -2.3998 -2.3998 -2.3976 -2.3976 -2.1542 -2.1542 -2.1517 -2.1517 2.4894 2.4894 2.4906 2.4906 2.8846 2.8846 3.0083 3.0083 3.3180 3.3180 3.3686 3.3686 4.1758 4.1758 4.2817 4.2817 4.4905 4.4905 4.5316 4.5316 4.6827 4.6827 4.6884 4.6884 4.8391 4.8391 4.8826 4.8826 4.9880 4.9880 4.9997 4.9997 5.2244 5.2244 5.2655 5.2655 5.3502 5.3502 5.3554 5.3554 5.4217 5.4217 5.4372 5.4372 5.5024 5.5024 5.5210 5.5210 5.6308 5.6308 5.6464 5.6464 5.7071 5.7071 5.7244 5.7244 5.8962 5.8962 5.9058 5.9058 6.1607 6.1607 6.1907 6.1907 7.0652 7.0652 7.1423 7.1423 7.4253 7.4253 7.4458 7.4458 7.8359 7.8359 7.9619 7.9619 8.5627 8.5627 8.6168 8.6168 9.4706 9.4706 9.5489 9.5489 9.8185 9.8185 9.9160 9.9160 11.6655 11.6655 11.6848 11.6848 11.8770 11.8770 k = 0.1618 0.5000 0.1618 ( 10242 PWs) bands (ev): -4.6093 -4.6093 -4.6086 -4.6086 -3.7553 -3.7553 -3.7536 -3.7536 -2.3890 -2.3890 -2.3870 -2.3870 -2.1450 -2.1450 -2.1427 -2.1427 2.4736 2.4736 2.4774 2.4774 2.8922 2.8922 3.0214 3.0214 3.2939 3.2939 3.3474 3.3474 4.1625 4.1625 4.2734 4.2734 4.4835 4.4835 4.5287 4.5287 4.6784 4.6784 4.6889 4.6889 4.8381 4.8381 4.8762 4.8762 4.9702 4.9702 4.9812 4.9812 5.2176 5.2176 5.2549 5.2549 5.3444 5.3444 5.3526 5.3526 5.4216 5.4216 5.4359 5.4359 5.5047 5.5047 5.5228 5.5228 5.6308 5.6308 5.6501 5.6501 5.7121 5.7121 5.7261 5.7261 5.9041 5.9041 5.9142 5.9142 6.1442 6.1442 6.1730 6.1730 7.0505 7.0505 7.1376 7.1376 7.3997 7.3997 7.4053 7.4053 7.8774 7.8774 8.0088 8.0088 8.6018 8.6018 8.6734 8.6734 9.4742 9.4742 9.5452 9.5452 9.8357 9.8357 9.9202 9.9202 11.7235 11.7235 11.7412 11.7412 11.9010 11.9010 k = 0.1471 0.5000 0.1471 ( 10234 PWs) bands (ev): -4.6289 -4.6289 -4.6283 -4.6283 -3.7360 -3.7360 -3.7345 -3.7345 -2.3790 -2.3790 -2.3771 -2.3771 -2.1375 -2.1375 -2.1353 -2.1353 2.4582 2.4582 2.4640 2.4640 2.9019 2.9019 3.0350 3.0350 3.2734 3.2734 3.3296 3.3296 4.1527 4.1527 4.2677 4.2677 4.4742 4.4742 4.5237 4.5237 4.6777 4.6777 4.6934 4.6934 4.8370 4.8370 4.8699 4.8699 4.9538 4.9538 4.9639 4.9639 5.2095 5.2095 5.2426 5.2426 5.3381 5.3381 5.3493 5.3493 5.4211 5.4211 5.4340 5.4340 5.5067 5.5067 5.5245 5.5245 5.6296 5.6296 5.6525 5.6525 5.7165 5.7165 5.7263 5.7263 5.9115 5.9115 5.9209 5.9209 6.1267 6.1267 6.1532 6.1532 7.0301 7.0301 7.1225 7.1225 7.3789 7.3789 7.3849 7.3849 7.9139 7.9139 8.0465 8.0465 8.6483 8.6483 8.7326 8.7326 9.4764 9.4764 9.5393 9.5393 9.8512 9.8512 9.9220 9.9220 11.7759 11.7759 11.7925 11.7925 11.9289 11.9289 k = 0.1324 0.5000 0.1324 ( 10238 PWs) bands (ev): -4.6469 -4.6469 -4.6463 -4.6463 -3.7177 -3.7177 -3.7162 -3.7162 -2.3700 -2.3700 -2.3682 -2.3682 -2.1315 -2.1315 -2.1295 -2.1295 2.4434 2.4434 2.4504 2.4504 2.9132 2.9132 3.0476 3.0476 3.2574 3.2574 3.3152 3.3152 4.1469 4.1469 4.2650 4.2650 4.4631 4.4631 4.5171 4.5171 4.6804 4.6804 4.7013 4.7013 4.8357 4.8357 4.8637 4.8637 4.9390 4.9390 4.9477 4.9477 5.1995 5.1995 5.2284 5.2284 5.3313 5.3313 5.3454 5.3454 5.4205 5.4205 5.4316 5.4316 5.5085 5.5085 5.5259 5.5259 5.6274 5.6274 5.6535 5.6535 5.7199 5.7199 5.7248 5.7248 5.9169 5.9169 5.9245 5.9245 6.1096 6.1096 6.1322 6.1322 7.0095 7.0095 7.1014 7.1014 7.3638 7.3638 7.3771 7.3771 7.9454 7.9454 8.0746 8.0746 8.7019 8.7019 8.7934 8.7934 9.4775 9.4775 9.5319 9.5319 9.8648 9.8648 9.9218 9.9218 11.8149 11.8149 11.8311 11.8311 11.9684 11.9684 k = 0.1176 0.5000 0.1176 ( 10238 PWs) bands (ev): -4.6631 -4.6631 -4.6626 -4.6626 -3.7004 -3.7004 -3.6990 -3.6990 -2.3620 -2.3620 -2.3604 -2.3604 -2.1268 -2.1268 -2.1249 -2.1249 2.4293 2.4293 2.4368 2.4368 2.9256 2.9256 3.0573 3.0573 3.2469 3.2469 3.3044 3.3044 4.1455 4.1455 4.2653 4.2653 4.4511 4.4511 4.5091 4.5091 4.6861 4.6861 4.7123 4.7123 4.8345 4.8345 4.8577 4.8577 4.9259 4.9259 4.9326 4.9326 5.1869 5.1869 5.2120 5.2120 5.3243 5.3243 5.3410 5.3410 5.4196 5.4196 5.4288 5.4288 5.5102 5.5102 5.5271 5.5271 5.6246 5.6246 5.6533 5.6533 5.7214 5.7214 5.7216 5.7216 5.9192 5.9192 5.9239 5.9239 6.0946 6.0946 6.1122 6.1122 6.9928 6.9928 7.0800 7.0800 7.3551 7.3551 7.3727 7.3727 7.9724 7.9724 8.0939 8.0939 8.7607 8.7607 8.8544 8.8544 9.4778 9.4778 9.5236 9.5236 9.8760 9.8760 9.9197 9.9197 11.8365 11.8365 11.8524 11.8524 12.0231 12.0231 k = 0.1029 0.5000 0.1029 ( 10250 PWs) bands (ev): -4.6775 -4.6775 -4.6771 -4.6771 -3.6844 -3.6844 -3.6832 -3.6832 -2.3550 -2.3550 -2.3536 -2.3536 -2.1231 -2.1231 -2.1214 -2.1214 2.4160 2.4160 2.4237 2.4237 2.9382 2.9382 3.0626 3.0626 3.2428 3.2428 3.2967 3.2967 4.1487 4.1487 4.2684 4.2684 4.4386 4.4386 4.5001 4.5001 4.6942 4.6942 4.7257 4.7257 4.8333 4.8333 4.8519 4.8519 4.9144 4.9144 4.9187 4.9187 5.1710 5.1710 5.1929 5.1929 5.3175 5.3175 5.3361 5.3361 5.4185 5.4185 5.4259 5.4259 5.5120 5.5120 5.5282 5.5282 5.6214 5.6214 5.6518 5.6518 5.7164 5.7164 5.7208 5.7208 5.9178 5.9178 5.9191 5.9191 6.0831 6.0831 6.0953 6.0953 6.9821 6.9821 7.0620 7.0620 7.3493 7.3493 7.3691 7.3691 7.9956 7.9956 8.1060 8.1060 8.8225 8.8225 8.9138 8.9138 9.4780 9.4780 9.5153 9.5153 9.8844 9.8844 9.9158 9.9158 11.8449 11.8449 11.8597 11.8597 12.0884 12.0884 k = 0.0882 0.5000 0.0882 ( 10242 PWs) bands (ev): -4.6901 -4.6901 -4.6897 -4.6897 -3.6700 -3.6700 -3.6689 -3.6689 -2.3491 -2.3491 -2.3479 -2.3479 -2.1202 -2.1202 -2.1187 -2.1187 2.4040 2.4040 2.4113 2.4113 2.9507 2.9507 3.0627 3.0627 3.2447 3.2447 3.2921 3.2921 4.1564 4.1564 4.2737 4.2737 4.4264 4.4264 4.4904 4.4904 4.7047 4.7047 4.7413 4.7413 4.8324 4.8324 4.8466 4.8466 4.9047 4.9047 4.9059 4.9059 5.1512 5.1512 5.1709 5.1709 5.3114 5.3114 5.3309 5.3309 5.4174 5.4174 5.4231 5.4231 5.5138 5.5138 5.5290 5.5290 5.6179 5.6179 5.6492 5.6492 5.7096 5.7096 5.7178 5.7178 5.9114 5.9114 5.9132 5.9132 6.0756 6.0756 6.0829 6.0829 6.9778 6.9778 7.0490 7.0490 7.3441 7.3441 7.3650 7.3650 8.0155 8.0155 8.1125 8.1125 8.8843 8.8843 8.9693 8.9693 9.4787 9.4787 9.5078 9.5078 9.8899 9.8899 9.9104 9.9104 11.8457 11.8457 11.8586 11.8586 12.1581 12.1581 k = 0.0735 0.5000 0.0735 ( 10244 PWs) bands (ev): -4.7008 -4.7008 -4.7005 -4.7005 -3.6573 -3.6573 -3.6564 -3.6564 -2.3443 -2.3443 -2.3432 -2.3432 -2.1180 -2.1180 -2.1167 -2.1167 2.3935 2.3935 2.4000 2.4000 2.9626 2.9626 3.0585 3.0585 3.2510 3.2510 3.2898 3.2898 4.1684 4.1684 4.2802 4.2802 4.4153 4.4153 4.4800 4.4800 4.7173 4.7173 4.7585 4.7585 4.8320 4.8320 4.8419 4.8419 4.8941 4.8941 4.8969 4.8969 5.1275 5.1275 5.1459 5.1459 5.3065 5.3065 5.3254 5.3254 5.4162 5.4162 5.4204 5.4204 5.5157 5.5157 5.5296 5.5296 5.6145 5.6145 5.6453 5.6453 5.7019 5.7019 5.7127 5.7127 5.9029 5.9029 5.9067 5.9067 6.0714 6.0714 6.0750 6.0750 6.9793 6.9793 7.0407 7.0407 7.3389 7.3389 7.3596 7.3596 8.0328 8.0328 8.1148 8.1148 8.9434 8.9434 9.0189 9.0189 9.4805 9.4805 9.5018 9.5018 9.8923 9.8923 9.9037 9.9037 11.8424 11.8424 11.8531 11.8531 12.2275 12.2275 k = 0.0588 0.5000 0.0588 ( 10240 PWs) bands (ev): -4.7096 -4.7096 -4.7093 -4.7093 -3.6466 -3.6466 -3.6459 -3.6459 -2.3405 -2.3405 -2.3396 -2.3396 -2.1163 -2.1163 -2.1153 -2.1153 2.3846 2.3846 2.3901 2.3901 2.9737 2.9737 3.0513 3.0513 3.2595 3.2595 3.2891 3.2891 4.1840 4.1840 4.2859 4.2859 4.4066 4.4066 4.4689 4.4689 4.7318 4.7318 4.7764 4.7764 4.8320 4.8320 4.8383 4.8383 4.8833 4.8833 4.8908 4.8908 5.1011 5.1011 5.1185 5.1185 5.3029 5.3029 5.3200 5.3200 5.4151 5.4151 5.4181 5.4181 5.5176 5.5176 5.5298 5.5298 5.6116 5.6116 5.6400 5.6400 5.6946 5.6946 5.7063 5.7063 5.8956 5.8956 5.9001 5.9001 6.0693 6.0693 6.0707 6.0707 6.9852 6.9852 7.0360 7.0360 7.3338 7.3338 7.3531 7.3531 8.0480 8.0480 8.1140 8.1140 8.9971 8.9971 9.0603 9.0603 9.4838 9.4838 9.4979 9.4979 9.8920 9.8920 9.8965 9.8965 11.8372 11.8372 11.8457 11.8457 12.2928 12.2928 k = 0.0441 0.5000 0.0441 ( 10232 PWs) bands (ev): -4.7164 -4.7164 -4.7162 -4.7162 -3.6380 -3.6380 -3.6375 -3.6375 -2.3376 -2.3376 -2.3369 -2.3369 -2.1151 -2.1151 -2.1143 -2.1143 2.3776 2.3776 2.3819 2.3819 2.9842 2.9842 3.0425 3.0425 3.2684 3.2684 3.2893 3.2893 4.2022 4.2022 4.2883 4.2883 4.4021 4.4021 4.4573 4.4573 4.7478 4.7478 4.7928 4.7928 4.8328 4.8328 4.8368 4.8368 4.8737 4.8737 4.8863 4.8863 5.0743 5.0743 5.0902 5.0902 5.3009 5.3009 5.3148 5.3148 5.4141 5.4141 5.4162 5.4162 5.5197 5.5197 5.5295 5.5295 5.6098 5.6098 5.6334 5.6334 5.6890 5.6890 5.6996 5.6996 5.8902 5.8902 5.8944 5.8944 6.0684 6.0684 6.0686 6.0686 6.9939 6.9939 7.0333 7.0333 7.3293 7.3293 7.3458 7.3458 8.0613 8.0613 8.1110 8.1110 9.0431 9.0431 9.0918 9.0918 9.4884 9.4884 9.4964 9.4964 9.8894 9.8894 9.8895 9.8895 11.8317 11.8317 11.8380 11.8380 12.3502 12.3502 k = 0.0294 0.5000 0.0294 ( 10236 PWs) bands (ev): -4.7213 -4.7213 -4.7212 -4.7212 -3.6318 -3.6318 -3.6314 -3.6314 -2.3355 -2.3355 -2.3351 -2.3351 -2.1142 -2.1142 -2.1137 -2.1137 2.3727 2.3727 2.3757 2.3757 2.9942 2.9942 3.0330 3.0330 3.2762 3.2762 3.2894 3.2894 4.2219 4.2219 4.2848 4.2848 4.4033 4.4033 4.4450 4.4450 4.7645 4.7645 4.8024 4.8024 4.8343 4.8343 4.8396 4.8396 4.8666 4.8666 4.8828 4.8828 5.0507 5.0507 5.0635 5.0635 5.3004 5.3004 5.3101 5.3101 5.4134 5.4134 5.4147 5.4147 5.5218 5.5218 5.5287 5.5287 5.6094 5.6094 5.6264 5.6264 5.6858 5.6858 5.6936 5.6936 5.8870 5.8870 5.8901 5.8901 6.0678 6.0678 6.0681 6.0681 7.0038 7.0038 7.0309 7.0309 7.3263 7.3263 7.3385 7.3385 8.0730 8.0730 8.1062 8.1062 9.0794 9.0794 9.1123 9.1123 9.4931 9.4931 9.4967 9.4967 9.8838 9.8838 9.8857 9.8857 11.8272 11.8272 11.8313 11.8313 12.3961 12.3961 k = 0.0147 0.5000 0.0147 ( 10250 PWs) bands (ev): -4.7242 -4.7242 -4.7242 -4.7242 -3.6279 -3.6279 -3.6278 -3.6278 -2.3343 -2.3343 -2.3341 -2.3341 -2.1136 -2.1136 -2.1134 -2.1134 2.3701 2.3701 2.3715 2.3715 3.0039 3.0039 3.0233 3.0233 3.2823 3.2823 3.2887 3.2887 4.2417 4.2417 4.2750 4.2750 4.4101 4.4101 4.4325 4.4325 4.7804 4.7804 4.8018 4.8018 4.8368 4.8368 4.8427 4.8427 4.8664 4.8664 4.8790 4.8790 5.0350 5.0350 5.0424 5.0424 5.3011 5.3011 5.3061 5.3061 5.4131 5.4131 5.4137 5.4137 5.5238 5.5238 5.5274 5.5274 5.6109 5.6109 5.6198 5.6198 5.6848 5.6848 5.6889 5.6889 5.8855 5.8855 5.8872 5.8872 6.0676 6.0676 6.0679 6.0679 7.0134 7.0134 7.0272 7.0272 7.3256 7.3256 7.3321 7.3321 8.0832 8.0832 8.0998 8.0998 9.1048 9.1048 9.1214 9.1214 9.4966 9.4966 9.4978 9.4978 9.8804 9.8804 9.8820 9.8820 11.8245 11.8245 11.8265 11.8265 12.4266 12.4266 k = 0.0000 0.5000-0.0000 ( 10274 PWs) bands (ev): -4.7252 -4.7252 -4.7252 -4.7252 -3.6266 -3.6266 -3.6266 -3.6266 -2.3338 -2.3338 -2.3338 -2.3338 -2.1134 -2.1134 -2.1134 -2.1134 2.3697 2.3697 2.3697 2.3697 3.0136 3.0136 3.0136 3.0136 3.2864 3.2864 3.2864 3.2864 4.2600 4.2600 4.2600 4.2600 4.4204 4.4204 4.4204 4.4204 4.7936 4.7936 4.7936 4.7936 4.8403 4.8403 4.8403 4.8403 4.8731 4.8731 4.8731 4.8731 5.0318 5.0318 5.0318 5.0318 5.3030 5.3030 5.3030 5.3030 5.4131 5.4131 5.4131 5.4131 5.5256 5.5256 5.5256 5.5256 5.6144 5.6144 5.6144 5.6144 5.6859 5.6859 5.6859 5.6859 5.8857 5.8857 5.8857 5.8857 6.0677 6.0677 6.0677 6.0677 7.0214 7.0214 7.0214 7.0214 7.3276 7.3276 7.3276 7.3276 8.0922 8.0922 8.0922 8.0922 9.1189 9.1189 9.1189 9.1189 9.4982 9.4982 9.4982 9.4982 9.8799 9.8799 9.8799 9.8799 11.8242 11.8242 11.8242 11.8242 12.4390 12.4390 k = 0.5000 0.5000-0.0000 ( 10280 PWs) bands (ev): -4.2189 -4.2189 -4.2189 -4.2189 -4.2168 -4.2168 -4.2168 -4.2168 -2.2682 -2.2682 -2.2682 -2.2682 -2.2640 -2.2640 -2.2640 -2.2640 2.5278 2.5278 2.5278 2.5278 2.5889 2.5889 2.5889 2.5889 3.8939 3.8939 3.8939 3.8939 3.9516 3.9516 3.9516 3.9516 4.7078 4.7078 4.7078 4.7078 4.7289 4.7289 4.7289 4.7289 5.0201 5.0201 5.0201 5.0201 5.0483 5.0483 5.0483 5.0483 5.2266 5.2266 5.2266 5.2266 5.2512 5.2512 5.2512 5.2512 5.4361 5.4361 5.4361 5.4361 5.4477 5.4477 5.4477 5.4477 5.6161 5.6161 5.6161 5.6161 5.6266 5.6266 5.6266 5.6266 6.2474 6.2474 6.2474 6.2474 6.2622 6.2622 6.2622 6.2622 7.4221 7.4221 7.4221 7.4221 7.5542 7.5542 7.5542 7.5542 7.7961 7.7961 7.7961 7.7961 7.8580 7.8580 7.8580 7.8580 9.5624 9.5624 9.5624 9.5624 9.6941 9.6941 9.6941 9.6941 11.5834 11.5834 11.5834 11.5834 11.6040 11.6040 k = 0.5000 0.5000 0.0208 ( 10236 PWs) bands (ev): -4.2183 -4.2183 -4.2183 -4.2183 -4.2164 -4.2164 -4.2161 -4.2161 -2.2696 -2.2696 -2.2695 -2.2695 -2.2656 -2.2656 -2.2651 -2.2651 2.5270 2.5270 2.5321 2.5321 2.5899 2.5899 2.5914 2.5914 3.8921 3.8921 3.8971 3.8971 3.9498 3.9498 3.9547 3.9547 4.7077 4.7077 4.7092 4.7092 4.7249 4.7249 4.7336 4.7336 5.0171 5.0171 5.0242 5.0242 5.0436 5.0436 5.0538 5.0538 5.2251 5.2251 5.2291 5.2291 5.2488 5.2488 5.2543 5.2543 5.4354 5.4354 5.4367 5.4367 5.4451 5.4451 5.4497 5.4497 5.6142 5.6142 5.6173 5.6173 5.6224 5.6224 5.6294 5.6294 6.2447 6.2447 6.2501 6.2501 6.2617 6.2617 6.2627 6.2627 7.4115 7.4115 7.4155 7.4155 7.5088 7.5088 7.5799 7.5799 7.7601 7.7601 7.8489 7.8489 7.8590 7.8590 7.8707 7.8707 9.5537 9.5537 9.5718 9.5718 9.6911 9.6911 9.6972 9.6972 11.5792 11.5792 11.5841 11.5841 11.6000 11.6000 k = 0.5000 0.5000 0.0417 ( 10236 PWs) bands (ev): -4.2167 -4.2167 -4.2167 -4.2167 -4.2149 -4.2149 -4.2144 -4.2144 -2.2738 -2.2738 -2.2736 -2.2736 -2.2700 -2.2700 -2.2690 -2.2690 2.5297 2.5297 2.5400 2.5400 2.5945 2.5945 2.5973 2.5973 3.8915 3.8915 3.9015 3.9015 3.9494 3.9494 3.9591 3.9591 4.7087 4.7087 4.7116 4.7116 4.7217 4.7217 4.7388 4.7388 5.0154 5.0154 5.0293 5.0293 5.0396 5.0396 5.0601 5.0601 5.2244 5.2244 5.2324 5.2324 5.2469 5.2469 5.2578 5.2578 5.4345 5.4345 5.4370 5.4370 5.4418 5.4418 5.4508 5.4508 5.6117 5.6117 5.6169 5.6169 5.6178 5.6178 5.6309 5.6309 6.2419 6.2419 6.2527 6.2527 6.2610 6.2610 6.2631 6.2631 7.3859 7.3859 7.3928 7.3928 7.4554 7.4554 7.5679 7.5679 7.7588 7.7588 7.8726 7.8726 7.8948 7.8948 7.9066 7.9066 9.5460 9.5460 9.5818 9.5818 9.6880 9.6880 9.7003 9.7003 11.5715 11.5715 11.5809 11.5809 11.5914 11.5914 k = 0.5000 0.5000 0.0625 ( 10228 PWs) bands (ev): -4.2140 -4.2140 -4.2140 -4.2140 -4.2123 -4.2123 -4.2115 -4.2115 -2.2807 -2.2807 -2.2803 -2.2803 -2.2771 -2.2771 -2.2756 -2.2756 2.5358 2.5358 2.5513 2.5513 2.6025 2.6025 2.6067 2.6067 3.8921 3.8921 3.9072 3.9072 3.9504 3.9504 3.9647 3.9647 4.7106 4.7106 4.7151 4.7151 4.7192 4.7192 4.7440 4.7440 5.0153 5.0153 5.0355 5.0355 5.0365 5.0365 5.0672 5.0672 5.2248 5.2248 5.2365 5.2365 5.2454 5.2454 5.2618 5.2618 5.4334 5.4334 5.4372 5.4372 5.4382 5.4382 5.4509 5.4509 5.6087 5.6087 5.6101 5.6101 5.6177 5.6177 5.6312 5.6312 6.2390 6.2390 6.2553 6.2553 6.2603 6.2603 6.2636 6.2636 7.3493 7.3493 7.3578 7.3578 7.3984 7.3984 7.5244 7.5244 7.7860 7.7860 7.8951 7.8951 7.9261 7.9261 7.9648 7.9648 9.5392 9.5392 9.5922 9.5922 9.6846 9.6846 9.7031 9.7031 11.5607 11.5607 11.5738 11.5738 11.5781 11.5781 k = 0.5000 0.5000 0.0833 ( 10236 PWs) bands (ev): -4.2102 -4.2102 -4.2102 -4.2102 -4.2086 -4.2086 -4.2076 -4.2076 -2.2901 -2.2901 -2.2897 -2.2897 -2.2868 -2.2868 -2.2848 -2.2848 2.5453 2.5453 2.5660 2.5660 2.6138 2.6138 2.6193 2.6193 3.8938 3.8938 3.9141 3.9141 3.9526 3.9526 3.9713 3.9713 4.7131 4.7131 4.7171 4.7171 4.7191 4.7191 4.7487 4.7487 5.0172 5.0172 5.0346 5.0346 5.0431 5.0431 5.0753 5.0753 5.2263 5.2263 5.2414 5.2414 5.2445 5.2445 5.2663 5.2663 5.4320 5.4320 5.4342 5.4342 5.4371 5.4371 5.4499 5.4499 5.6024 5.6024 5.6054 5.6054 5.6172 5.6172 5.6306 5.6306 6.2361 6.2361 6.2579 6.2579 6.2594 6.2594 6.2641 6.2641 7.3053 7.3053 7.3145 7.3145 7.3397 7.3397 7.4685 7.4685 7.8224 7.8224 7.9222 7.9222 7.9606 7.9606 8.0210 8.0210 9.5332 9.5332 9.6025 9.6025 9.6807 9.6807 9.7054 9.7054 11.5472 11.5472 11.5599 11.5599 11.5628 11.5628 k = 0.5000 0.5000 0.1042 ( 10232 PWs) bands (ev): -4.2054 -4.2054 -4.2054 -4.2054 -4.2040 -4.2040 -4.2027 -4.2027 -2.3019 -2.3019 -2.3014 -2.3014 -2.2988 -2.2988 -2.2964 -2.2964 2.5577 2.5577 2.5837 2.5837 2.6282 2.6282 2.6349 2.6349 3.8966 3.8966 3.9221 3.9221 3.9563 3.9563 3.9788 3.9788 4.7150 4.7150 4.7157 4.7157 4.7232 4.7232 4.7519 4.7519 5.0217 5.0217 5.0342 5.0342 5.0520 5.0520 5.0845 5.0845 5.2289 5.2289 5.2442 5.2442 5.2469 5.2469 5.2714 5.2714 5.4303 5.4303 5.4305 5.4305 5.4368 5.4368 5.4475 5.4475 5.5940 5.5940 5.6021 5.6021 5.6166 5.6166 5.6294 5.6294 6.2330 6.2330 6.2584 6.2584 6.2605 6.2605 6.2645 6.2645 7.2567 7.2567 7.2662 7.2662 7.2804 7.2804 7.4087 7.4087 7.8593 7.8593 7.9506 7.9506 7.9952 7.9952 8.0740 8.0740 9.5280 9.5280 9.6120 9.6120 9.6757 9.6757 9.7064 9.7064 11.5318 11.5318 11.5370 11.5370 11.5485 11.5485 k = 0.5000 0.5000 0.1250 ( 10252 PWs) bands (ev): -4.1997 -4.1997 -4.1997 -4.1997 -4.1984 -4.1984 -4.1968 -4.1968 -2.3159 -2.3159 -2.3154 -2.3154 -2.3131 -2.3131 -2.3102 -2.3102 2.5730 2.5730 2.6043 2.6043 2.6456 2.6456 2.6533 2.6533 3.9004 3.9004 3.9312 3.9312 3.9611 3.9611 3.9872 3.9872 4.7125 4.7125 4.7179 4.7179 4.7266 4.7266 4.7529 4.7529 5.0294 5.0294 5.0360 5.0360 5.0627 5.0627 5.0952 5.0952 5.2328 5.2328 5.2446 5.2446 5.2529 5.2529 5.2770 5.2770 5.4266 5.4266 5.4288 5.4288 5.4362 5.4362 5.4439 5.4439 5.5855 5.5855 5.5993 5.5993 5.6161 5.6161 5.6278 5.6278 6.2298 6.2298 6.2571 6.2571 6.2629 6.2629 6.2651 6.2651 7.2053 7.2053 7.2151 7.2151 7.2211 7.2211 7.3480 7.3480 7.8935 7.8935 7.9778 7.9778 8.0277 8.0277 8.1225 8.1225 9.5230 9.5230 9.6200 9.6200 9.6691 9.6691 9.7056 9.7056 11.5101 11.5101 11.5156 11.5156 11.5320 11.5320 k = 0.5000 0.5000 0.1458 ( 10252 PWs) bands (ev): -4.1931 -4.1931 -4.1930 -4.1930 -4.1919 -4.1919 -4.1901 -4.1901 -2.3319 -2.3319 -2.3313 -2.3313 -2.3293 -2.3293 -2.3260 -2.3260 2.5908 2.5908 2.6276 2.6276 2.6655 2.6655 2.6742 2.6742 3.9050 3.9050 3.9413 3.9413 3.9672 3.9672 3.9962 3.9962 4.7091 4.7091 4.7193 4.7193 4.7284 4.7284 4.7508 4.7508 5.0406 5.0406 5.0408 5.0408 5.0753 5.0753 5.1074 5.1074 5.2380 5.2380 5.2456 5.2456 5.2594 5.2594 5.2831 5.2831 5.4237 5.4237 5.4271 5.4271 5.4355 5.4355 5.4389 5.4389 5.5774 5.5774 5.5973 5.5973 5.6163 5.6163 5.6263 5.6263 6.2265 6.2265 6.2557 6.2557 6.2653 6.2653 6.2656 6.2656 7.1524 7.1524 7.1625 7.1625 7.1629 7.1629 7.2877 7.2877 7.9237 7.9237 8.0022 8.0022 8.0565 8.0565 8.1657 8.1657 9.5180 9.5180 9.6254 9.6254 9.6602 9.6602 9.7019 9.7019 11.4805 11.4805 11.5001 11.5001 11.5150 11.5150 k = 0.5000 0.5000 0.1667 ( 10248 PWs) bands (ev): -4.1857 -4.1857 -4.1856 -4.1856 -4.1846 -4.1846 -4.1825 -4.1825 -2.3496 -2.3496 -2.3489 -2.3489 -2.3472 -2.3472 -2.3435 -2.3435 2.6107 2.6107 2.6530 2.6530 2.6878 2.6878 2.6971 2.6971 3.9103 3.9103 3.9522 3.9522 3.9744 3.9744 4.0057 4.0057 4.7042 4.7042 4.7190 4.7190 4.7275 4.7275 4.7450 4.7450 5.0489 5.0489 5.0560 5.0560 5.0898 5.0898 5.1215 5.1215 5.2449 5.2449 5.2474 5.2474 5.2662 5.2662 5.2896 5.2896 5.4218 5.4218 5.4253 5.4253 5.4328 5.4328 5.4346 5.4346 5.5704 5.5704 5.5963 5.5963 5.6173 5.6173 5.6253 5.6253 6.2230 6.2230 6.2539 6.2539 6.2663 6.2663 6.2675 6.2675 7.0988 7.0988 7.1047 7.1047 7.1104 7.1104 7.2283 7.2283 7.9491 7.9491 8.0228 8.0228 8.0806 8.0806 8.2029 8.2029 9.5121 9.5121 9.6270 9.6270 9.6480 9.6480 9.6942 9.6942 11.4502 11.4502 11.4873 11.4873 11.4999 11.4999 k = 0.5000 0.5000 0.1875 ( 10248 PWs) bands (ev): -4.1776 -4.1776 -4.1775 -4.1775 -4.1766 -4.1766 -4.1742 -4.1742 -2.3687 -2.3687 -2.3680 -2.3680 -2.3666 -2.3666 -2.3625 -2.3625 2.6325 2.6325 2.6804 2.6804 2.7120 2.7120 2.7218 2.7218 3.9164 3.9164 3.9639 3.9639 3.9826 3.9826 4.0156 4.0156 4.6974 4.6974 4.7166 4.7166 4.7231 4.7231 4.7351 4.7351 5.0612 5.0612 5.0747 5.0747 5.1062 5.1062 5.1374 5.1374 5.2500 5.2500 5.2537 5.2537 5.2730 5.2730 5.2964 5.2964 5.4216 5.4216 5.4237 5.4237 5.4256 5.4256 5.4338 5.4338 5.5650 5.5650 5.5967 5.5967 5.6198 5.6198 5.6252 5.6252 6.2192 6.2192 6.2519 6.2519 6.2669 6.2669 6.2696 6.2696 7.0449 7.0449 7.0483 7.0483 7.0583 7.0583 7.1701 7.1701 7.9695 7.9695 8.0390 8.0390 8.0990 8.0990 8.2335 8.2335 9.5044 9.5044 9.6238 9.6238 9.6319 9.6319 9.6816 9.6816 11.4215 11.4215 11.4795 11.4795 11.4893 11.4893 k = 0.5000 0.5000 0.2083 ( 10232 PWs) bands (ev): -4.1689 -4.1689 -4.1688 -4.1688 -4.1680 -4.1680 -4.1654 -4.1654 -2.3889 -2.3889 -2.3882 -2.3882 -2.3870 -2.3870 -2.3826 -2.3826 2.6556 2.6556 2.7093 2.7093 2.7378 2.7378 2.7478 2.7478 3.9230 3.9230 3.9762 3.9762 3.9919 3.9919 4.0258 4.0258 4.6883 4.6883 4.7116 4.7116 4.7147 4.7147 4.7214 4.7214 5.0777 5.0777 5.0961 5.0961 5.1241 5.1241 5.1550 5.1550 5.2537 5.2537 5.2649 5.2649 5.2798 5.2798 5.3032 5.3032 5.4179 5.4179 5.4225 5.4225 5.4234 5.4234 5.4333 5.4333 5.5621 5.5621 5.5986 5.5986 5.6244 5.6244 5.6262 5.6262 6.2153 6.2153 6.2495 6.2495 6.2677 6.2677 6.2714 6.2714 6.9912 6.9912 6.9934 6.9934 7.0073 7.0073 7.1133 7.1133 7.9848 7.9848 8.0503 8.0503 8.1115 8.1115 8.2573 8.2573 9.4942 9.4942 9.6113 9.6113 9.6146 9.6146 9.6632 9.6632 11.3973 11.3973 11.4787 11.4787 11.4857 11.4857 k = 0.5000 0.5000 0.2292 ( 10240 PWs) bands (ev): -4.1597 -4.1597 -4.1596 -4.1596 -4.1589 -4.1589 -4.1561 -4.1561 -2.4099 -2.4099 -2.4092 -2.4092 -2.4082 -2.4082 -2.4035 -2.4035 2.6798 2.6798 2.7393 2.7393 2.7647 2.7647 2.7748 2.7748 3.9301 3.9301 3.9892 3.9892 4.0021 4.0021 4.0361 4.0361 4.6765 4.6765 4.7019 4.7019 4.7034 4.7034 4.7041 4.7041 5.0980 5.0980 5.1191 5.1191 5.1425 5.1425 5.1739 5.1739 5.2586 5.2586 5.2790 5.2790 5.2865 5.2865 5.3099 5.3099 5.4099 5.4099 5.4217 5.4217 5.4276 5.4276 5.4334 5.4334 5.5622 5.5622 5.6021 5.6021 5.6287 5.6287 5.6316 5.6316 6.2111 6.2111 6.2467 6.2467 6.2685 6.2685 6.2728 6.2728 6.9378 6.9378 6.9402 6.9402 6.9574 6.9574 7.0579 7.0579 7.9951 7.9951 8.0566 8.0566 8.1177 8.1177 8.2742 8.2742 9.4804 9.4804 9.5860 9.5860 9.5988 9.5988 9.6385 9.6385 11.3798 11.3798 11.4868 11.4868 11.4914 11.4914 k = 0.5000 0.5000 0.2500 ( 10224 PWs) bands (ev): -4.1502 -4.1502 -4.1501 -4.1501 -4.1495 -4.1495 -4.1464 -4.1464 -2.4313 -2.4313 -2.4306 -2.4306 -2.4298 -2.4298 -2.4248 -2.4248 2.7045 2.7045 2.7700 2.7700 2.7924 2.7924 2.8022 2.8022 3.9376 3.9376 4.0026 4.0026 4.0131 4.0131 4.0465 4.0465 4.6620 4.6620 4.6836 4.6836 4.6852 4.6852 4.6922 4.6922 5.1208 5.1208 5.1422 5.1422 5.1604 5.1604 5.1933 5.1933 5.2652 5.2652 5.2931 5.2931 5.2965 5.2965 5.3163 5.3163 5.4021 5.4021 5.4217 5.4217 5.4342 5.4342 5.4345 5.4345 5.5661 5.5661 5.6075 5.6075 5.6331 5.6331 5.6427 5.6427 6.2068 6.2068 6.2434 6.2434 6.2693 6.2693 6.2738 6.2738 6.8848 6.8848 6.8891 6.8891 6.9091 6.9091 7.0040 7.0040 8.0008 8.0008 8.0580 8.0580 8.1177 8.1177 8.2844 8.2844 9.4626 9.4626 9.5563 9.5563 9.5763 9.5763 9.6079 9.6079 11.3713 11.3713 11.5049 11.5049 11.5076 11.5076 k = 0.5000 0.5000 0.2708 ( 10232 PWs) bands (ev): -4.1405 -4.1405 -4.1404 -4.1404 -4.1398 -4.1398 -4.1365 -4.1365 -2.4527 -2.4527 -2.4521 -2.4521 -2.4515 -2.4515 -2.4462 -2.4462 2.7294 2.7294 2.8009 2.8009 2.8204 2.8204 2.8298 2.8298 3.9455 3.9455 4.0165 4.0165 4.0250 4.0250 4.0570 4.0570 4.6450 4.6450 4.6606 4.6606 4.6649 4.6649 4.6778 4.6778 5.1444 5.1444 5.1638 5.1638 5.1767 5.1767 5.2123 5.2123 5.2738 5.2738 5.2997 5.2997 5.3176 5.3176 5.3223 5.3223 5.3950 5.3950 5.4228 5.4228 5.4367 5.4367 5.4429 5.4429 5.5745 5.5745 5.6152 5.6152 5.6396 5.6396 5.6586 5.6586 6.2022 6.2022 6.2395 6.2395 6.2702 6.2702 6.2740 6.2740 6.8323 6.8323 6.8402 6.8402 6.8626 6.8626 6.9515 6.9515 8.0021 8.0021 8.0548 8.0548 8.1117 8.1117 8.2883 8.2883 9.4407 9.4407 9.5228 9.5228 9.5477 9.5477 9.5719 9.5719 11.3728 11.3728 11.5335 11.5335 11.5349 11.5349 k = 0.5000 0.5000 0.2917 ( 10208 PWs) bands (ev): -4.1307 -4.1307 -4.1306 -4.1306 -4.1302 -4.1302 -4.1266 -4.1266 -2.4739 -2.4739 -2.4733 -2.4733 -2.4729 -2.4729 -2.4674 -2.4674 2.7539 2.7539 2.8315 2.8315 2.8482 2.8482 2.8569 2.8569 3.9536 3.9536 4.0307 4.0307 4.0375 4.0375 4.0675 4.0675 4.6256 4.6256 4.6356 4.6356 4.6419 4.6419 4.6606 4.6606 5.1667 5.1667 5.1827 5.1827 5.1906 5.1906 5.2297 5.2297 5.2852 5.2852 5.3069 5.3069 5.3282 5.3282 5.3415 5.3415 5.3896 5.3896 5.4255 5.4255 5.4400 5.4400 5.4530 5.4530 5.5882 5.5882 5.6255 5.6255 5.6488 5.6488 5.6806 5.6806 6.1974 6.1974 6.2349 6.2349 6.2710 6.2710 6.2733 6.2733 6.7803 6.7803 6.7938 6.7938 6.8179 6.8179 6.9004 6.9004 7.9997 7.9997 8.0474 8.0474 8.1001 8.1001 8.2863 8.2863 9.4151 9.4151 9.4867 9.4867 9.5141 9.5141 9.5319 9.5319 11.3847 11.3847 11.5722 11.5722 11.5730 11.5730 k = 0.5000 0.5000 0.3125 ( 10208 PWs) bands (ev): -4.1211 -4.1211 -4.1210 -4.1210 -4.1207 -4.1207 -4.1169 -4.1169 -2.4944 -2.4944 -2.4940 -2.4940 -2.4936 -2.4936 -2.4879 -2.4879 2.7778 2.7778 2.8614 2.8614 2.8753 2.8753 2.8832 2.8832 3.9620 3.9620 4.0453 4.0453 4.0507 4.0507 4.0779 4.0779 4.6042 4.6042 4.6094 4.6094 4.6167 4.6167 4.6410 4.6410 5.1856 5.1856 5.1981 5.1981 5.2019 5.2019 5.2444 5.2444 5.2992 5.2992 5.3147 5.3147 5.3343 5.3343 5.3636 5.3636 5.3890 5.3890 5.4303 5.4303 5.4441 5.4441 5.4634 5.4634 5.6075 5.6075 5.6391 5.6391 5.6612 5.6612 5.7096 5.7096 6.1924 6.1924 6.2295 6.2295 6.2713 6.2713 6.2719 6.2719 6.7285 6.7285 6.7502 6.7502 6.7753 6.7753 6.8506 6.8506 7.9940 7.9940 8.0362 8.0362 8.0837 8.0837 8.2793 8.2793 9.3867 9.3867 9.4494 9.4494 9.4770 9.4770 9.4896 9.4896 11.4064 11.4064 11.6200 11.6200 11.6206 11.6206 k = 0.5000 0.5000 0.3333 ( 10216 PWs) bands (ev): -4.1118 -4.1118 -4.1118 -4.1118 -4.1115 -4.1115 -4.1075 -4.1075 -2.5140 -2.5140 -2.5136 -2.5136 -2.5133 -2.5133 -2.5074 -2.5074 2.8005 2.8005 2.8900 2.8900 2.9014 2.9014 2.9083 2.9083 3.9706 3.9706 4.0601 4.0601 4.0644 4.0644 4.0884 4.0884 4.5813 4.5813 4.5825 4.5825 4.5903 4.5903 4.6196 4.6196 5.2001 5.2001 5.2096 5.2096 5.2108 5.2108 5.2556 5.2556 5.3146 5.3146 5.3230 5.3230 5.3408 5.3408 5.3708 5.3708 5.4049 5.4049 5.4377 5.4377 5.4485 5.4485 5.4731 5.4731 5.6324 5.6324 5.6567 5.6567 5.6771 5.6771 5.7461 5.7461 6.1872 6.1872 6.2231 6.2231 6.2677 6.2677 6.2726 6.2726 6.6769 6.6769 6.7100 6.7100 6.7351 6.7351 6.8024 6.8024 7.9857 7.9857 8.0221 8.0221 8.0633 8.0633 8.2680 8.2680 9.3568 9.3568 9.4123 9.4123 9.4383 9.4383 9.4467 9.4467 11.4365 11.4365 11.6753 11.6753 11.6761 11.6761 k = 0.5000 0.5000 0.3542 ( 10216 PWs) bands (ev): -4.1031 -4.1031 -4.1030 -4.1030 -4.1028 -4.1028 -4.0986 -4.0986 -2.5322 -2.5322 -2.5319 -2.5319 -2.5317 -2.5317 -2.5256 -2.5256 2.8216 2.8216 2.9169 2.9169 2.9259 2.9259 2.9316 2.9316 3.9792 3.9792 4.0750 4.0750 4.0785 4.0785 4.0987 4.0987 4.5558 4.5558 4.5576 4.5576 4.5635 4.5635 4.5970 4.5970 5.2106 5.2106 5.2176 5.2176 5.2178 5.2178 5.2635 5.2635 5.3293 5.3293 5.3315 5.3315 5.3478 5.3478 5.3697 5.3697 5.4286 5.4286 5.4478 5.4478 5.4529 5.4529 5.4816 5.4816 5.6622 5.6622 5.6789 5.6789 5.6971 5.6971 5.7895 5.7895 6.1819 6.1819 6.2156 6.2156 6.2621 6.2621 6.2730 6.2730 6.6254 6.6254 6.6734 6.6734 6.6974 6.6974 6.7559 6.7559 7.9756 7.9756 8.0058 8.0058 8.0401 8.0401 8.2535 8.2535 9.3268 9.3268 9.3768 9.3768 9.3997 9.3997 9.4050 9.4050 11.4730 11.4730 11.7362 11.7362 11.7371 11.7371 k = 0.5000 0.5000 0.3750 ( 10200 PWs) bands (ev): -4.0950 -4.0950 -4.0950 -4.0950 -4.0948 -4.0948 -4.0905 -4.0905 -2.5487 -2.5487 -2.5485 -2.5485 -2.5483 -2.5483 -2.5422 -2.5422 2.8408 2.8408 2.9415 2.9415 2.9483 2.9483 2.9529 2.9529 3.9876 3.9876 4.0899 4.0899 4.0927 4.0927 4.1090 4.1090 4.5301 4.5301 4.5337 4.5337 4.5371 4.5371 4.5741 4.5741 5.2181 5.2181 5.2227 5.2227 5.2235 5.2235 5.2685 5.2685 5.3398 5.3398 5.3414 5.3414 5.3549 5.3549 5.3679 5.3679 5.4508 5.4508 5.4570 5.4570 5.4599 5.4599 5.4887 5.4887 5.6956 5.6956 5.7056 5.7056 5.7211 5.7211 5.8390 5.8390 6.1764 6.1764 6.2068 6.2068 6.2541 6.2541 6.2732 6.2732 6.5740 6.5740 6.6413 6.6413 6.6629 6.6629 6.7115 6.7115 7.9645 7.9645 7.9883 7.9883 8.0154 8.0154 8.2370 8.2370 9.2980 9.2980 9.3442 9.3442 9.3630 9.3630 9.3660 9.3660 11.5133 11.5133 11.7999 11.7999 11.8011 11.8011 k = 0.5000 0.5000 0.3958 ( 10192 PWs) bands (ev): -4.0878 -4.0878 -4.0878 -4.0878 -4.0876 -4.0876 -4.0832 -4.0832 -2.5633 -2.5633 -2.5631 -2.5631 -2.5630 -2.5630 -2.5568 -2.5568 2.8578 2.8578 2.9633 2.9633 2.9682 2.9682 2.9716 2.9716 3.9958 3.9958 4.1044 4.1044 4.1066 4.1066 4.1188 4.1188 4.5062 4.5062 4.5105 4.5105 4.5121 4.5121 4.5517 4.5517 5.2234 5.2234 5.2264 5.2264 5.2272 5.2272 5.2714 5.2714 5.3472 5.3472 5.3504 5.3504 5.3616 5.3616 5.3666 5.3666 5.4608 5.4608 5.4693 5.4693 5.4727 5.4727 5.4945 5.4945 5.7310 5.7310 5.7360 5.7360 5.7483 5.7483 5.8931 5.8931 6.1708 6.1708 6.1966 6.1966 6.2435 6.2435 6.2726 6.2726 6.5225 6.5225 6.6138 6.6138 6.6318 6.6318 6.6700 6.6700 7.9531 7.9531 7.9707 7.9707 7.9908 7.9908 8.2197 8.2197 9.2719 9.2719 9.3153 9.3153 9.3296 9.3296 9.3312 9.3312 11.5546 11.5546 11.8638 11.8638 11.8650 11.8650 k = 0.5000 0.5000 0.4167 ( 10184 PWs) bands (ev): -4.0816 -4.0816 -4.0816 -4.0816 -4.0815 -4.0815 -4.0769 -4.0769 -2.5757 -2.5757 -2.5755 -2.5755 -2.5755 -2.5755 -2.5691 -2.5691 2.8721 2.8721 2.9820 2.9820 2.9852 2.9852 2.9875 2.9875 4.0033 4.0033 4.1180 4.1180 4.1197 4.1197 4.1281 4.1281 4.4848 4.4848 4.4889 4.4889 4.4893 4.4893 4.5309 4.5309 5.2271 5.2271 5.2291 5.2291 5.2296 5.2296 5.2730 5.2730 5.3536 5.3536 5.3566 5.3566 5.3659 5.3659 5.3673 5.3673 5.4640 5.4640 5.4837 5.4837 5.4844 5.4844 5.4991 5.4991 5.7662 5.7662 5.7681 5.7681 5.7772 5.7772 5.9503 5.9503 6.1652 6.1652 6.1852 6.1852 6.2308 6.2308 6.2707 6.2707 6.4717 6.4717 6.5916 6.5916 6.6050 6.6050 6.6324 6.6324 7.9423 7.9423 7.9542 7.9542 7.9677 7.9677 8.2031 8.2031 9.2493 9.2493 9.2910 9.2910 9.3008 9.3008 9.3015 9.3015 11.5940 11.5940 11.9243 11.9243 11.9254 11.9254 k = 0.5000 0.5000 0.4375 ( 10152 PWs) bands (ev): -4.0767 -4.0767 -4.0767 -4.0767 -4.0766 -4.0766 -4.0719 -4.0719 -2.5855 -2.5855 -2.5854 -2.5854 -2.5854 -2.5854 -2.5790 -2.5790 2.8836 2.8836 2.9970 2.9970 2.9989 2.9989 3.0002 3.0002 4.0098 4.0098 4.1302 4.1302 4.1313 4.1313 4.1363 4.1363 4.4670 4.4670 4.4700 4.4700 4.4700 4.4700 4.5129 4.5129 5.2298 5.2298 5.2309 5.2309 5.2312 5.2312 5.2739 5.2739 5.3588 5.3588 5.3609 5.3609 5.3656 5.3656 5.3720 5.3720 5.4667 5.4667 5.4942 5.4942 5.4943 5.4943 5.5026 5.5026 5.7989 5.7989 5.7993 5.7993 5.8051 5.8051 6.0089 6.0089 6.1599 6.1599 6.1733 6.1733 6.2168 6.2168 6.2660 6.2660 6.4231 6.4231 6.5746 6.5746 6.5832 6.5832 6.6002 6.6002 7.9330 7.9330 7.9400 7.9400 7.9479 7.9479 8.1884 8.1884 9.2311 9.2311 9.2716 9.2716 9.2775 9.2775 9.2777 9.2777 11.6287 11.6287 11.9776 11.9776 11.9784 11.9784 k = 0.5000 0.5000 0.4583 ( 10124 PWs) bands (ev): -4.0730 -4.0730 -4.0730 -4.0730 -4.0730 -4.0730 -4.0682 -4.0682 -2.5927 -2.5927 -2.5927 -2.5927 -2.5927 -2.5927 -2.5862 -2.5862 2.8919 2.8919 3.0080 3.0080 3.0089 3.0089 3.0095 3.0095 4.0148 4.0148 4.1400 4.1400 4.1405 4.1405 4.1429 4.1429 4.4536 4.4536 4.4551 4.4551 4.4552 4.4552 4.4987 4.4987 5.2316 5.2316 5.2320 5.2320 5.2322 5.2322 5.2743 5.2743 5.3625 5.3625 5.3635 5.3635 5.3655 5.3655 5.3754 5.3754 5.4687 5.4687 5.5013 5.5013 5.5015 5.5015 5.5050 5.5050 5.8259 5.8259 5.8260 5.8260 5.8289 5.8289 6.0668 6.0668 6.1552 6.1552 6.1620 6.1620 6.2036 6.2036 6.2552 6.2552 6.3809 6.3809 6.5628 6.5628 6.5670 6.5670 6.5751 6.5751 7.9257 7.9257 7.9290 7.9290 7.9326 7.9326 8.1770 8.1770 9.2177 9.2177 9.2577 9.2577 9.2603 9.2603 9.2604 9.2604 11.6557 11.6557 12.0198 12.0198 12.0203 12.0203 k = 0.5000 0.5000 0.4792 ( 10144 PWs) bands (ev): -4.0708 -4.0708 -4.0708 -4.0708 -4.0708 -4.0708 -4.0660 -4.0660 -2.5971 -2.5971 -2.5971 -2.5971 -2.5971 -2.5971 -2.5906 -2.5906 2.8970 2.8970 3.0147 3.0147 3.0149 3.0149 3.0151 3.0151 4.0181 4.0181 4.1464 4.1464 4.1466 4.1466 4.1472 4.1472 4.4452 4.4452 4.4456 4.4456 4.4456 4.4456 4.4896 4.4896 5.2325 5.2325 5.2326 5.2326 5.2327 5.2327 5.2745 5.2745 5.3647 5.3647 5.3650 5.3650 5.3654 5.3654 5.3773 5.3773 5.4700 5.4700 5.5055 5.5055 5.5056 5.5056 5.5064 5.5064 5.8443 5.8443 5.8443 5.8443 5.8451 5.8451 6.1201 6.1201 6.1518 6.1518 6.1537 6.1537 6.1938 6.1938 6.2336 6.2336 6.3525 6.3525 6.5559 6.5559 6.5570 6.5570 6.5591 6.5591 7.9211 7.9211 7.9220 7.9220 7.9229 7.9229 8.1697 8.1697 9.2096 9.2096 9.2492 9.2492 9.2499 9.2499 9.2499 9.2499 11.6729 11.6729 12.0471 12.0471 12.0472 12.0472 k = 0.5000 0.5000 0.5000 ( 10144 PWs) bands (ev): -4.0701 -4.0701 -4.0701 -4.0701 -4.0701 -4.0701 -4.0652 -4.0652 -2.5985 -2.5985 -2.5985 -2.5985 -2.5985 -2.5985 -2.5920 -2.5920 2.8987 2.8987 3.0170 3.0170 3.0170 3.0170 3.0170 3.0170 4.0192 4.0192 4.1487 4.1487 4.1487 4.1487 4.1487 4.1487 4.4423 4.4423 4.4423 4.4423 4.4423 4.4423 4.4865 4.4865 5.2328 5.2328 5.2328 5.2328 5.2328 5.2328 5.2745 5.2745 5.3655 5.3655 5.3655 5.3655 5.3655 5.3655 5.3780 5.3780 5.4704 5.4704 5.5069 5.5069 5.5069 5.5069 5.5069 5.5069 5.8509 5.8509 5.8509 5.8509 5.8509 5.8509 6.1505 6.1505 6.1505 6.1505 6.1505 6.1505 6.1901 6.1901 6.2138 6.2138 6.3431 6.3431 6.5536 6.5536 6.5536 6.5536 6.5536 6.5536 7.9196 7.9196 7.9196 7.9196 7.9196 7.9196 8.1672 8.1672 9.2068 9.2068 9.2464 9.2464 9.2464 9.2464 9.2464 9.2464 11.6788 11.6788 12.0565 12.0565 12.0565 12.0565 Writing output data file CuTe2.save init_run : 0.75s CPU 0.84s WALL ( 1 calls) electrons : 410.53s CPU 414.42s 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 : 410.52s CPU 414.40s 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 : 0.14s CPU 0.15s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.11s WALL ( 188 calls) cegterg : 376.54s CPU 379.75s WALL ( 219 calls) Called by sum_band: Called by *egterg: h_psi : 198.12s CPU 201.55s WALL ( 4126 calls) s_psi : 26.39s CPU 26.26s WALL ( 4126 calls) g_psi : 0.37s CPU 0.36s WALL ( 3719 calls) cdiaghg : 135.47s CPU 135.87s WALL ( 3907 calls) cegterg:over : 19.39s CPU 19.60s WALL ( 3719 calls) cegterg:upda : 13.20s CPU 13.18s WALL ( 3719 calls) cegterg:last : 7.35s CPU 7.37s WALL ( 595 calls) cdiaghg:chol : 6.37s CPU 6.47s WALL ( 3907 calls) cdiaghg:inve : 5.04s CPU 5.09s WALL ( 3907 calls) cdiaghg:para : 10.12s CPU 10.16s WALL ( 7814 calls) Called by h_psi: h_psi:vloc : 153.97s CPU 157.20s WALL ( 4126 calls) h_psi:vnl : 43.79s CPU 44.00s WALL ( 4126 calls) add_vuspsi : 23.91s CPU 24.01s WALL ( 4126 calls) General routines calbec : 19.84s CPU 19.98s WALL ( 4126 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 147.99s CPU 151.29s WALL ( 922208 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.22s CPU 0.27s WALL ( 376 calls) Parallel routines fft_scatter : 98.68s CPU 100.83s WALL ( 922231 calls) PWSCF : 7m35.89s CPU 7m53.54s WALL This run was terminated on: 16:58:35 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=