Program PWSCF v.5.1.1 starts on 19Jul2015 at 13: 4:27 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./FeS2.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 41 32 9 1385 929 147 Max 42 33 10 1388 946 152 Sum 1993 1541 437 66539 45145 7123 bravais-lattice index = 14 lattice parameter (alat) = 10.2383 a.u. unit-cell volume = 1073.2217 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.238346 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 S read from file: /home/autes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 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 1151 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 Fe read from file: /home/autes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 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 S 6.00 32.06500 S( 1.00) Fe 8.00 55.84500 Fe( 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: E 1 3C2 -3C2 2 -2 3 -3 4 -4 4C3' 5 7 8 6 4C3 9 12 10 11 i 13 3s_h-3s_h 14 -14 15 -15 16 -16 4S6 17 19 20 18 4S6' 21 24 22 23 -E -1 -4C3' -5 -7 -8 -6 -4C3 -9 -12 -10 -11 -i -13 -4S6 -17 -19 -20 -18 -4S6' -21 -24 -22 -23 Cartesian axes number of k points= 228 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 2) = ( 0.0000000 0.0172414 -0.0000000), wk = 0.0043860 k( 3) = ( 0.0000000 0.0344828 -0.0000000), wk = 0.0043860 k( 4) = ( 0.0000000 0.0517241 -0.0000000), wk = 0.0043860 k( 5) = ( 0.0000000 0.0689655 -0.0000000), wk = 0.0043860 k( 6) = ( 0.0000000 0.0862069 -0.0000000), wk = 0.0043860 k( 7) = ( 0.0000000 0.1034483 -0.0000000), wk = 0.0043860 k( 8) = ( 0.0000000 0.1206897 -0.0000000), wk = 0.0043860 k( 9) = ( 0.0000000 0.1379310 -0.0000000), wk = 0.0043860 k( 10) = ( 0.0000000 0.1551724 -0.0000000), wk = 0.0043860 k( 11) = ( 0.0000000 0.1724138 -0.0000000), wk = 0.0043860 k( 12) = ( 0.0000000 0.1896552 -0.0000000), wk = 0.0043860 k( 13) = ( 0.0000000 0.2068966 -0.0000000), wk = 0.0043860 k( 14) = ( 0.0000000 0.2241379 -0.0000000), wk = 0.0043860 k( 15) = ( 0.0000000 0.2413793 -0.0000000), wk = 0.0043860 k( 16) = ( 0.0000000 0.2586207 -0.0000000), wk = 0.0043860 k( 17) = ( 0.0000000 0.2758621 -0.0000000), wk = 0.0043860 k( 18) = ( 0.0000000 0.2931034 -0.0000000), wk = 0.0043860 k( 19) = ( 0.0000000 0.3103448 -0.0000000), wk = 0.0043860 k( 20) = ( 0.0000000 0.3275862 -0.0000000), wk = 0.0043860 k( 21) = ( 0.0000000 0.3448276 -0.0000000), wk = 0.0043860 k( 22) = ( 0.0000000 0.3620690 -0.0000000), wk = 0.0043860 k( 23) = ( 0.0000000 0.3793103 -0.0000000), wk = 0.0043860 k( 24) = ( 0.0000000 0.3965517 -0.0000000), wk = 0.0043860 k( 25) = ( 0.0000000 0.4137931 -0.0000000), wk = 0.0043860 k( 26) = ( 0.0000000 0.4310345 -0.0000000), wk = 0.0043860 k( 27) = ( 0.0000000 0.4482759 -0.0000000), wk = 0.0043860 k( 28) = ( 0.0000000 0.4655172 -0.0000000), wk = 0.0043860 k( 29) = ( 0.0000000 0.4827586 -0.0000000), wk = 0.0043860 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043860 k( 31) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043860 k( 32) = ( 0.0172414 0.5000000 -0.0000000), wk = 0.0043860 k( 33) = ( 0.0344828 0.5000000 -0.0000000), wk = 0.0043860 k( 34) = ( 0.0517241 0.5000000 -0.0000000), wk = 0.0043860 k( 35) = ( 0.0689655 0.5000000 -0.0000000), wk = 0.0043860 k( 36) = ( 0.0862069 0.5000000 -0.0000000), wk = 0.0043860 k( 37) = ( 0.1034483 0.5000000 -0.0000000), wk = 0.0043860 k( 38) = ( 0.1206897 0.5000000 -0.0000000), wk = 0.0043860 k( 39) = ( 0.1379310 0.5000000 -0.0000000), wk = 0.0043860 k( 40) = ( 0.1551724 0.5000000 -0.0000000), wk = 0.0043860 k( 41) = ( 0.1724138 0.5000000 -0.0000000), wk = 0.0043860 k( 42) = ( 0.1896552 0.5000000 -0.0000000), wk = 0.0043860 k( 43) = ( 0.2068966 0.5000000 -0.0000000), wk = 0.0043860 k( 44) = ( 0.2241379 0.5000000 -0.0000000), wk = 0.0043860 k( 45) = ( 0.2413793 0.5000000 -0.0000000), wk = 0.0043860 k( 46) = ( 0.2586207 0.5000000 -0.0000000), wk = 0.0043860 k( 47) = ( 0.2758621 0.5000000 -0.0000000), wk = 0.0043860 k( 48) = ( 0.2931034 0.5000000 -0.0000000), wk = 0.0043860 k( 49) = ( 0.3103448 0.5000000 -0.0000000), wk = 0.0043860 k( 50) = ( 0.3275862 0.5000000 -0.0000000), wk = 0.0043860 k( 51) = ( 0.3448276 0.5000000 -0.0000000), wk = 0.0043860 k( 52) = ( 0.3620690 0.5000000 -0.0000000), wk = 0.0043860 k( 53) = ( 0.3793103 0.5000000 -0.0000000), wk = 0.0043860 k( 54) = ( 0.3965517 0.5000000 -0.0000000), wk = 0.0043860 k( 55) = ( 0.4137931 0.5000000 -0.0000000), wk = 0.0043860 k( 56) = ( 0.4310345 0.5000000 -0.0000000), wk = 0.0043860 k( 57) = ( 0.4482759 0.5000000 -0.0000000), wk = 0.0043860 k( 58) = ( 0.4655172 0.5000000 -0.0000000), wk = 0.0043860 k( 59) = ( 0.4827586 0.5000000 -0.0000000), wk = 0.0043860 k( 60) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043860 k( 61) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043860 k( 62) = ( 0.4880952 0.4880952 -0.0000000), wk = 0.0043860 k( 63) = ( 0.4761905 0.4761905 -0.0000000), wk = 0.0043860 k( 64) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0043860 k( 65) = ( 0.4523810 0.4523809 -0.0000000), wk = 0.0043860 k( 66) = ( 0.4404762 0.4404762 -0.0000000), wk = 0.0043860 k( 67) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0043860 k( 68) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0043860 k( 69) = ( 0.4047619 0.4047619 -0.0000000), wk = 0.0043860 k( 70) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0043860 k( 71) = ( 0.3809524 0.3809524 -0.0000000), wk = 0.0043860 k( 72) = ( 0.3690476 0.3690476 -0.0000000), wk = 0.0043860 k( 73) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0043860 k( 74) = ( 0.3452381 0.3452381 -0.0000000), wk = 0.0043860 k( 75) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0043860 k( 76) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0043860 k( 77) = ( 0.3095238 0.3095238 -0.0000000), wk = 0.0043860 k( 78) = ( 0.2976190 0.2976190 -0.0000000), wk = 0.0043860 k( 79) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0043860 k( 80) = ( 0.2738095 0.2738095 -0.0000000), wk = 0.0043860 k( 81) = ( 0.2619048 0.2619048 -0.0000000), wk = 0.0043860 k( 82) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0043860 k( 83) = ( 0.2380952 0.2380952 -0.0000000), wk = 0.0043860 k( 84) = ( 0.2261905 0.2261905 -0.0000000), wk = 0.0043860 k( 85) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0043860 k( 86) = ( 0.2023810 0.2023809 -0.0000000), wk = 0.0043860 k( 87) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0043860 k( 88) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0043860 k( 89) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0043860 k( 90) = ( 0.1547619 0.1547619 -0.0000000), wk = 0.0043860 k( 91) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0043860 k( 92) = ( 0.1309524 0.1309524 -0.0000000), wk = 0.0043860 k( 93) = ( 0.1190476 0.1190476 -0.0000000), wk = 0.0043860 k( 94) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0043860 k( 95) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0043860 k( 96) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0043860 k( 97) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0043860 k( 98) = ( 0.0595238 0.0595238 -0.0000000), wk = 0.0043860 k( 99) = ( 0.0476191 0.0476190 -0.0000000), wk = 0.0043860 k( 100) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0043860 k( 101) = ( 0.0238095 0.0238095 -0.0000000), wk = 0.0043860 k( 102) = ( 0.0119048 0.0119048 -0.0000000), wk = 0.0043860 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 105) = ( 0.0098039 0.0098039 0.0098039), wk = 0.0043860 k( 106) = ( 0.0196078 0.0196078 0.0196078), wk = 0.0043860 k( 107) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0043860 k( 108) = ( 0.0392157 0.0392157 0.0392157), wk = 0.0043860 k( 109) = ( 0.0490196 0.0490196 0.0490196), wk = 0.0043860 k( 110) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0043860 k( 111) = ( 0.0686275 0.0686275 0.0686274), wk = 0.0043860 k( 112) = ( 0.0784314 0.0784314 0.0784314), wk = 0.0043860 k( 113) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0043860 k( 114) = ( 0.0980392 0.0980392 0.0980392), wk = 0.0043860 k( 115) = ( 0.1078431 0.1078431 0.1078431), wk = 0.0043860 k( 116) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0043860 k( 117) = ( 0.1274510 0.1274510 0.1274510), wk = 0.0043860 k( 118) = ( 0.1372549 0.1372549 0.1372549), wk = 0.0043860 k( 119) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0043860 k( 120) = ( 0.1568627 0.1568627 0.1568627), wk = 0.0043860 k( 121) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0043860 k( 122) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0043860 k( 123) = ( 0.1862745 0.1862745 0.1862745), wk = 0.0043860 k( 124) = ( 0.1960784 0.1960784 0.1960784), wk = 0.0043860 k( 125) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0043860 k( 126) = ( 0.2156863 0.2156863 0.2156863), wk = 0.0043860 k( 127) = ( 0.2254902 0.2254902 0.2254902), wk = 0.0043860 k( 128) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0043860 k( 129) = ( 0.2450980 0.2450980 0.2450980), wk = 0.0043860 k( 130) = ( 0.2549020 0.2549020 0.2549020), wk = 0.0043860 k( 131) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0043860 k( 132) = ( 0.2745098 0.2745098 0.2745098), wk = 0.0043860 k( 133) = ( 0.2843137 0.2843137 0.2843137), wk = 0.0043860 k( 134) = ( 0.2941177 0.2941176 0.2941176), wk = 0.0043860 k( 135) = ( 0.3039216 0.3039216 0.3039216), wk = 0.0043860 k( 136) = ( 0.3137255 0.3137255 0.3137255), wk = 0.0043860 k( 137) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0043860 k( 138) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0043860 k( 139) = ( 0.3431373 0.3431372 0.3431372), wk = 0.0043860 k( 140) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0043860 k( 141) = ( 0.3627451 0.3627451 0.3627451), wk = 0.0043860 k( 142) = ( 0.3725490 0.3725490 0.3725490), wk = 0.0043860 k( 143) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0043860 k( 144) = ( 0.3921569 0.3921569 0.3921569), wk = 0.0043860 k( 145) = ( 0.4019608 0.4019608 0.4019608), wk = 0.0043860 k( 146) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0043860 k( 147) = ( 0.4215686 0.4215686 0.4215686), wk = 0.0043860 k( 148) = ( 0.4313726 0.4313725 0.4313725), wk = 0.0043860 k( 149) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0043860 k( 150) = ( 0.4509804 0.4509804 0.4509804), wk = 0.0043860 k( 151) = ( 0.4607843 0.4607843 0.4607843), wk = 0.0043860 k( 152) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0043860 k( 153) = ( 0.4803922 0.4803922 0.4803922), wk = 0.0043860 k( 154) = ( 0.4901961 0.4901961 0.4901961), wk = 0.0043860 k( 155) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 k( 156) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 k( 157) = ( 0.4880952 0.5000000 0.4880952), wk = 0.0043860 k( 158) = ( 0.4761905 0.5000000 0.4761905), wk = 0.0043860 k( 159) = ( 0.4642857 0.5000000 0.4642857), wk = 0.0043860 k( 160) = ( 0.4523810 0.5000000 0.4523809), wk = 0.0043860 k( 161) = ( 0.4404762 0.5000000 0.4404762), wk = 0.0043860 k( 162) = ( 0.4285714 0.5000000 0.4285714), wk = 0.0043860 k( 163) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0043860 k( 164) = ( 0.4047619 0.5000000 0.4047619), wk = 0.0043860 k( 165) = ( 0.3928571 0.5000000 0.3928571), wk = 0.0043860 k( 166) = ( 0.3809524 0.5000000 0.3809524), wk = 0.0043860 k( 167) = ( 0.3690476 0.5000000 0.3690476), wk = 0.0043860 k( 168) = ( 0.3571429 0.5000000 0.3571429), wk = 0.0043860 k( 169) = ( 0.3452381 0.5000000 0.3452381), wk = 0.0043860 k( 170) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0043860 k( 171) = ( 0.3214286 0.5000000 0.3214286), wk = 0.0043860 k( 172) = ( 0.3095238 0.5000000 0.3095238), wk = 0.0043860 k( 173) = ( 0.2976190 0.5000000 0.2976190), wk = 0.0043860 k( 174) = ( 0.2857143 0.5000000 0.2857143), wk = 0.0043860 k( 175) = ( 0.2738095 0.5000000 0.2738095), wk = 0.0043860 k( 176) = ( 0.2619048 0.5000000 0.2619048), wk = 0.0043860 k( 177) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0043860 k( 178) = ( 0.2380952 0.5000000 0.2380952), wk = 0.0043860 k( 179) = ( 0.2261905 0.5000000 0.2261905), wk = 0.0043860 k( 180) = ( 0.2142857 0.5000000 0.2142857), wk = 0.0043860 k( 181) = ( 0.2023810 0.5000000 0.2023809), wk = 0.0043860 k( 182) = ( 0.1904762 0.5000000 0.1904762), wk = 0.0043860 k( 183) = ( 0.1785714 0.5000000 0.1785714), wk = 0.0043860 k( 184) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0043860 k( 185) = ( 0.1547619 0.5000000 0.1547619), wk = 0.0043860 k( 186) = ( 0.1428571 0.5000000 0.1428571), wk = 0.0043860 k( 187) = ( 0.1309524 0.5000000 0.1309524), wk = 0.0043860 k( 188) = ( 0.1190476 0.5000000 0.1190476), wk = 0.0043860 k( 189) = ( 0.1071429 0.5000000 0.1071429), wk = 0.0043860 k( 190) = ( 0.0952381 0.5000000 0.0952381), wk = 0.0043860 k( 191) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0043860 k( 192) = ( 0.0714286 0.5000000 0.0714286), wk = 0.0043860 k( 193) = ( 0.0595238 0.5000000 0.0595238), wk = 0.0043860 k( 194) = ( 0.0476191 0.5000000 0.0476190), wk = 0.0043860 k( 195) = ( 0.0357143 0.5000000 0.0357143), wk = 0.0043860 k( 196) = ( 0.0238095 0.5000000 0.0238095), wk = 0.0043860 k( 197) = ( 0.0119048 0.5000000 0.0119048), wk = 0.0043860 k( 198) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043860 k( 199) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043860 k( 200) = ( 0.5000000 0.5000000 0.0172414), wk = 0.0043860 k( 201) = ( 0.5000000 0.5000000 0.0344828), wk = 0.0043860 k( 202) = ( 0.5000000 0.5000000 0.0517241), wk = 0.0043860 k( 203) = ( 0.5000000 0.5000000 0.0689655), wk = 0.0043860 k( 204) = ( 0.5000000 0.5000000 0.0862069), wk = 0.0043860 k( 205) = ( 0.5000000 0.5000000 0.1034483), wk = 0.0043860 k( 206) = ( 0.5000000 0.5000000 0.1206897), wk = 0.0043860 k( 207) = ( 0.5000000 0.5000000 0.1379310), wk = 0.0043860 k( 208) = ( 0.5000000 0.5000000 0.1551724), wk = 0.0043860 k( 209) = ( 0.5000000 0.5000000 0.1724138), wk = 0.0043860 k( 210) = ( 0.5000000 0.5000000 0.1896552), wk = 0.0043860 k( 211) = ( 0.5000000 0.5000000 0.2068965), wk = 0.0043860 k( 212) = ( 0.5000000 0.5000000 0.2241379), wk = 0.0043860 k( 213) = ( 0.5000000 0.5000000 0.2413793), wk = 0.0043860 k( 214) = ( 0.5000000 0.5000000 0.2586207), wk = 0.0043860 k( 215) = ( 0.5000000 0.5000000 0.2758621), wk = 0.0043860 k( 216) = ( 0.5000000 0.5000000 0.2931034), wk = 0.0043860 k( 217) = ( 0.5000000 0.5000000 0.3103448), wk = 0.0043860 k( 218) = ( 0.5000000 0.5000000 0.3275862), wk = 0.0043860 k( 219) = ( 0.5000000 0.5000000 0.3448276), wk = 0.0043860 k( 220) = ( 0.5000000 0.5000000 0.3620690), wk = 0.0043860 k( 221) = ( 0.5000000 0.5000000 0.3793103), wk = 0.0043860 k( 222) = ( 0.5000000 0.5000000 0.3965517), wk = 0.0043860 k( 223) = ( 0.5000000 0.5000000 0.4137931), wk = 0.0043860 k( 224) = ( 0.5000000 0.5000000 0.4310345), wk = 0.0043860 k( 225) = ( 0.5000000 0.5000000 0.4482759), wk = 0.0043860 k( 226) = ( 0.5000000 0.5000000 0.4655172), wk = 0.0043860 k( 227) = ( 0.5000000 0.5000000 0.4827586), wk = 0.0043860 k( 228) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 2) = ( 0.0000000 0.0172414 0.0000000), wk = 0.0043860 k( 3) = ( 0.0000000 0.0344828 0.0000000), wk = 0.0043860 k( 4) = ( 0.0000000 0.0517241 0.0000000), wk = 0.0043860 k( 5) = ( 0.0000000 0.0689655 0.0000000), wk = 0.0043860 k( 6) = ( 0.0000000 0.0862069 0.0000000), wk = 0.0043860 k( 7) = ( 0.0000000 0.1034483 0.0000000), wk = 0.0043860 k( 8) = ( 0.0000000 0.1206897 0.0000000), wk = 0.0043860 k( 9) = ( 0.0000000 0.1379310 0.0000000), wk = 0.0043860 k( 10) = ( 0.0000000 0.1551724 0.0000000), wk = 0.0043860 k( 11) = ( 0.0000000 0.1724138 0.0000000), wk = 0.0043860 k( 12) = ( 0.0000000 0.1896552 0.0000000), wk = 0.0043860 k( 13) = ( 0.0000000 0.2068966 0.0000000), wk = 0.0043860 k( 14) = ( 0.0000000 0.2241379 0.0000000), wk = 0.0043860 k( 15) = ( 0.0000000 0.2413793 0.0000000), wk = 0.0043860 k( 16) = ( 0.0000000 0.2586207 0.0000000), wk = 0.0043860 k( 17) = ( 0.0000000 0.2758621 0.0000000), wk = 0.0043860 k( 18) = ( 0.0000000 0.2931034 0.0000000), wk = 0.0043860 k( 19) = ( 0.0000000 0.3103448 0.0000000), wk = 0.0043860 k( 20) = ( 0.0000000 0.3275862 0.0000000), wk = 0.0043860 k( 21) = ( 0.0000000 0.3448276 0.0000000), wk = 0.0043860 k( 22) = ( 0.0000000 0.3620690 0.0000000), wk = 0.0043860 k( 23) = ( 0.0000000 0.3793103 0.0000000), wk = 0.0043860 k( 24) = ( 0.0000000 0.3965517 0.0000000), wk = 0.0043860 k( 25) = ( 0.0000000 0.4137931 0.0000000), wk = 0.0043860 k( 26) = ( 0.0000000 0.4310345 0.0000000), wk = 0.0043860 k( 27) = ( 0.0000000 0.4482759 0.0000000), wk = 0.0043860 k( 28) = ( 0.0000000 0.4655172 0.0000000), wk = 0.0043860 k( 29) = ( 0.0000000 0.4827586 0.0000000), wk = 0.0043860 k( 30) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043860 k( 31) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043860 k( 32) = ( 0.0172414 0.5000000 0.0000000), wk = 0.0043860 k( 33) = ( 0.0344828 0.5000000 0.0000000), wk = 0.0043860 k( 34) = ( 0.0517241 0.5000000 0.0000000), wk = 0.0043860 k( 35) = ( 0.0689655 0.5000000 0.0000000), wk = 0.0043860 k( 36) = ( 0.0862069 0.5000000 0.0000000), wk = 0.0043860 k( 37) = ( 0.1034483 0.5000000 0.0000000), wk = 0.0043860 k( 38) = ( 0.1206897 0.5000000 0.0000000), wk = 0.0043860 k( 39) = ( 0.1379310 0.5000000 0.0000000), wk = 0.0043860 k( 40) = ( 0.1551724 0.5000000 0.0000000), wk = 0.0043860 k( 41) = ( 0.1724138 0.5000000 0.0000000), wk = 0.0043860 k( 42) = ( 0.1896552 0.5000000 0.0000000), wk = 0.0043860 k( 43) = ( 0.2068966 0.5000000 0.0000000), wk = 0.0043860 k( 44) = ( 0.2241379 0.5000000 0.0000000), wk = 0.0043860 k( 45) = ( 0.2413793 0.5000000 0.0000000), wk = 0.0043860 k( 46) = ( 0.2586207 0.5000000 0.0000000), wk = 0.0043860 k( 47) = ( 0.2758621 0.5000000 0.0000000), wk = 0.0043860 k( 48) = ( 0.2931034 0.5000000 0.0000000), wk = 0.0043860 k( 49) = ( 0.3103448 0.5000000 0.0000000), wk = 0.0043860 k( 50) = ( 0.3275862 0.5000000 0.0000000), wk = 0.0043860 k( 51) = ( 0.3448276 0.5000000 0.0000000), wk = 0.0043860 k( 52) = ( 0.3620690 0.5000000 0.0000000), wk = 0.0043860 k( 53) = ( 0.3793103 0.5000000 0.0000000), wk = 0.0043860 k( 54) = ( 0.3965517 0.5000000 -0.0000000), wk = 0.0043860 k( 55) = ( 0.4137931 0.5000000 0.0000000), wk = 0.0043860 k( 56) = ( 0.4310345 0.5000000 0.0000000), wk = 0.0043860 k( 57) = ( 0.4482759 0.5000000 0.0000000), wk = 0.0043860 k( 58) = ( 0.4655172 0.5000000 -0.0000000), wk = 0.0043860 k( 59) = ( 0.4827586 0.5000000 0.0000000), wk = 0.0043860 k( 60) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043860 k( 61) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043860 k( 62) = ( 0.4880952 0.4880952 0.0000000), wk = 0.0043860 k( 63) = ( 0.4761905 0.4761905 0.0000000), wk = 0.0043860 k( 64) = ( 0.4642857 0.4642857 0.0000000), wk = 0.0043860 k( 65) = ( 0.4523810 0.4523810 0.0000000), wk = 0.0043860 k( 66) = ( 0.4404762 0.4404762 0.0000000), wk = 0.0043860 k( 67) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0043860 k( 68) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0043860 k( 69) = ( 0.4047619 0.4047619 0.0000000), wk = 0.0043860 k( 70) = ( 0.3928571 0.3928571 0.0000000), wk = 0.0043860 k( 71) = ( 0.3809524 0.3809524 0.0000000), wk = 0.0043860 k( 72) = ( 0.3690476 0.3690476 0.0000000), wk = 0.0043860 k( 73) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0043860 k( 74) = ( 0.3452381 0.3452381 0.0000000), wk = 0.0043860 k( 75) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0043860 k( 76) = ( 0.3214286 0.3214286 0.0000000), wk = 0.0043860 k( 77) = ( 0.3095238 0.3095238 0.0000000), wk = 0.0043860 k( 78) = ( 0.2976190 0.2976190 -0.0000000), wk = 0.0043860 k( 79) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0043860 k( 80) = ( 0.2738095 0.2738095 0.0000000), wk = 0.0043860 k( 81) = ( 0.2619048 0.2619048 0.0000000), wk = 0.0043860 k( 82) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0043860 k( 83) = ( 0.2380952 0.2380952 0.0000000), wk = 0.0043860 k( 84) = ( 0.2261905 0.2261905 0.0000000), wk = 0.0043860 k( 85) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0043860 k( 86) = ( 0.2023810 0.2023810 0.0000000), wk = 0.0043860 k( 87) = ( 0.1904762 0.1904762 0.0000000), wk = 0.0043860 k( 88) = ( 0.1785714 0.1785714 0.0000000), wk = 0.0043860 k( 89) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0043860 k( 90) = ( 0.1547619 0.1547619 -0.0000000), wk = 0.0043860 k( 91) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0043860 k( 92) = ( 0.1309524 0.1309524 0.0000000), wk = 0.0043860 k( 93) = ( 0.1190476 0.1190476 0.0000000), wk = 0.0043860 k( 94) = ( 0.1071429 0.1071429 0.0000000), wk = 0.0043860 k( 95) = ( 0.0952381 0.0952381 0.0000000), wk = 0.0043860 k( 96) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0043860 k( 97) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0043860 k( 98) = ( 0.0595238 0.0595238 0.0000000), wk = 0.0043860 k( 99) = ( 0.0476191 0.0476191 0.0000000), wk = 0.0043860 k( 100) = ( 0.0357143 0.0357143 0.0000000), wk = 0.0043860 k( 101) = ( 0.0238095 0.0238095 0.0000000), wk = 0.0043860 k( 102) = ( 0.0119048 0.0119048 0.0000000), wk = 0.0043860 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 104) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 105) = ( 0.0098039 0.0098039 0.0098039), wk = 0.0043860 k( 106) = ( 0.0196078 0.0196078 0.0196078), wk = 0.0043860 k( 107) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0043860 k( 108) = ( 0.0392157 0.0392157 0.0392157), wk = 0.0043860 k( 109) = ( 0.0490196 0.0490196 0.0490196), wk = 0.0043860 k( 110) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0043860 k( 111) = ( 0.0686275 0.0686275 0.0686275), wk = 0.0043860 k( 112) = ( 0.0784314 0.0784314 0.0784314), wk = 0.0043860 k( 113) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0043860 k( 114) = ( 0.0980392 0.0980392 0.0980392), wk = 0.0043860 k( 115) = ( 0.1078431 0.1078431 0.1078431), wk = 0.0043860 k( 116) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0043860 k( 117) = ( 0.1274510 0.1274510 0.1274510), wk = 0.0043860 k( 118) = ( 0.1372549 0.1372549 0.1372549), wk = 0.0043860 k( 119) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0043860 k( 120) = ( 0.1568627 0.1568627 0.1568627), wk = 0.0043860 k( 121) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0043860 k( 122) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0043860 k( 123) = ( 0.1862745 0.1862745 0.1862745), wk = 0.0043860 k( 124) = ( 0.1960784 0.1960784 0.1960784), wk = 0.0043860 k( 125) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0043860 k( 126) = ( 0.2156863 0.2156863 0.2156863), wk = 0.0043860 k( 127) = ( 0.2254902 0.2254902 0.2254902), wk = 0.0043860 k( 128) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0043860 k( 129) = ( 0.2450980 0.2450980 0.2450980), wk = 0.0043860 k( 130) = ( 0.2549020 0.2549020 0.2549020), wk = 0.0043860 k( 131) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0043860 k( 132) = ( 0.2745098 0.2745098 0.2745098), wk = 0.0043860 k( 133) = ( 0.2843137 0.2843137 0.2843137), wk = 0.0043860 k( 134) = ( 0.2941177 0.2941177 0.2941177), wk = 0.0043860 k( 135) = ( 0.3039216 0.3039216 0.3039216), wk = 0.0043860 k( 136) = ( 0.3137255 0.3137255 0.3137255), wk = 0.0043860 k( 137) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0043860 k( 138) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0043860 k( 139) = ( 0.3431373 0.3431373 0.3431373), wk = 0.0043860 k( 140) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0043860 k( 141) = ( 0.3627451 0.3627451 0.3627451), wk = 0.0043860 k( 142) = ( 0.3725490 0.3725490 0.3725490), wk = 0.0043860 k( 143) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0043860 k( 144) = ( 0.3921569 0.3921569 0.3921569), wk = 0.0043860 k( 145) = ( 0.4019608 0.4019608 0.4019608), wk = 0.0043860 k( 146) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0043860 k( 147) = ( 0.4215686 0.4215686 0.4215686), wk = 0.0043860 k( 148) = ( 0.4313726 0.4313726 0.4313726), wk = 0.0043860 k( 149) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0043860 k( 150) = ( 0.4509804 0.4509804 0.4509804), wk = 0.0043860 k( 151) = ( 0.4607843 0.4607843 0.4607843), wk = 0.0043860 k( 152) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0043860 k( 153) = ( 0.4803922 0.4803922 0.4803922), wk = 0.0043860 k( 154) = ( 0.4901961 0.4901961 0.4901961), wk = 0.0043860 k( 155) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 k( 156) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 k( 157) = ( 0.4880952 0.5000000 0.4880952), wk = 0.0043860 k( 158) = ( 0.4761905 0.5000000 0.4761905), wk = 0.0043860 k( 159) = ( 0.4642857 0.5000000 0.4642857), wk = 0.0043860 k( 160) = ( 0.4523810 0.5000000 0.4523810), wk = 0.0043860 k( 161) = ( 0.4404762 0.5000000 0.4404762), wk = 0.0043860 k( 162) = ( 0.4285714 0.5000000 0.4285714), wk = 0.0043860 k( 163) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0043860 k( 164) = ( 0.4047619 0.5000000 0.4047619), wk = 0.0043860 k( 165) = ( 0.3928571 0.5000000 0.3928571), wk = 0.0043860 k( 166) = ( 0.3809524 0.5000000 0.3809524), wk = 0.0043860 k( 167) = ( 0.3690476 0.5000000 0.3690476), wk = 0.0043860 k( 168) = ( 0.3571429 0.5000000 0.3571429), wk = 0.0043860 k( 169) = ( 0.3452381 0.5000000 0.3452381), wk = 0.0043860 k( 170) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0043860 k( 171) = ( 0.3214286 0.5000000 0.3214286), wk = 0.0043860 k( 172) = ( 0.3095238 0.5000000 0.3095238), wk = 0.0043860 k( 173) = ( 0.2976190 0.5000000 0.2976190), wk = 0.0043860 k( 174) = ( 0.2857143 0.5000000 0.2857143), wk = 0.0043860 k( 175) = ( 0.2738095 0.5000000 0.2738095), wk = 0.0043860 k( 176) = ( 0.2619048 0.5000000 0.2619048), wk = 0.0043860 k( 177) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0043860 k( 178) = ( 0.2380952 0.5000000 0.2380952), wk = 0.0043860 k( 179) = ( 0.2261905 0.5000000 0.2261905), wk = 0.0043860 k( 180) = ( 0.2142857 0.5000000 0.2142857), wk = 0.0043860 k( 181) = ( 0.2023810 0.5000000 0.2023810), wk = 0.0043860 k( 182) = ( 0.1904762 0.5000000 0.1904762), wk = 0.0043860 k( 183) = ( 0.1785714 0.5000000 0.1785714), wk = 0.0043860 k( 184) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0043860 k( 185) = ( 0.1547619 0.5000000 0.1547619), wk = 0.0043860 k( 186) = ( 0.1428571 0.5000000 0.1428571), wk = 0.0043860 k( 187) = ( 0.1309524 0.5000000 0.1309524), wk = 0.0043860 k( 188) = ( 0.1190476 0.5000000 0.1190476), wk = 0.0043860 k( 189) = ( 0.1071429 0.5000000 0.1071429), wk = 0.0043860 k( 190) = ( 0.0952381 0.5000000 0.0952381), wk = 0.0043860 k( 191) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0043860 k( 192) = ( 0.0714286 0.5000000 0.0714286), wk = 0.0043860 k( 193) = ( 0.0595238 0.5000000 0.0595238), wk = 0.0043860 k( 194) = ( 0.0476191 0.5000000 0.0476191), wk = 0.0043860 k( 195) = ( 0.0357143 0.5000000 0.0357143), wk = 0.0043860 k( 196) = ( 0.0238095 0.5000000 0.0238095), wk = 0.0043860 k( 197) = ( 0.0119048 0.5000000 0.0119048), wk = 0.0043860 k( 198) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043860 k( 199) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043860 k( 200) = ( 0.5000000 0.5000000 0.0172414), wk = 0.0043860 k( 201) = ( 0.5000000 0.5000000 0.0344828), wk = 0.0043860 k( 202) = ( 0.5000000 0.5000000 0.0517241), wk = 0.0043860 k( 203) = ( 0.5000000 0.5000000 0.0689655), wk = 0.0043860 k( 204) = ( 0.5000000 0.5000000 0.0862069), wk = 0.0043860 k( 205) = ( 0.5000000 0.5000000 0.1034483), wk = 0.0043860 k( 206) = ( 0.5000000 0.5000000 0.1206897), wk = 0.0043860 k( 207) = ( 0.5000000 0.5000000 0.1379310), wk = 0.0043860 k( 208) = ( 0.5000000 0.5000000 0.1551724), wk = 0.0043860 k( 209) = ( 0.5000000 0.5000000 0.1724138), wk = 0.0043860 k( 210) = ( 0.5000000 0.5000000 0.1896552), wk = 0.0043860 k( 211) = ( 0.5000000 0.5000000 0.2068966), wk = 0.0043860 k( 212) = ( 0.5000000 0.5000000 0.2241379), wk = 0.0043860 k( 213) = ( 0.5000000 0.5000000 0.2413793), wk = 0.0043860 k( 214) = ( 0.5000000 0.5000000 0.2586207), wk = 0.0043860 k( 215) = ( 0.5000000 0.5000000 0.2758621), wk = 0.0043860 k( 216) = ( 0.5000000 0.5000000 0.2931034), wk = 0.0043860 k( 217) = ( 0.5000000 0.5000000 0.3103448), wk = 0.0043860 k( 218) = ( 0.5000000 0.5000000 0.3275862), wk = 0.0043860 k( 219) = ( 0.5000000 0.5000000 0.3448276), wk = 0.0043860 k( 220) = ( 0.5000000 0.5000000 0.3620690), wk = 0.0043860 k( 221) = ( 0.5000000 0.5000000 0.3793103), wk = 0.0043860 k( 222) = ( 0.5000000 0.5000000 0.3965517), wk = 0.0043860 k( 223) = ( 0.5000000 0.5000000 0.4137931), wk = 0.0043860 k( 224) = ( 0.5000000 0.5000000 0.4310345), wk = 0.0043860 k( 225) = ( 0.5000000 0.5000000 0.4482759), wk = 0.0043860 k( 226) = ( 0.5000000 0.5000000 0.4655172), wk = 0.0043860 k( 227) = ( 0.5000000 0.5000000 0.4827586), wk = 0.0043860 k( 228) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 Dense grid: 66539 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 45145 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.37 Mb ( 252, 96) NL pseudopotentials 0.78 Mb ( 126, 408) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1387) G-vector shells 0.00 Mb ( 367) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.48 Mb ( 252, 384) Each subspace H/S matrix 2.25 Mb ( 384, 384) Each matrix 1.20 Mb ( 408, 2, 96) The potential is recalculated from file : ./FeS2.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 49.6 secs Computing kpt #: 2 total cpu time spent up to now is 58.4 secs Computing kpt #: 3 total cpu time spent up to now is 67.2 secs Computing kpt #: 4 total cpu time spent up to now is 75.8 secs Computing kpt #: 5 total cpu time spent up to now is 84.4 secs Computing kpt #: 6 total cpu time spent up to now is 93.0 secs Computing kpt #: 7 total cpu time spent up to now is 101.5 secs Computing kpt #: 8 total cpu time spent up to now is 110.0 secs Computing kpt #: 9 total cpu time spent up to now is 118.4 secs Computing kpt #: 10 total cpu time spent up to now is 126.9 secs Computing kpt #: 11 total cpu time spent up to now is 135.7 secs Computing kpt #: 12 total cpu time spent up to now is 143.6 secs Computing kpt #: 13 total cpu time spent up to now is 151.3 secs Computing kpt #: 14 total cpu time spent up to now is 158.8 secs Computing kpt #: 15 total cpu time spent up to now is 166.1 secs Computing kpt #: 16 total cpu time spent up to now is 173.5 secs Computing kpt #: 17 total cpu time spent up to now is 180.8 secs Computing kpt #: 18 total cpu time spent up to now is 188.2 secs Computing kpt #: 19 total cpu time spent up to now is 195.7 secs Computing kpt #: 20 total cpu time spent up to now is 203.4 secs Computing kpt #: 21 total cpu time spent up to now is 211.2 secs Computing kpt #: 22 total cpu time spent up to now is 219.2 secs Computing kpt #: 23 total cpu time spent up to now is 227.6 secs Computing kpt #: 24 total cpu time spent up to now is 237.1 secs Computing kpt #: 25 total cpu time spent up to now is 246.5 secs Computing kpt #: 26 total cpu time spent up to now is 255.4 secs Computing kpt #: 27 total cpu time spent up to now is 264.4 secs Computing kpt #: 28 total cpu time spent up to now is 274.1 secs Computing kpt #: 29 total cpu time spent up to now is 283.9 secs Computing kpt #: 30 total cpu time spent up to now is 293.6 secs Computing kpt #: 31 total cpu time spent up to now is 303.3 secs Computing kpt #: 32 total cpu time spent up to now is 313.0 secs Computing kpt #: 33 total cpu time spent up to now is 322.9 secs Computing kpt #: 34 total cpu time spent up to now is 332.2 secs Computing kpt #: 35 total cpu time spent up to now is 341.9 secs Computing kpt #: 36 total cpu time spent up to now is 350.5 secs Computing kpt #: 37 total cpu time spent up to now is 359.8 secs Computing kpt #: 38 total cpu time spent up to now is 368.2 secs Computing kpt #: 39 total cpu time spent up to now is 376.6 secs Computing kpt #: 40 total cpu time spent up to now is 384.8 secs Computing kpt #: 41 total cpu time spent up to now is 392.7 secs Computing kpt #: 42 total cpu time spent up to now is 400.5 secs Computing kpt #: 43 total cpu time spent up to now is 408.2 secs Computing kpt #: 44 total cpu time spent up to now is 416.0 secs Computing kpt 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spent up to now is 535.3 secs Computing kpt #: 61 total cpu time spent up to now is 542.6 secs Computing kpt #: 62 total cpu time spent up to now is 550.0 secs Computing kpt #: 63 total cpu time spent up to now is 557.4 secs Computing kpt #: 64 total cpu time spent up to now is 564.8 secs Computing kpt #: 65 total cpu time spent up to now is 572.4 secs Computing kpt #: 66 total cpu time spent up to now is 579.9 secs Computing kpt #: 67 total cpu time spent up to now is 587.5 secs Computing kpt #: 68 total cpu time spent up to now is 594.4 secs Computing kpt #: 69 total cpu time spent up to now is 602.1 secs Computing kpt #: 70 total cpu time spent up to now is 609.2 secs Computing kpt #: 71 total cpu time spent up to now is 616.1 secs Computing kpt #: 72 total cpu time spent up to now is 623.8 secs Computing kpt #: 73 total cpu time spent up to now is 631.6 secs Computing kpt #: 74 total cpu time spent up to now is 639.5 secs Computing kpt #: 75 total cpu time spent up to now is 647.5 secs Computing kpt #: 76 total cpu time spent up to now is 655.7 secs Computing kpt #: 77 total cpu time spent up to now is 663.9 secs Computing kpt #: 78 total cpu time spent up to now is 672.1 secs Computing kpt #: 79 total cpu time spent up to now is 681.0 secs Computing kpt #: 80 total cpu time spent up to now is 689.1 secs Computing kpt #: 81 total cpu time spent up to now is 697.2 secs Computing kpt #: 82 total cpu time spent up to now is 705.1 secs Computing kpt #: 83 total cpu time spent up to now is 712.9 secs Computing kpt #: 84 total cpu time spent up to now is 720.8 secs Computing kpt #: 85 total cpu time spent up to now is 728.6 secs Computing kpt #: 86 total cpu time spent up to now is 736.5 secs Computing kpt #: 87 total cpu time spent up to now is 746.1 secs Computing kpt #: 88 total cpu time spent up to now is 756.6 secs Computing kpt #: 89 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 771.3 secs Computing kpt #: 90 total cpu time spent up to now is 780.0 secs Computing kpt #: 91 total cpu time spent up to now is 788.1 secs Computing kpt #: 92 total cpu time spent up to now is 796.2 secs Computing kpt #: 93 total cpu time spent up to now is 804.2 secs Computing kpt #: 94 total cpu time spent up to now is 812.1 secs Computing kpt #: 95 total cpu time spent up to now is 820.2 secs Computing kpt #: 96 total cpu time spent up to now is 828.9 secs Computing kpt #: 97 total cpu time spent up to now is 837.4 secs Computing kpt #: 98 total cpu time spent up to now is 846.1 secs Computing kpt #: 99 total cpu time spent up to now is 854.7 secs Computing kpt #: 100 total cpu time spent up to now is 863.4 secs Computing kpt #: 101 total cpu time spent up to now is 872.1 secs Computing kpt #: 102 total cpu time spent up to now is 880.9 secs Computing kpt #: 103 total cpu time spent up to now is 888.9 secs Computing kpt #: 104 total cpu time spent up to now is 896.9 secs Computing kpt #: 105 total cpu time spent up to now is 905.8 secs Computing kpt #: 106 total cpu time spent up to now is 914.5 secs Computing kpt #: 107 total cpu time spent up to now is 923.3 secs Computing kpt #: 108 total cpu time spent up to now is 932.1 secs Computing kpt #: 109 total cpu time spent up to now is 940.9 secs Computing kpt #: 110 total cpu time spent up to now is 949.6 secs Computing kpt #: 111 total cpu time spent up to now is 958.2 secs Computing kpt #: 112 total cpu time spent up to now is 966.8 secs Computing kpt #: 113 total cpu time spent up to now is 975.6 secs Computing kpt #: 114 total cpu time spent up to now is 984.4 secs Computing kpt #: 115 total cpu time spent up to now is 993.1 secs Computing kpt #: 116 total cpu time spent up to now is 1001.9 secs Computing kpt #: 117 total cpu time spent up to now is 1010.7 secs Computing kpt #: 118 total cpu time spent up to now is 1019.6 secs Computing kpt #: 119 total cpu time spent up to now is 1028.4 secs Computing kpt #: 120 total cpu time spent up to now is 1037.5 secs Computing kpt #: 121 total cpu time spent up to now is 1046.2 secs Computing kpt #: 122 total cpu time spent up to now is 1055.1 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1070.2 secs Computing kpt #: 124 total cpu time spent up to now is 1079.1 secs Computing kpt #: 125 total cpu time spent up to now is 1088.1 secs Computing kpt #: 126 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1103.1 secs Computing kpt #: 127 total cpu time spent up to now is 1112.3 secs Computing kpt #: 128 total cpu time spent up to now is 1121.7 secs Computing kpt #: 129 total cpu time spent up to now is 1131.0 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1146.1 secs Computing kpt #: 131 total cpu time spent up to now is 1155.6 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1170.7 secs Computing kpt #: 133 total cpu time spent up to now is 1180.3 secs Computing kpt #: 134 total cpu time spent up to now is 1189.8 secs Computing kpt #: 135 total cpu time spent up to now is 1199.6 secs Computing kpt #: 136 total cpu time spent up to now is 1209.1 secs Computing kpt #: 137 total cpu time spent up to now is 1219.1 secs Computing kpt #: 138 total cpu time spent up to now is 1229.2 secs Computing kpt #: 139 total cpu time spent up to now is 1238.9 secs Computing kpt #: 140 total cpu time spent up to now is 1248.2 secs Computing kpt #: 141 total cpu time spent up to now is 1256.8 secs Computing kpt #: 142 total cpu time spent up to now is 1265.8 secs Computing kpt #: 143 total cpu time spent up to now is 1273.5 secs Computing kpt #: 144 total cpu time spent up to now is 1281.1 secs Computing kpt #: 145 total cpu time spent up to now is 1288.6 secs Computing kpt #: 146 total cpu time spent up to now is 1296.1 secs Computing kpt #: 147 total cpu time spent up to now is 1303.1 secs Computing kpt #: 148 total cpu time spent up to now is 1310.0 secs Computing kpt #: 149 total cpu time spent up to now is 1316.9 secs Computing kpt #: 150 total cpu time spent up to now is 1324.2 secs Computing kpt #: 151 total cpu time spent up to now is 1331.6 secs Computing kpt #: 152 total cpu time spent up to now is 1338.9 secs Computing kpt #: 153 total cpu time spent up to now is 1346.0 secs Computing kpt #: 154 total cpu time spent up to now is 1353.1 secs Computing kpt #: 155 total cpu time spent up to now is 1360.2 secs Computing kpt #: 156 total cpu time spent up to now is 1367.3 secs Computing kpt #: 157 total cpu time spent up to now is 1374.4 secs Computing kpt #: 158 total cpu time spent up to now is 1381.6 secs Computing kpt #: 159 total cpu time spent up to now is 1388.8 secs Computing kpt #: 160 total cpu time spent up to now is 1396.2 secs Computing kpt #: 161 total cpu time spent up to now is 1403.0 secs Computing kpt #: 162 total cpu time spent up to now is 1409.9 secs Computing kpt #: 163 total cpu time spent up to now is 1417.0 secs Computing kpt #: 164 total cpu time spent up to now is 1424.0 secs Computing kpt #: 165 total cpu time spent up to now is 1431.8 secs Computing kpt #: 166 total cpu time spent up to now is 1439.5 secs Computing kpt #: 167 total cpu time spent up to now is 1447.2 secs Computing kpt #: 168 total cpu time spent up to now is 1455.2 secs Computing kpt #: 169 total cpu time spent up to now is 1463.2 secs Computing kpt #: 170 total cpu time spent up to now is 1471.2 secs Computing kpt #: 171 total cpu time spent up to now is 1479.4 secs Computing kpt #: 172 total cpu time spent up to now is 1487.8 secs Computing kpt #: 173 total cpu time spent up to now is 1496.2 secs Computing kpt #: 174 total cpu time spent up to now is 1504.7 secs Computing kpt #: 175 total cpu time spent up to now is 1513.1 secs Computing kpt #: 176 total cpu time spent up to now is 1521.7 secs Computing kpt #: 177 total cpu time spent up to now is 1530.3 secs Computing kpt #: 178 total cpu time spent up to now is 1538.9 secs Computing kpt #: 179 total cpu time spent up to now is 1547.7 secs Computing kpt #: 180 total cpu time spent up to now is 1556.3 secs Computing kpt #: 181 total cpu time spent up to now is 1564.9 secs Computing kpt #: 182 total cpu time spent up to now is 1573.5 secs Computing kpt #: 183 total cpu time spent up to now is 1582.2 secs Computing kpt #: 184 total cpu time spent up to now is 1591.0 secs Computing kpt #: 185 total cpu time spent up to now is 1599.6 secs Computing kpt #: 186 total cpu time spent up to now is 1608.5 secs Computing kpt #: 187 total cpu time spent up to now is 1618.0 secs Computing kpt #: 188 total cpu time spent up to now is 1627.6 secs Computing kpt #: 189 total cpu time spent up to now is 1637.5 secs Computing kpt #: 190 total cpu time spent up to now is 1646.5 secs Computing kpt #: 191 total cpu time spent up to now is 1655.8 secs Computing kpt #: 192 total cpu time spent up to now is 1665.7 secs Computing kpt #: 193 total cpu time spent up to now is 1675.1 secs Computing kpt #: 194 total cpu time spent up to now is 1685.0 secs Computing kpt #: 195 total cpu time spent up to now is 1694.8 secs Computing kpt #: 196 total cpu time spent up to now is 1704.7 secs Computing kpt #: 197 total cpu time spent up to now is 1714.5 secs Computing kpt #: 198 total cpu time spent up to now is 1724.3 secs Computing kpt #: 199 total cpu time spent up to now is 1731.6 secs Computing kpt #: 200 total cpu time spent up to now is 1739.1 secs Computing kpt #: 201 total cpu time spent up to now is 1746.5 secs Computing kpt #: 202 total cpu time spent up to now is 1753.9 secs Computing kpt #: 203 total cpu time spent up to now is 1761.3 secs Computing kpt #: 204 total cpu time spent up to now is 1768.9 secs Computing kpt #: 205 total cpu time spent up to now is 1776.3 secs Computing kpt #: 206 total cpu time spent up to now is 1783.3 secs Computing kpt #: 207 total cpu time spent up to now is 1790.4 secs Computing kpt #: 208 total cpu time spent up to now is 1798.0 secs Computing kpt #: 209 total cpu time spent up to now is 1805.1 secs Computing kpt #: 210 total cpu time spent up to now is 1812.7 secs Computing kpt #: 211 total cpu time spent up to now is 1820.3 secs Computing kpt #: 212 total cpu time spent up to now is 1828.0 secs Computing kpt #: 213 total cpu time spent up to now is 1835.9 secs Computing kpt #: 214 total cpu time spent up to now is 1843.6 secs Computing kpt #: 215 total cpu time spent up to now is 1851.3 secs Computing kpt #: 216 total cpu time spent up to now is 1859.0 secs Computing kpt #: 217 total cpu time spent up to now is 1866.7 secs Computing kpt #: 218 total cpu time spent up to now is 1874.3 secs Computing kpt #: 219 total cpu time spent up to now is 1881.3 secs Computing kpt #: 220 total cpu time spent up to now is 1888.3 secs Computing kpt #: 221 total cpu time spent up to now is 1895.3 secs Computing kpt #: 222 total cpu time spent up to now is 1902.3 secs Computing kpt #: 223 total cpu time spent up to now is 1909.7 secs Computing kpt #: 224 total cpu time spent up to now is 1916.9 secs Computing kpt #: 225 total cpu time spent up to now is 1924.1 secs Computing kpt #: 226 total cpu time spent up to now is 1931.2 secs Computing kpt #: 227 total cpu time spent up to now is 1938.4 secs Computing kpt #: 228 total cpu time spent up to now is 1945.4 secs ethr = 1.25E-11, avg # of iterations = 38.4 total cpu time spent up to now is 1945.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5695 PWs) bands (ev): -5.6182 -5.6182 -3.4610 -3.4610 -3.4610 -3.4610 -3.4601 -3.4601 -1.1476 -1.1476 -1.1409 -1.1409 -1.1409 -1.1409 0.3111 0.3111 4.6339 4.6339 4.6374 4.6374 4.6374 4.6374 5.3762 5.3762 5.3873 5.3873 5.3873 5.3873 6.2345 6.2345 6.2345 6.2345 6.2709 6.2709 6.3140 6.3140 6.3140 6.3140 6.5448 6.5448 7.4454 7.4454 7.4454 7.4454 7.4608 7.4608 7.8031 7.8031 7.8031 7.8031 8.6944 8.6944 8.7449 8.7449 8.7449 8.7449 10.1410 10.1410 10.1835 10.1835 10.1835 10.1835 10.6991 10.6991 10.6991 10.6991 10.8448 10.8448 10.8448 10.8448 10.8448 10.8448 10.9177 10.9177 10.9177 10.9177 10.9351 10.9351 11.1466 11.1466 11.7143 11.7143 12.7193 12.7193 12.7193 12.7193 12.7382 12.7382 14.2220 14.2220 14.2874 14.2874 14.2874 14.2874 14.4852 14.4852 k = 0.0000 0.0172-0.0000 ( 5659 PWs) bands (ev): -5.6171 -5.6171 -3.4634 -3.4634 -3.4606 -3.4606 -3.4600 -3.4600 -1.1469 -1.1469 -1.1405 -1.1405 -1.1400 -1.1400 0.3092 0.3092 4.6312 4.6312 4.6352 4.6352 4.6368 4.6368 5.3742 5.3742 5.3844 5.3844 5.3916 5.3916 6.1812 6.1812 6.2368 6.2368 6.2862 6.2862 6.3178 6.3178 6.3579 6.3579 6.5424 6.5424 7.4445 7.4445 7.4474 7.4474 7.4619 7.4619 7.7986 7.7986 7.8035 7.8035 8.6956 8.6956 8.7431 8.7431 8.7501 8.7501 10.1426 10.1426 10.1841 10.1841 10.1859 10.1859 10.6981 10.6981 10.6994 10.6994 10.8443 10.8443 10.8447 10.8447 10.8451 10.8451 10.9173 10.9173 10.9176 10.9176 10.9351 10.9351 11.1469 11.1469 11.7181 11.7181 12.7189 12.7189 12.7196 12.7196 12.7382 12.7382 14.2195 14.2195 14.2836 14.2836 14.2856 14.2856 14.4857 14.4857 k = 0.0000 0.0345-0.0000 ( 5643 PWs) bands (ev): -5.6138 -5.6138 -3.4712 -3.4712 -3.4598 -3.4598 -3.4592 -3.4592 -1.1451 -1.1451 -1.1391 -1.1391 -1.1373 -1.1373 0.3034 0.3034 4.6194 4.6194 4.6318 4.6318 4.6354 4.6354 5.3602 5.3602 5.3806 5.3806 5.4083 5.4083 6.1086 6.1086 6.2436 6.2436 6.2995 6.2995 6.3291 6.3291 6.4341 6.4341 6.5355 6.5355 7.4413 7.4413 7.4499 7.4499 7.4689 7.4689 7.7858 7.7858 7.8049 7.8049 8.6956 8.6956 8.7377 8.7377 8.7683 8.7683 10.1464 10.1464 10.1862 10.1862 10.1930 10.1930 10.6946 10.6946 10.7001 10.7001 10.8426 10.8426 10.8441 10.8441 10.8459 10.8459 10.9156 10.9156 10.9171 10.9171 10.9349 10.9349 11.1474 11.1474 11.7293 11.7293 12.7174 12.7174 12.7203 12.7203 12.7380 12.7380 14.2122 14.2122 14.2725 14.2725 14.2804 14.2804 14.4872 14.4872 k = 0.0000 0.0517-0.0000 ( 5646 PWs) bands (ev): -5.6082 -5.6082 -3.4843 -3.4843 -3.4584 -3.4584 -3.4578 -3.4578 -1.1424 -1.1424 -1.1367 -1.1367 -1.1326 -1.1326 0.2937 0.2937 4.6001 4.6001 4.6264 4.6264 4.6333 4.6333 5.3351 5.3351 5.3763 5.3763 5.4365 5.4365 6.0365 6.0365 6.2546 6.2546 6.3177 6.3177 6.3468 6.3468 6.5125 6.5125 6.5266 6.5266 7.4349 7.4349 7.4498 7.4498 7.4861 7.4861 7.7664 7.7664 7.8072 7.8072 8.6907 8.6907 8.7290 8.7290 8.8013 8.8013 10.1505 10.1505 10.1916 10.1916 10.2046 10.2046 10.6886 10.6886 10.7010 10.7010 10.8394 10.8394 10.8429 10.8429 10.8471 10.8471 10.9127 10.9127 10.9163 10.9163 10.9351 10.9351 11.1482 11.1482 11.7477 11.7477 12.7148 12.7148 12.7212 12.7212 12.7381 12.7381 14.1997 14.1997 14.2549 14.2549 14.2726 14.2726 14.4891 14.4891 k = 0.0000 0.0690-0.0000 ( 5642 PWs) bands (ev): -5.6005 -5.6005 -3.5023 -3.5023 -3.4564 -3.4564 -3.4557 -3.4557 -1.1389 -1.1389 -1.1334 -1.1334 -1.1260 -1.1260 0.2804 0.2804 4.5752 4.5752 4.6187 4.6187 4.6302 4.6302 5.3028 5.3028 5.3702 5.3702 5.4743 5.4743 5.9667 5.9667 6.2697 6.2697 6.3410 6.3410 6.3694 6.3694 6.5076 6.5076 6.5986 6.5986 7.4251 7.4251 7.4491 7.4491 7.5123 7.5123 7.7428 7.7428 7.8104 7.8104 8.6807 8.6807 8.7175 8.7175 8.8464 8.8464 10.1529 10.1529 10.2024 10.2024 10.2204 10.2204 10.6803 10.6803 10.7023 10.7023 10.8347 10.8347 10.8411 10.8411 10.8487 10.8487 10.9085 10.9085 10.9153 10.9153 10.9363 10.9363 11.1494 11.1494 11.7728 11.7728 12.7110 12.7110 12.7219 12.7219 12.7394 12.7394 14.1822 14.1822 14.2317 14.2317 14.2632 14.2632 14.4910 14.4910 k = 0.0000 0.0862-0.0000 ( 5638 PWs) bands (ev): -5.5905 -5.5905 -3.5252 -3.5252 -3.4540 -3.4540 -3.4531 -3.4531 -1.1348 -1.1348 -1.1289 -1.1289 -1.1175 -1.1175 0.2634 0.2634 4.5465 4.5465 4.6087 4.6087 4.6256 4.6256 5.2662 5.2662 5.3620 5.3620 5.5202 5.5202 5.9000 5.9000 6.2885 6.2885 6.3680 6.3680 6.3957 6.3957 6.4887 6.4887 6.6818 6.6818 7.4124 7.4124 7.4488 7.4488 7.5467 7.5467 7.7172 7.7172 7.8145 7.8145 8.6666 8.6666 8.7038 8.7038 8.8999 8.8999 10.1531 10.1531 10.2186 10.2186 10.2403 10.2403 10.6696 10.6696 10.7039 10.7039 10.8282 10.8282 10.8386 10.8386 10.8505 10.8505 10.9031 10.9031 10.9145 10.9145 10.9388 10.9388 11.1508 11.1508 11.8040 11.8040 12.7058 12.7058 12.7221 12.7221 12.7424 12.7424 14.1600 14.1600 14.2042 14.2042 14.2528 14.2528 14.4924 14.4924 k = 0.0000 0.1034-0.0000 ( 5626 PWs) bands (ev): -5.5783 -5.5783 -3.5526 -3.5526 -3.4511 -3.4511 -3.4500 -3.4500 -1.1301 -1.1301 -1.1234 -1.1234 -1.1075 -1.1075 0.2430 0.2430 4.5154 4.5154 4.5964 4.5964 4.6190 4.6190 5.2278 5.2278 5.3514 5.3514 5.5729 5.5729 5.8368 5.8368 6.3103 6.3103 6.3957 6.3957 6.4254 6.4254 6.4675 6.4675 6.7651 6.7651 7.3971 7.3971 7.4494 7.4494 7.5891 7.5891 7.6915 7.6915 7.8195 7.8195 8.6489 8.6489 8.6884 8.6884 8.9588 8.9588 10.1521 10.1521 10.2387 10.2387 10.2640 10.2640 10.6568 10.6568 10.7057 10.7057 10.8196 10.8196 10.8352 10.8352 10.8526 10.8526 10.8966 10.8966 10.9143 10.9143 10.9429 10.9429 11.1526 11.1526 11.8405 11.8405 12.6993 12.6993 12.7220 12.7220 12.7474 12.7474 14.1334 14.1334 14.1735 14.1735 14.2418 14.2418 14.4931 14.4931 k = 0.0000 0.1207-0.0000 ( 5618 PWs) bands (ev): -5.5640 -5.5640 -3.5842 -3.5842 -3.4477 -3.4477 -3.4463 -3.4463 -1.1248 -1.1248 -1.1166 -1.1166 -1.0962 -1.0962 0.2194 0.2194 4.4831 4.4831 4.5818 4.5818 4.6097 4.6097 5.1899 5.1899 5.3381 5.3381 5.6316 5.6316 5.7775 5.7775 6.3346 6.3346 6.4180 6.4180 6.4440 6.4440 6.4635 6.4635 6.8477 6.8477 7.3797 7.3797 7.4517 7.4517 7.6389 7.6389 7.6671 7.6671 7.8254 7.8254 8.6279 8.6279 8.6716 8.6716 9.0202 9.0202 10.1509 10.1509 10.2612 10.2612 10.2911 10.2911 10.6419 10.6419 10.7076 10.7076 10.8086 10.8086 10.8309 10.8309 10.8546 10.8546 10.8893 10.8893 10.9151 10.9151 10.9488 10.9488 11.1546 11.1546 11.8817 11.8817 12.6917 12.6917 12.7219 12.7219 12.7542 12.7542 14.1032 14.1032 14.1410 14.1410 14.2304 14.2304 14.4928 14.4928 k = 0.0000 0.1379-0.0000 ( 5622 PWs) bands (ev): -5.5474 -5.5474 -3.6198 -3.6198 -3.4439 -3.4439 -3.4422 -3.4422 -1.1189 -1.1189 -1.1086 -1.1086 -1.0839 -1.0839 0.1927 0.1927 4.4506 4.4506 4.5649 4.5649 4.5970 4.5970 5.1545 5.1545 5.3217 5.3217 5.6950 5.6950 5.7227 5.7227 6.3605 6.3605 6.4105 6.4105 6.4494 6.4494 6.5025 6.5025 6.9289 6.9289 7.3605 7.3605 7.4565 7.4565 7.6442 7.6442 7.6963 7.6963 7.8322 7.8322 8.6043 8.6043 8.6538 8.6538 9.0817 9.0817 10.1503 10.1503 10.2850 10.2850 10.3212 10.3212 10.6252 10.6252 10.7096 10.7096 10.7951 10.7951 10.8257 10.8257 10.8564 10.8564 10.8814 10.8814 10.9172 10.9172 10.9566 10.9566 11.1568 11.1568 11.9268 11.9268 12.6831 12.6831 12.7222 12.7222 12.7629 12.7629 14.0699 14.0699 14.1076 14.1076 14.2185 14.2185 14.4916 14.4916 k = 0.0000 0.1552-0.0000 ( 5634 PWs) bands (ev): -5.5288 -5.5288 -3.6589 -3.6589 -3.4398 -3.4398 -3.4378 -3.4378 -1.1124 -1.1124 -1.0995 -1.0995 -1.0710 -1.0710 0.1633 0.1633 4.4188 4.4188 4.5457 4.5457 4.5804 4.5804 5.1234 5.1234 5.3019 5.3019 5.6706 5.6706 5.7647 5.7647 6.3810 6.3810 6.3930 6.3930 6.4651 6.4651 6.5466 6.5466 7.0077 7.0077 7.3403 7.3403 7.4649 7.4649 7.6243 7.6243 7.7596 7.7596 7.8401 7.8401 8.5785 8.5785 8.6352 8.6352 9.1411 9.1411 10.1506 10.1506 10.3092 10.3092 10.3539 10.3539 10.6074 10.6074 10.7112 10.7112 10.7790 10.7790 10.8200 10.8200 10.8577 10.8577 10.8735 10.8735 10.9208 10.9208 10.9664 10.9664 11.1591 11.1591 11.9751 11.9751 12.6736 12.6736 12.7232 12.7232 12.7735 12.7735 14.0344 14.0344 14.0742 14.0742 14.2063 14.2063 14.4888 14.4888 k = 0.0000 0.1724-0.0000 ( 5634 PWs) bands (ev): -5.5080 -5.5080 -3.7013 -3.7013 -3.4352 -3.4352 -3.4329 -3.4329 -1.1053 -1.1053 -1.0892 -1.0892 -1.0575 -1.0575 0.1312 0.1312 4.3882 4.3882 4.5243 4.5243 4.5596 4.5596 5.0976 5.0976 5.2782 5.2782 5.6239 5.6239 5.8376 5.8376 6.3602 6.3602 6.4163 6.4163 6.4781 6.4781 6.5931 6.5931 7.0828 7.0828 7.3197 7.3197 7.4787 7.4787 7.6072 7.6072 7.8267 7.8267 7.8506 7.8506 8.5509 8.5509 8.6159 8.6159 9.1961 9.1961 10.1523 10.1523 10.3332 10.3332 10.3884 10.3884 10.5893 10.5893 10.7116 10.7116 10.7613 10.7613 10.8140 10.8140 10.8572 10.8572 10.8670 10.8670 10.9258 10.9258 10.9783 10.9783 11.1616 11.1616 12.0258 12.0258 12.6635 12.6635 12.7252 12.7252 12.7862 12.7862 13.9982 13.9982 14.0412 14.0412 14.1938 14.1938 14.4560 14.4560 k = 0.0000 0.1897-0.0000 ( 5650 PWs) bands (ev): -5.4850 -5.4850 -3.7467 -3.7467 -3.4304 -3.4304 -3.4277 -3.4277 -1.0978 -1.0978 -1.0777 -1.0777 -1.0439 -1.0439 0.0969 0.0969 4.3595 4.3595 4.5010 4.5010 4.5345 4.5345 5.0779 5.0779 5.2506 5.2506 5.5814 5.5814 5.9147 5.9147 6.3372 6.3372 6.4424 6.4424 6.4877 6.4877 6.6403 6.6403 7.1526 7.1526 7.2997 7.2997 7.4997 7.4997 7.5930 7.5930 7.8560 7.8560 7.9042 7.9042 8.5219 8.5219 8.5959 8.5959 9.2445 9.2445 10.1554 10.1554 10.3563 10.3563 10.4241 10.4241 10.5718 10.5718 10.7082 10.7082 10.7446 10.7446 10.8079 10.8079 10.8520 10.8520 10.8646 10.8646 10.9323 10.9323 10.9922 10.9922 11.1640 11.1640 12.0783 12.0783 12.6530 12.6530 12.7285 12.7285 12.8011 12.8011 13.9626 13.9626 14.0085 14.0085 14.1812 14.1812 14.3533 14.3533 k = 0.0000 0.2069-0.0000 ( 5654 PWs) bands (ev): -5.4600 -5.4600 -3.7947 -3.7947 -3.4254 -3.4254 -3.4224 -3.4224 -1.0897 -1.0897 -1.0650 -1.0650 -1.0303 -1.0303 0.0605 0.0605 4.3331 4.3331 4.4758 4.4758 4.5057 4.5057 5.0643 5.0643 5.2189 5.2189 5.5432 5.5432 5.9955 5.9955 6.3165 6.3165 6.4669 6.4669 6.4940 6.4940 6.6864 6.6864 7.2152 7.2152 7.2818 7.2818 7.5294 7.5294 7.5823 7.5823 7.8669 7.8669 7.9807 7.9807 8.4919 8.4919 8.5755 8.5755 9.2839 9.2839 10.1601 10.1601 10.3782 10.3782 10.4605 10.4605 10.5562 10.5562 10.6951 10.6951 10.7350 10.7350 10.8021 10.8021 10.8439 10.8439 10.8648 10.8648 10.9401 10.9401 11.0079 11.0079 11.1664 11.1664 12.1320 12.1320 12.6423 12.6423 12.7333 12.7333 12.8184 12.8184 13.9289 13.9289 13.9763 13.9763 14.1677 14.1677 14.2475 14.2475 k = 0.0000 0.2241-0.0000 ( 5662 PWs) bands (ev): -5.4330 -5.4330 -3.8449 -3.8449 -3.4201 -3.4201 -3.4168 -3.4168 -1.0811 -1.0811 -1.0511 -1.0511 -1.0170 -1.0170 0.0223 0.0223 4.3093 4.3093 4.4492 4.4492 4.4738 4.4738 5.0565 5.0565 5.1831 5.1831 5.5091 5.5091 6.0798 6.0798 6.2990 6.2990 6.4884 6.4884 6.4979 6.4979 6.7293 6.7293 7.2625 7.2625 7.2749 7.2749 7.5585 7.5585 7.5856 7.5856 7.8781 7.8781 8.0599 8.0599 8.4612 8.4612 8.5547 8.5547 9.3123 9.3123 10.1663 10.1663 10.3984 10.3984 10.4968 10.4968 10.5437 10.5437 10.6722 10.6722 10.7327 10.7327 10.7970 10.7970 10.8352 10.8352 10.8656 10.8656 10.9493 10.9493 11.0250 11.0250 11.1687 11.1687 12.1864 12.1864 12.6317 12.6317 12.7400 12.7400 12.8384 12.8384 13.8980 13.8980 13.9448 13.9448 14.1308 14.1308 14.1640 14.1640 k = 0.0000 0.2414-0.0000 ( 5654 PWs) bands (ev): -5.4038 -5.4038 -3.8971 -3.8971 -3.4147 -3.4147 -3.4111 -3.4111 -1.0722 -1.0722 -1.0359 -1.0359 -1.0042 -1.0042 -0.0173 -0.0173 4.2885 4.2885 4.4213 4.4213 4.4400 4.4400 5.0538 5.0538 5.1434 5.1434 5.4788 5.4788 6.1671 6.1671 6.2853 6.2853 6.4975 6.4975 6.5083 6.5083 6.7664 6.7664 7.2577 7.2577 7.3185 7.3185 7.5581 7.5581 7.6313 7.6313 7.8900 7.8900 8.1403 8.1403 8.4299 8.4299 8.5336 8.5336 9.3276 9.3276 10.1740 10.1740 10.4166 10.4166 10.5315 10.5315 10.5365 10.5365 10.6450 10.6450 10.7330 10.7330 10.7928 10.7928 10.8265 10.8265 10.8664 10.8664 10.9597 10.9597 11.0433 11.0433 11.1707 11.1707 12.2410 12.2410 12.6215 12.6215 12.7487 12.7487 12.8612 12.8612 13.8709 13.8709 13.9141 13.9141 14.0269 14.0269 14.1474 14.1474 k = 0.0000 0.2586-0.0000 ( 5654 PWs) bands (ev): -5.3727 -5.3727 -3.9510 -3.9510 -3.4092 -3.4092 -3.4054 -3.4054 -1.0629 -1.0629 -1.0194 -1.0194 -0.9920 -0.9920 -0.0583 -0.0583 4.2709 4.2709 4.3927 4.3927 4.4051 4.4051 5.0554 5.0554 5.1002 5.1002 5.4521 5.4521 6.2571 6.2571 6.2757 6.2757 6.4967 6.4967 6.5226 6.5226 6.7950 6.7950 7.2581 7.2581 7.3603 7.3603 7.5526 7.5526 7.6927 7.6927 7.9027 7.9027 8.2205 8.2205 8.3984 8.3984 8.5123 8.5123 9.3281 9.3281 10.1826 10.1826 10.4324 10.4324 10.5322 10.5322 10.5656 10.5656 10.6177 10.6177 10.7337 10.7337 10.7896 10.7896 10.8184 10.8184 10.8673 10.8673 10.9714 10.9714 11.0622 11.0622 11.1721 11.1721 12.2953 12.2953 12.6118 12.6118 12.7595 12.7595 12.8869 12.8869 13.8476 13.8476 13.8830 13.8830 13.9212 13.9212 14.1353 14.1353 k = 0.0000 0.2759-0.0000 ( 5638 PWs) bands (ev): -5.3397 -5.3397 -4.0063 -4.0063 -3.4037 -3.4037 -3.3997 -3.3997 -1.0534 -1.0534 -1.0017 -1.0017 -0.9806 -0.9806 -0.1002 -0.1002 4.2567 4.2567 4.3633 4.3633 4.3704 4.3704 5.0524 5.0524 5.0620 5.0620 5.4285 5.4285 6.2702 6.2702 6.3493 6.3493 6.4940 6.4940 6.5331 6.5331 6.8126 6.8126 7.2693 7.2693 7.3994 7.3994 7.5475 7.5475 7.7614 7.7614 7.9162 7.9162 8.2983 8.2983 8.3677 8.3677 8.4908 8.4908 9.3132 9.3132 10.1920 10.1920 10.4447 10.4447 10.5326 10.5326 10.5793 10.5793 10.6101 10.6101 10.7341 10.7341 10.7873 10.7873 10.8115 10.8115 10.8685 10.8685 10.9842 10.9842 11.0813 11.0813 11.1730 11.1730 12.3489 12.3489 12.6031 12.6031 12.7725 12.7725 12.9159 12.9159 13.8030 13.8030 13.8352 13.8352 13.8605 13.8605 14.1240 14.1240 k = 0.0000 0.2931-0.0000 ( 5634 PWs) bands (ev): -5.3046 -5.3046 -4.0628 -4.0628 -3.3983 -3.3983 -3.3942 -3.3942 -1.0437 -1.0437 -0.9829 -0.9829 -0.9699 -0.9699 -0.1429 -0.1429 4.2460 4.2460 4.3329 4.3329 4.3375 4.3375 5.0044 5.0044 5.0693 5.0693 5.4077 5.4077 6.2689 6.2689 6.4425 6.4425 6.4900 6.4900 6.5399 6.5399 6.8187 6.8187 7.2923 7.2923 7.4376 7.4376 7.5429 7.5429 7.8345 7.8345 7.9305 7.9305 8.3291 8.3291 8.3814 8.3814 8.4692 8.4692 9.2829 9.2829 10.2017 10.2017 10.4511 10.4511 10.5296 10.5296 10.5695 10.5695 10.6356 10.6356 10.7338 10.7338 10.7857 10.7857 10.8072 10.8072 10.8700 10.8700 10.9980 10.9980 11.1001 11.1001 11.1731 11.1731 12.4017 12.4017 12.5956 12.5956 12.7875 12.7875 12.9481 12.9481 13.7002 13.7002 13.8205 13.8205 13.8334 13.8334 14.1132 14.1132 k = 0.0000 0.3103-0.0000 ( 5642 PWs) bands (ev): -5.2678 -5.2678 -4.1201 -4.1201 -3.3929 -3.3929 -3.3888 -3.3888 -1.0338 -1.0338 -0.9645 -0.9645 -0.9585 -0.9585 -0.1862 -0.1862 4.2391 4.2391 4.3011 4.3011 4.3078 4.3078 4.9535 4.9535 5.0797 5.0797 5.3893 5.3893 6.2715 6.2715 6.4852 6.4852 6.5285 6.5285 6.5503 6.5503 6.8148 6.8148 7.3261 7.3261 7.4759 7.4759 7.5387 7.5387 7.9093 7.9093 7.9465 7.9465 8.2987 8.2987 8.4472 8.4472 8.4528 8.4528 9.2379 9.2379 10.2113 10.2113 10.4454 10.4454 10.5207 10.5207 10.5763 10.5763 10.6611 10.6611 10.7326 10.7326 10.7842 10.7842 10.8064 10.8064 10.8720 10.8720 11.0128 11.0128 11.1180 11.1180 11.1721 11.1721 12.4531 12.4531 12.5897 12.5897 12.8043 12.8043 12.9837 12.9837 13.5963 13.5963 13.8093 13.8093 13.8134 13.8134 14.1028 14.1028 k = 0.0000 0.3276-0.0000 ( 5638 PWs) bands (ev): -5.2290 -5.2290 -4.1781 -4.1781 -3.3877 -3.3877 -3.3836 -3.3836 -1.0239 -1.0239 -0.9540 -0.9540 -0.9391 -0.9391 -0.2297 -0.2297 4.2359 4.2359 4.2703 4.2703 4.2799 4.2799 4.9012 4.9012 5.0921 5.0921 5.3729 5.3729 6.2779 6.2779 6.4800 6.4800 6.5385 6.5385 6.6305 6.6305 6.8051 6.8051 7.3690 7.3690 7.5136 7.5136 7.5357 7.5357 7.9573 7.9573 7.9914 7.9914 8.2662 8.2662 8.4261 8.4261 8.5203 8.5203 9.1796 9.1796 10.2204 10.2204 10.4244 10.4244 10.5191 10.5191 10.5935 10.5935 10.6802 10.6802 10.7325 10.7325 10.7835 10.7835 10.8094 10.8094 10.8751 10.8751 11.0283 11.0283 11.1347 11.1347 11.1700 11.1700 12.5030 12.5030 12.5861 12.5861 12.8225 12.8225 13.0227 13.0227 13.4948 13.4948 13.7883 13.7883 13.8114 13.8114 14.0927 14.0927 k = 0.0000 0.3448-0.0000 ( 5638 PWs) bands (ev): -5.1885 -5.1885 -4.2365 -4.2365 -3.3828 -3.3828 -3.3788 -3.3788 -1.0140 -1.0140 -0.9468 -0.9468 -0.9161 -0.9161 -0.2733 -0.2733 4.2353 4.2353 4.2430 4.2430 4.2535 4.2535 4.8482 4.8482 5.1058 5.1058 5.3581 5.3581 6.2877 6.2877 6.4746 6.4746 6.5350 6.5350 6.7057 6.7057 6.8041 6.8041 7.4189 7.4189 7.5263 7.5263 7.5579 7.5579 7.9744 7.9744 8.0682 8.0682 8.2332 8.2332 8.4049 8.4049 8.5822 8.5822 9.1097 9.1097 10.2285 10.2285 10.3947 10.3947 10.5240 10.5240 10.6152 10.6152 10.6884 10.6884 10.7369 10.7369 10.7839 10.7839 10.8155 10.8155 10.8799 10.8799 11.0444 11.0444 11.1497 11.1497 11.1665 11.1665 12.5500 12.5500 12.5862 12.5862 12.8415 12.8415 13.0650 13.0650 13.3964 13.3964 13.7705 13.7705 13.8144 13.8144 14.0827 14.0827 k = 0.0000 0.3621-0.0000 ( 5638 PWs) bands (ev): -5.1462 -5.1462 -4.2952 -4.2952 -3.3781 -3.3781 -3.3743 -3.3743 -1.0043 -1.0043 -0.9412 -0.9412 -0.8915 -0.8915 -0.3169 -0.3169 4.2145 4.2145 4.2286 4.2286 4.2424 4.2424 4.7951 4.7951 5.1206 5.1206 5.3444 5.3444 6.3007 6.3007 6.4695 6.4695 6.5288 6.5288 6.7240 6.7240 6.8542 6.8542 7.4745 7.4745 7.5211 7.5211 7.5978 7.5978 7.9907 7.9907 8.1460 8.1460 8.1999 8.1999 8.3840 8.3840 8.6364 8.6364 9.0302 9.0302 10.2351 10.2351 10.3627 10.3627 10.5312 10.5312 10.6391 10.6391 10.6857 10.6857 10.7461 10.7461 10.7854 10.7854 10.8230 10.8230 10.8874 10.8874 11.0609 11.0609 11.1607 11.1607 11.1635 11.1635 12.5789 12.5789 12.6056 12.6056 12.8604 12.8604 13.1106 13.1106 13.3020 13.3020 13.7562 13.7562 13.8219 13.8219 14.0727 14.0727 k = 0.0000 0.3793-0.0000 ( 5638 PWs) bands (ev): -5.1023 -5.1023 -4.3539 -4.3539 -3.3738 -3.3738 -3.3702 -3.3702 -0.9948 -0.9948 -0.9369 -0.9369 -0.8654 -0.8654 -0.3601 -0.3601 4.1912 4.1912 4.2057 4.2057 4.2510 4.2510 4.7424 4.7424 5.1361 5.1361 5.3317 5.3317 6.3166 6.3166 6.4648 6.4648 6.5209 6.5209 6.7049 6.7049 6.9357 6.9357 7.5133 7.5133 7.5357 7.5357 7.6388 7.6388 8.0069 8.0069 8.1661 8.1661 8.2232 8.2232 8.3639 8.3639 8.6815 8.6815 8.9430 8.9430 10.2400 10.2400 10.3317 10.3317 10.5390 10.5390 10.6628 10.6628 10.6780 10.6780 10.7559 10.7559 10.7878 10.7878 10.8302 10.8302 10.8988 10.8988 11.0771 11.0771 11.1547 11.1547 11.1736 11.1736 12.5862 12.5862 12.6479 12.6479 12.8781 12.8781 13.1592 13.1592 13.2123 13.2123 13.7459 13.7459 13.8332 13.8332 14.0623 14.0623 k = 0.0000 0.3966-0.0000 ( 5630 PWs) bands (ev): -5.0567 -5.0567 -4.4125 -4.4125 -3.3699 -3.3699 -3.3666 -3.3666 -0.9856 -0.9856 -0.9339 -0.9339 -0.8378 -0.8378 -0.4029 -0.4029 4.1710 4.1710 4.1851 4.1851 4.2638 4.2638 4.6906 4.6906 5.1520 5.1520 5.3194 5.3194 6.3352 6.3352 6.4610 6.4610 6.5120 6.5120 6.6774 6.6774 7.0192 7.0192 7.5041 7.5041 7.6012 7.6012 7.6800 7.6800 8.0229 8.0229 8.1322 8.1322 8.2974 8.2974 8.3460 8.3460 8.7161 8.7161 8.8499 8.8499 10.2430 10.2430 10.3036 10.3036 10.5470 10.5470 10.6648 10.6648 10.6893 10.6893 10.7643 10.7643 10.7906 10.7906 10.8353 10.8353 10.9144 10.9144 11.0925 11.0925 11.1470 11.1470 11.1819 11.1819 12.5947 12.5947 12.6906 12.6906 12.8934 12.8934 13.1269 13.1269 13.2117 13.2117 13.7393 13.7393 13.8477 13.8477 14.0425 14.0425 k = 0.0000 0.4138-0.0000 ( 5646 PWs) bands (ev): -5.0096 -5.0096 -4.4708 -4.4708 -3.3664 -3.3664 -3.3636 -3.3636 -0.9768 -0.9768 -0.9323 -0.9323 -0.8087 -0.8087 -0.4451 -0.4451 4.1538 4.1538 4.1668 4.1668 4.2805 4.2805 4.6401 4.6401 5.1680 5.1680 5.3075 5.3075 6.3562 6.3562 6.4581 6.4581 6.5026 6.5026 6.6470 6.6470 7.0982 7.0982 7.4922 7.4922 7.6718 7.6718 7.7211 7.7211 8.0382 8.0382 8.0979 8.0979 8.3223 8.3223 8.3763 8.3763 8.7360 8.7360 8.7561 8.7561 10.2441 10.2441 10.2797 10.2797 10.5549 10.5549 10.6532 10.6532 10.7116 10.7116 10.7708 10.7708 10.7939 10.7939 10.8378 10.8378 10.9334 10.9334 11.1049 11.1049 11.1395 11.1395 11.1876 11.1876 12.6070 12.6070 12.7312 12.7312 12.9052 12.9052 13.0477 13.0477 13.2666 13.2666 13.7351 13.7351 13.8646 13.8646 13.9883 13.9883 k = 0.0000 0.4310-0.0000 ( 5642 PWs) bands (ev): -4.9610 -4.9610 -4.5287 -4.5287 -3.3634 -3.3634 -3.3611 -3.3611 -0.9686 -0.9686 -0.9320 -0.9320 -0.7782 -0.7782 -0.4865 -0.4865 4.1401 4.1401 4.1513 4.1513 4.3012 4.3012 4.5913 4.5913 5.1839 5.1839 5.2955 5.2955 6.3793 6.3793 6.4564 6.4564 6.4933 6.4933 6.6154 6.6154 7.1702 7.1702 7.4775 7.4775 7.7468 7.7468 7.7621 7.7621 8.0520 8.0520 8.0631 8.0631 8.3074 8.3074 8.4453 8.4453 8.6526 8.6526 8.7516 8.7516 10.2434 10.2434 10.2608 10.2608 10.5628 10.5628 10.6412 10.6412 10.7322 10.7322 10.7757 10.7757 10.7975 10.7975 10.8381 10.8381 10.9545 10.9545 11.1076 11.1076 11.1388 11.1388 11.1908 11.1908 12.6239 12.6239 12.7692 12.7692 12.9123 12.9123 12.9745 12.9745 13.3242 13.3242 13.7293 13.7293 13.8833 13.8833 13.9402 13.9402 k = 0.0000 0.4483-0.0000 ( 5654 PWs) bands (ev): -4.9109 -4.9109 -4.5860 -4.5860 -3.3610 -3.3610 -3.3592 -3.3592 -0.9609 -0.9609 -0.9329 -0.9329 -0.7463 -0.7463 -0.5271 -0.5271 4.1297 4.1297 4.1386 4.1386 4.3257 4.3257 4.5448 4.5448 5.1996 5.1996 5.2833 5.2833 6.4044 6.4044 6.4560 6.4560 6.4844 6.4844 6.5834 6.5834 7.2341 7.2341 7.4592 7.4592 7.8013 7.8013 7.8263 7.8263 8.0279 8.0279 8.0626 8.0626 8.2950 8.2950 8.5108 8.5108 8.5555 8.5555 8.7497 8.7497 10.2412 10.2412 10.2472 10.2472 10.5709 10.5709 10.6293 10.6293 10.7497 10.7497 10.7789 10.7789 10.8018 10.8018 10.8363 10.8363 10.9767 10.9767 11.0976 11.0976 11.1476 11.1476 11.1912 11.1912 12.6458 12.6458 12.8039 12.8039 12.9073 12.9073 12.9144 12.9144 13.3841 13.3841 13.7134 13.7134 13.9028 13.9028 13.9081 13.9081 k = 0.0000 0.4655-0.0000 ( 5654 PWs) bands (ev): -4.8596 -4.8596 -4.6426 -4.6426 -3.3591 -3.3591 -3.3579 -3.3579 -0.9539 -0.9539 -0.9350 -0.9350 -0.7130 -0.7130 -0.5666 -0.5666 4.1227 4.1227 4.1289 4.1289 4.3539 4.3539 4.5006 4.5006 5.2149 5.2149 5.2707 5.2707 6.4310 6.4310 6.4571 6.4571 6.4765 6.4765 6.5515 6.5515 7.2894 7.2894 7.4368 7.4368 7.8409 7.8409 7.9043 7.9043 7.9924 7.9924 8.0672 8.0672 8.2890 8.2890 8.4617 8.4617 8.5728 8.5728 8.7356 8.7356 10.2378 10.2378 10.2391 10.2391 10.5793 10.5793 10.6179 10.6179 10.7635 10.7635 10.7806 10.7806 10.8070 10.8070 10.8326 10.8326 10.9993 10.9993 11.0819 11.0819 11.1587 11.1587 11.1892 11.1892 12.6735 12.6735 12.8345 12.8345 12.8478 12.8478 12.9098 12.9098 13.4459 13.4459 13.6792 13.6792 13.9001 13.9001 13.9227 13.9227 k = 0.0000 0.4828-0.0000 ( 5646 PWs) bands (ev): -4.8070 -4.8070 -4.6984 -4.6984 -3.3579 -3.3579 -3.3573 -3.3573 -0.9478 -0.9478 -0.9382 -0.9382 -0.6783 -0.6783 -0.6051 -0.6051 4.1192 4.1192 4.1224 4.1224 4.3857 4.3857 4.4592 4.4592 5.2298 5.2298 5.2576 5.2576 6.4576 6.4576 6.4609 6.4609 6.4701 6.4701 6.5201 6.5201 7.3366 7.3366 7.4094 7.4094 7.8795 7.8795 7.9526 7.9526 7.9792 7.9792 8.0597 8.0597 8.2956 8.2956 8.3818 8.3818 8.6269 8.6269 8.7096 8.7096 10.2343 10.2343 10.2356 10.2356 10.5880 10.5880 10.6073 10.6073 10.7729 10.7729 10.7805 10.7805 10.8134 10.8134 10.8272 10.8272 11.0216 11.0216 11.0635 11.0635 11.1691 11.1691 11.1847 11.1847 12.7071 12.7071 12.7939 12.7939 12.8616 12.8616 12.8995 12.8995 13.5084 13.5084 13.6290 13.6290 13.9141 13.9141 13.9408 13.9408 k = 0.0000 0.5000-0.0000 ( 5622 PWs) bands (ev): -4.7532 -4.7532 -4.7532 -4.7532 -3.3573 -3.3573 -3.3573 -3.3573 -0.9425 -0.9425 -0.9425 -0.9425 -0.6423 -0.6423 -0.6423 -0.6423 4.1191 4.1191 4.1191 4.1191 4.4209 4.4209 4.4209 4.4209 5.2440 5.2440 5.2440 5.2440 6.4635 6.4635 6.4635 6.4635 6.4897 6.4897 6.4897 6.4897 7.3764 7.3764 7.3764 7.3764 7.9173 7.9173 7.9173 7.9173 8.0313 8.0313 8.0313 8.0313 8.3245 8.3245 8.3245 8.3245 8.6730 8.6730 8.6730 8.6730 10.2338 10.2338 10.2338 10.2338 10.5974 10.5974 10.5974 10.5974 10.7782 10.7782 10.7782 10.7782 10.8207 10.8207 10.8207 10.8207 11.0433 11.0433 11.0433 11.0433 11.1780 11.1780 11.1780 11.1780 12.7472 12.7472 12.7472 12.7472 12.8833 12.8833 12.8833 12.8833 13.5704 13.5704 13.5704 13.5704 13.9391 13.9391 13.9391 13.9391 k = 0.0000 0.5000-0.0000 ( 5622 PWs) bands (ev): -4.7532 -4.7532 -4.7532 -4.7532 -3.3573 -3.3573 -3.3573 -3.3573 -0.9425 -0.9425 -0.9425 -0.9425 -0.6423 -0.6423 -0.6423 -0.6423 4.1191 4.1191 4.1191 4.1191 4.4209 4.4209 4.4209 4.4209 5.2440 5.2440 5.2440 5.2440 6.4635 6.4635 6.4635 6.4635 6.4897 6.4897 6.4897 6.4897 7.3764 7.3764 7.3764 7.3764 7.9173 7.9173 7.9173 7.9173 8.0313 8.0313 8.0313 8.0313 8.3245 8.3245 8.3245 8.3245 8.6730 8.6730 8.6730 8.6730 10.2338 10.2338 10.2338 10.2338 10.5974 10.5974 10.5974 10.5974 10.7782 10.7782 10.7782 10.7782 10.8207 10.8207 10.8207 10.8207 11.0433 11.0433 11.0433 11.0433 11.1780 11.1780 11.1780 11.1780 12.7472 12.7472 12.7472 12.7472 12.8833 12.8833 12.8833 12.8833 13.5704 13.5704 13.5704 13.5704 13.9391 13.9391 13.9391 13.9391 k = 0.0172 0.5000-0.0000 ( 5654 PWs) bands (ev): -4.7522 -4.7522 -4.7522 -4.7522 -3.3582 -3.3582 -3.3582 -3.3582 -0.9425 -0.9425 -0.9425 -0.9425 -0.6434 -0.6434 -0.6434 -0.6434 4.1221 4.1221 4.1221 4.1221 4.4196 4.4196 4.4196 4.4196 5.2392 5.2392 5.2392 5.2392 6.4694 6.4694 6.4694 6.4694 6.4887 6.4887 6.4887 6.4887 7.3763 7.3763 7.3763 7.3763 7.9162 7.9162 7.9162 7.9162 8.0263 8.0263 8.0263 8.0263 8.3338 8.3338 8.3338 8.3338 8.6732 8.6732 8.6732 8.6732 10.2332 10.2332 10.2332 10.2332 10.5976 10.5976 10.5976 10.5976 10.7766 10.7766 10.7766 10.7766 10.8202 10.8202 10.8202 10.8202 11.0431 11.0431 11.0431 11.0431 11.1776 11.1776 11.1776 11.1776 12.7468 12.7468 12.7468 12.7468 12.8827 12.8827 12.8827 12.8827 13.5708 13.5708 13.5708 13.5708 13.9390 13.9390 13.9390 13.9390 k = 0.0345 0.5000-0.0000 ( 5654 PWs) bands (ev): -4.7494 -4.7494 -4.7494 -4.7494 -3.3611 -3.3611 -3.3611 -3.3611 -0.9423 -0.9423 -0.9423 -0.9423 -0.6465 -0.6465 -0.6465 -0.6465 4.1312 4.1312 4.1312 4.1312 4.4161 4.4161 4.4161 4.4161 5.2251 5.2251 5.2251 5.2251 6.4819 6.4819 6.4819 6.4819 6.4911 6.4911 6.4911 6.4911 7.3761 7.3761 7.3761 7.3761 7.9127 7.9127 7.9127 7.9127 8.0133 8.0133 8.0133 8.0133 8.3599 8.3599 8.3599 8.3599 8.6739 8.6739 8.6739 8.6739 10.2314 10.2314 10.2314 10.2314 10.5984 10.5984 10.5984 10.5984 10.7716 10.7716 10.7716 10.7716 10.8192 10.8192 10.8192 10.8192 11.0427 11.0427 11.0427 11.0427 11.1768 11.1768 11.1768 11.1768 12.7456 12.7456 12.7456 12.7456 12.8812 12.8812 12.8812 12.8812 13.5722 13.5722 13.5722 13.5722 13.9364 13.9364 13.9364 13.9364 k = 0.0517 0.5000-0.0000 ( 5646 PWs) bands (ev): -4.7447 -4.7447 -4.7447 -4.7447 -3.3658 -3.3658 -3.3658 -3.3658 -0.9421 -0.9421 -0.9421 -0.9421 -0.6516 -0.6516 -0.6516 -0.6516 4.1460 4.1460 4.1460 4.1460 4.4102 4.4102 4.4102 4.4102 5.2029 5.2029 5.2029 5.2029 6.4781 6.4781 6.4781 6.4781 6.5187 6.5187 6.5187 6.5187 7.3757 7.3757 7.3757 7.3757 7.9071 7.9071 7.9071 7.9071 7.9957 7.9957 7.9957 7.9957 8.3988 8.3988 8.3988 8.3988 8.6751 8.6751 8.6751 8.6751 10.2285 10.2285 10.2285 10.2285 10.5998 10.5998 10.5998 10.5998 10.7633 10.7633 10.7633 10.7633 10.8176 10.8176 10.8176 10.8176 11.0422 11.0422 11.0422 11.0422 11.1755 11.1755 11.1755 11.1755 12.7437 12.7437 12.7437 12.7437 12.8788 12.8788 12.8788 12.8788 13.5743 13.5743 13.5743 13.5743 13.9251 13.9251 13.9251 13.9251 k = 0.0690 0.5000-0.0000 ( 5650 PWs) bands (ev): -4.7381 -4.7381 -4.7381 -4.7381 -3.3724 -3.3724 -3.3724 -3.3724 -0.9418 -0.9418 -0.9418 -0.9418 -0.6585 -0.6585 -0.6585 -0.6585 4.1662 4.1662 4.1662 4.1662 4.4021 4.4021 4.4021 4.4021 5.1741 5.1741 5.1741 5.1741 6.4706 6.4706 6.4706 6.4706 6.5577 6.5577 6.5577 6.5577 7.3753 7.3753 7.3753 7.3753 7.8993 7.8993 7.8993 7.8993 7.9765 7.9765 7.9765 7.9765 8.4471 8.4471 8.4471 8.4471 8.6766 8.6766 8.6766 8.6766 10.2245 10.2245 10.2245 10.2245 10.6017 10.6017 10.6017 10.6017 10.7513 10.7513 10.7513 10.7513 10.8156 10.8156 10.8156 10.8156 11.0415 11.0415 11.0415 11.0415 11.1736 11.1736 11.1736 11.1736 12.7411 12.7411 12.7411 12.7411 12.8755 12.8755 12.8755 12.8755 13.5769 13.5769 13.5769 13.5769 13.9044 13.9044 13.9044 13.9044 k = 0.0862 0.5000-0.0000 ( 5650 PWs) bands (ev): -4.7296 -4.7296 -4.7296 -4.7296 -3.3810 -3.3810 -3.3810 -3.3810 -0.9414 -0.9414 -0.9414 -0.9414 -0.6672 -0.6672 -0.6672 -0.6672 4.1913 4.1913 4.1913 4.1913 4.3918 4.3918 4.3918 4.3918 5.1406 5.1406 5.1406 5.1406 6.4613 6.4613 6.4613 6.4613 6.6048 6.6048 6.6048 6.6048 7.3749 7.3749 7.3749 7.3749 7.8896 7.8896 7.8896 7.8896 7.9577 7.9577 7.9577 7.9577 8.5022 8.5022 8.5022 8.5022 8.6783 8.6783 8.6783 8.6783 10.2196 10.2196 10.2196 10.2196 10.6042 10.6042 10.6042 10.6042 10.7360 10.7360 10.7360 10.7360 10.8133 10.8133 10.8133 10.8133 11.0409 11.0409 11.0409 11.0409 11.1712 11.1712 11.1712 11.1712 12.7379 12.7379 12.7379 12.7379 12.8714 12.8714 12.8714 12.8714 13.5796 13.5796 13.5796 13.5796 13.8777 13.8777 13.8777 13.8777 k = 0.1034 0.5000-0.0000 ( 5656 PWs) bands (ev): -4.7193 -4.7193 -4.7193 -4.7193 -3.3914 -3.3914 -3.3914 -3.3914 -0.9409 -0.9409 -0.9409 -0.9409 -0.6775 -0.6775 -0.6775 -0.6775 4.2206 4.2206 4.2206 4.2206 4.3795 4.3795 4.3795 4.3795 5.1043 5.1043 5.1043 5.1043 6.4505 6.4505 6.4505 6.4505 6.6585 6.6585 6.6585 6.6585 7.3745 7.3745 7.3745 7.3745 7.8782 7.8782 7.8782 7.8782 7.9402 7.9402 7.9402 7.9402 8.5619 8.5619 8.5619 8.5619 8.6803 8.6803 8.6803 8.6803 10.2140 10.2140 10.2140 10.2140 10.6074 10.6074 10.6074 10.6074 10.7173 10.7173 10.7173 10.7173 10.8106 10.8106 10.8106 10.8106 11.0404 11.0404 11.0404 11.0404 11.1683 11.1683 11.1683 11.1683 12.7341 12.7341 12.7341 12.7341 12.8666 12.8666 12.8666 12.8666 13.5822 13.5822 13.5822 13.5822 13.8471 13.8471 13.8471 13.8471 k = 0.1207 0.5000-0.0000 ( 5650 PWs) bands (ev): -4.7071 -4.7071 -4.7071 -4.7071 -3.4038 -3.4038 -3.4038 -3.4038 -0.9403 -0.9403 -0.9403 -0.9403 -0.6891 -0.6891 -0.6891 -0.6891 4.2531 4.2531 4.2531 4.2531 4.3653 4.3653 4.3653 4.3653 5.0673 5.0673 5.0673 5.0673 6.4388 6.4388 6.4388 6.4388 6.7170 6.7170 6.7170 6.7170 7.3741 7.3741 7.3741 7.3741 7.8653 7.8653 7.8653 7.8653 7.9244 7.9244 7.9244 7.9244 8.6242 8.6242 8.6242 8.6242 8.6832 8.6832 8.6832 8.6832 10.2080 10.2080 10.2080 10.2080 10.6110 10.6110 10.6110 10.6110 10.6957 10.6957 10.6957 10.6957 10.8077 10.8077 10.8077 10.8077 11.0401 11.0401 11.0401 11.0401 11.1649 11.1649 11.1649 11.1649 12.7299 12.7299 12.7299 12.7299 12.8614 12.8614 12.8614 12.8614 13.5843 13.5843 13.5843 13.5843 13.8141 13.8141 13.8141 13.8141 k = 0.1379 0.5000-0.0000 ( 5654 PWs) bands (ev): -4.6932 -4.6932 -4.6932 -4.6932 -3.4181 -3.4181 -3.4181 -3.4181 -0.9397 -0.9397 -0.9397 -0.9397 -0.7018 -0.7018 -0.7018 -0.7018 4.2872 4.2872 4.2872 4.2872 4.3495 4.3495 4.3495 4.3495 5.0319 5.0319 5.0319 5.0319 6.4264 6.4264 6.4264 6.4264 6.7792 6.7792 6.7792 6.7792 7.3738 7.3738 7.3738 7.3738 7.8512 7.8512 7.8512 7.8512 7.9105 7.9105 7.9105 7.9105 8.6737 8.6737 8.6737 8.6737 8.7008 8.7008 8.7008 8.7008 10.2018 10.2018 10.2018 10.2018 10.6140 10.6140 10.6140 10.6140 10.6727 10.6727 10.6727 10.6727 10.8045 10.8045 10.8045 10.8045 11.0399 11.0399 11.0399 11.0399 11.1611 11.1611 11.1611 11.1611 12.7255 12.7255 12.7255 12.7255 12.8557 12.8557 12.8557 12.8557 13.5855 13.5855 13.5855 13.5855 13.7795 13.7795 13.7795 13.7795 k = 0.1552 0.5000-0.0000 ( 5654 PWs) bands (ev): -4.6774 -4.6774 -4.6774 -4.6774 -3.4342 -3.4342 -3.4342 -3.4342 -0.9391 -0.9391 -0.9391 -0.9391 -0.7153 -0.7153 -0.7153 -0.7153 4.3202 4.3202 4.3202 4.3202 4.3333 4.3333 4.3333 4.3333 5.0003 5.0003 5.0003 5.0003 6.4137 6.4137 6.4137 6.4137 6.8436 6.8436 6.8436 6.8436 7.3735 7.3735 7.3735 7.3735 7.8361 7.8361 7.8361 7.8361 7.8985 7.8985 7.8985 7.8985 8.6807 8.6807 8.6807 8.6807 8.7618 8.7618 8.7618 8.7618 10.1957 10.1957 10.1957 10.1957 10.6124 10.6124 10.6124 10.6124 10.6527 10.6527 10.6527 10.6527 10.8009 10.8009 10.8009 10.8009 11.0400 11.0400 11.0400 11.0400 11.1568 11.1568 11.1568 11.1568 12.7212 12.7212 12.7212 12.7212 12.8499 12.8499 12.8499 12.8499 13.5854 13.5854 13.5854 13.5854 13.7443 13.7443 13.7443 13.7443 k = 0.1724 0.5000-0.0000 ( 5650 PWs) bands (ev): -4.6599 -4.6599 -4.6599 -4.6599 -3.4523 -3.4523 -3.4523 -3.4523 -0.9384 -0.9384 -0.9384 -0.9384 -0.7295 -0.7295 -0.7295 -0.7295 4.3130 4.3130 4.3130 4.3130 4.3534 4.3534 4.3534 4.3534 4.9757 4.9757 4.9757 4.9757 6.4008 6.4008 6.4008 6.4008 6.9094 6.9094 6.9094 6.9094 7.3733 7.3733 7.3733 7.3733 7.8205 7.8205 7.8205 7.8205 7.8883 7.8883 7.8883 7.8883 8.6820 8.6820 8.6820 8.6820 8.8279 8.8279 8.8279 8.8279 10.1899 10.1899 10.1899 10.1899 10.5965 10.5965 10.5965 10.5965 10.6461 10.6461 10.6461 10.6461 10.7970 10.7970 10.7970 10.7970 11.0402 11.0402 11.0402 11.0402 11.1522 11.1522 11.1522 11.1522 12.7170 12.7170 12.7170 12.7170 12.8441 12.8441 12.8441 12.8441 13.5837 13.5837 13.5837 13.5837 13.7089 13.7089 13.7089 13.7089 k = 0.1897 0.5000-0.0000 ( 5646 PWs) bands (ev): -4.6407 -4.6407 -4.6407 -4.6407 -3.4722 -3.4722 -3.4722 -3.4722 -0.9377 -0.9377 -0.9377 -0.9377 -0.7441 -0.7441 -0.7441 -0.7441 4.2936 4.2936 4.2936 4.2936 4.3789 4.3789 4.3789 4.3789 4.9612 4.9612 4.9612 4.9612 6.3880 6.3880 6.3880 6.3880 6.9753 6.9753 6.9753 6.9753 7.3731 7.3731 7.3731 7.3731 7.8046 7.8046 7.8046 7.8046 7.8797 7.8797 7.8797 7.8797 8.6824 8.6824 8.6824 8.6824 8.8933 8.8933 8.8933 8.8933 10.1848 10.1848 10.1848 10.1848 10.5694 10.5694 10.5694 10.5694 10.6505 10.6505 10.6505 10.6505 10.7928 10.7928 10.7928 10.7928 11.0406 11.0406 11.0406 11.0406 11.1473 11.1473 11.1473 11.1473 12.7135 12.7135 12.7135 12.7135 12.8385 12.8385 12.8385 12.8385 13.5802 13.5802 13.5802 13.5802 13.6738 13.6738 13.6738 13.6738 k = 0.2069 0.5000-0.0000 ( 5646 PWs) bands (ev): -4.6198 -4.6198 -4.6198 -4.6198 -3.4940 -3.4940 -3.4940 -3.4940 -0.9370 -0.9370 -0.9370 -0.9370 -0.7588 -0.7588 -0.7588 -0.7588 4.2734 4.2734 4.2734 4.2734 4.3957 4.3957 4.3957 4.3957 4.9601 4.9601 4.9601 4.9601 6.3753 6.3753 6.3753 6.3753 7.0405 7.0405 7.0405 7.0405 7.3728 7.3728 7.3728 7.3728 7.7889 7.7889 7.7889 7.7889 7.8728 7.8728 7.8728 7.8728 8.6822 8.6822 8.6822 8.6822 8.9563 8.9563 8.9563 8.9563 10.1805 10.1805 10.1805 10.1805 10.5389 10.5389 10.5389 10.5389 10.6587 10.6587 10.6587 10.6587 10.7882 10.7882 10.7882 10.7882 11.0410 11.0410 11.0410 11.0410 11.1419 11.1419 11.1419 11.1419 12.7110 12.7110 12.7110 12.7110 12.8335 12.8335 12.8335 12.8335 13.5743 13.5743 13.5743 13.5743 13.6393 13.6393 13.6393 13.6393 k = 0.2241 0.5000-0.0000 ( 5646 PWs) bands (ev): -4.5973 -4.5973 -4.5973 -4.5973 -3.5175 -3.5175 -3.5175 -3.5175 -0.9362 -0.9362 -0.9362 -0.9362 -0.7735 -0.7735 -0.7735 -0.7735 4.2527 4.2527 4.2527 4.2527 4.4015 4.4015 4.4015 4.4015 4.9744 4.9744 4.9744 4.9744 6.3628 6.3628 6.3628 6.3628 7.1040 7.1040 7.1040 7.1040 7.3724 7.3724 7.3724 7.3724 7.7737 7.7737 7.7737 7.7737 7.8673 7.8673 7.8673 7.8673 8.6817 8.6817 8.6817 8.6817 9.0153 9.0153 9.0153 9.0153 10.1775 10.1775 10.1775 10.1775 10.5081 10.5081 10.5081 10.5081 10.6687 10.6687 10.6687 10.6687 10.7834 10.7834 10.7834 10.7834 11.0415 11.0415 11.0415 11.0415 11.1363 11.1363 11.1363 11.1363 12.7097 12.7097 12.7097 12.7097 12.8291 12.8291 12.8291 12.8291 13.5657 13.5657 13.5657 13.5657 13.6060 13.6060 13.6060 13.6060 k = 0.2414 0.5000-0.0000 ( 5660 PWs) bands (ev): -4.5732 -4.5732 -4.5732 -4.5732 -3.5428 -3.5428 -3.5428 -3.5428 -0.9355 -0.9355 -0.9355 -0.9355 -0.7880 -0.7880 -0.7880 -0.7880 4.2319 4.2319 4.2319 4.2319 4.3963 4.3963 4.3963 4.3963 5.0041 5.0041 5.0041 5.0041 6.3505 6.3505 6.3505 6.3505 7.1645 7.1645 7.1645 7.1645 7.3719 7.3719 7.3719 7.3719 7.7599 7.7599 7.7599 7.7599 7.8631 7.8631 7.8631 7.8631 8.6809 8.6809 8.6809 8.6809 9.0689 9.0689 9.0689 9.0689 10.1758 10.1758 10.1758 10.1758 10.4785 10.4785 10.4785 10.4785 10.6797 10.6797 10.6797 10.6797 10.7785 10.7785 10.7785 10.7785 11.0421 11.0421 11.0421 11.0421 11.1304 11.1304 11.1304 11.1304 12.7102 12.7102 12.7102 12.7102 12.8258 12.8258 12.8258 12.8258 13.5526 13.5526 13.5526 13.5526 13.5752 13.5752 13.5752 13.5752 k = 0.2586 0.5000-0.0000 ( 5660 PWs) bands (ev): -4.5475 -4.5475 -4.5475 -4.5475 -3.5698 -3.5698 -3.5698 -3.5698 -0.9348 -0.9348 -0.9348 -0.9348 -0.8021 -0.8021 -0.8021 -0.8021 4.2112 4.2112 4.2112 4.2112 4.3817 4.3817 4.3817 4.3817 5.0474 5.0474 5.0474 5.0474 6.3382 6.3382 6.3382 6.3382 7.2210 7.2210 7.2210 7.2210 7.3712 7.3712 7.3712 7.3712 7.7481 7.7481 7.7481 7.7481 7.8601 7.8601 7.8601 7.8601 8.6803 8.6803 8.6803 8.6803 9.1156 9.1156 9.1156 9.1156 10.1758 10.1758 10.1758 10.1758 10.4515 10.4515 10.4515 10.4515 10.6912 10.6912 10.6912 10.6912 10.7737 10.7737 10.7737 10.7737 11.0427 11.0427 11.0427 11.0427 11.1243 11.1243 11.1243 11.1243 12.7129 12.7129 12.7129 12.7129 12.8237 12.8237 12.8237 12.8237 13.5303 13.5303 13.5303 13.5303 13.5515 13.5515 13.5515 13.5515 k = 0.2759 0.5000-0.0000 ( 5656 PWs) bands (ev): -4.5204 -4.5204 -4.5204 -4.5204 -3.5985 -3.5985 -3.5985 -3.5985 -0.9341 -0.9341 -0.9341 -0.9341 -0.8155 -0.8155 -0.8155 -0.8155 4.1909 4.1909 4.1909 4.1909 4.3603 4.3603 4.3603 4.3603 5.1013 5.1013 5.1013 5.1013 6.3257 6.3257 6.3257 6.3257 7.2719 7.2719 7.2719 7.2719 7.3703 7.3703 7.3703 7.3703 7.7394 7.7394 7.7394 7.7394 7.8582 7.8582 7.8582 7.8582 8.6802 8.6802 8.6802 8.6802 9.1537 9.1537 9.1537 9.1537 10.1775 10.1775 10.1775 10.1775 10.4283 10.4283 10.4283 10.4283 10.7028 10.7028 10.7028 10.7028 10.7694 10.7694 10.7694 10.7694 11.0432 11.0432 11.0432 11.0432 11.1181 11.1181 11.1181 11.1181 12.7181 12.7181 12.7181 12.7181 12.8232 12.8232 12.8232 12.8232 13.5003 13.5003 13.5003 13.5003 13.5329 13.5329 13.5329 13.5329 k = 0.2931 0.5000-0.0000 ( 5652 PWs) bands (ev): -4.4918 -4.4918 -4.4918 -4.4918 -3.6286 -3.6286 -3.6286 -3.6286 -0.9334 -0.9334 -0.9334 -0.9334 -0.8284 -0.8284 -0.8284 -0.8284 4.1714 4.1714 4.1714 4.1714 4.3346 4.3346 4.3346 4.3346 5.1631 5.1631 5.1631 5.1631 6.3128 6.3128 6.3128 6.3128 7.3157 7.3157 7.3157 7.3157 7.3692 7.3692 7.3692 7.3692 7.7348 7.7348 7.7348 7.7348 7.8574 7.8574 7.8574 7.8574 8.6808 8.6808 8.6808 8.6808 9.1821 9.1821 9.1821 9.1821 10.1810 10.1810 10.1810 10.1810 10.4098 10.4098 10.4098 10.4098 10.7134 10.7134 10.7134 10.7134 10.7663 10.7663 10.7663 10.7663 11.0438 11.0438 11.0438 11.0438 11.1118 11.1118 11.1118 11.1118 12.7262 12.7262 12.7262 12.7262 12.8245 12.8245 12.8245 12.8245 13.4684 13.4684 13.4684 13.4684 13.5135 13.5135 13.5135 13.5135 k = 0.3103 0.5000-0.0000 ( 5652 PWs) bands (ev): -4.4619 -4.4619 -4.4619 -4.4619 -3.6602 -3.6602 -3.6602 -3.6602 -0.9326 -0.9326 -0.9326 -0.9326 -0.8404 -0.8404 -0.8404 -0.8404 4.1529 4.1529 4.1529 4.1529 4.3066 4.3066 4.3066 4.3066 5.2304 5.2304 5.2304 5.2304 6.2991 6.2991 6.2991 6.2991 7.3503 7.3503 7.3503 7.3503 7.3687 7.3687 7.3687 7.3687 7.7355 7.7355 7.7355 7.7355 7.8575 7.8575 7.8575 7.8575 8.6827 8.6827 8.6827 8.6827 9.1998 9.1998 9.1998 9.1998 10.1865 10.1865 10.1865 10.1865 10.3965 10.3965 10.3965 10.3965 10.7218 10.7218 10.7218 10.7218 10.7658 10.7658 10.7658 10.7658 11.0443 11.0443 11.0443 11.0443 11.1055 11.1055 11.1055 11.1055 12.7375 12.7375 12.7375 12.7375 12.8279 12.8279 12.8279 12.8279 13.4359 13.4359 13.4359 13.4359 13.4917 13.4917 13.4917 13.4917 k = 0.3276 0.5000-0.0000 ( 5656 PWs) bands (ev): -4.4307 -4.4307 -4.4307 -4.4307 -3.6931 -3.6931 -3.6931 -3.6931 -0.9319 -0.9319 -0.9319 -0.9319 -0.8516 -0.8516 -0.8516 -0.8516 4.1357 4.1357 4.1357 4.1357 4.2778 4.2778 4.2778 4.2778 5.3013 5.3013 5.3013 5.3013 6.2843 6.2843 6.2843 6.2843 7.3636 7.3636 7.3636 7.3636 7.3797 7.3797 7.3797 7.3797 7.7422 7.7422 7.7422 7.7422 7.8584 7.8584 7.8584 7.8584 8.6864 8.6864 8.6864 8.6864 9.2066 9.2066 9.2066 9.2066 10.1938 10.1938 10.1938 10.1938 10.3884 10.3884 10.3884 10.3884 10.7267 10.7267 10.7267 10.7267 10.7692 10.7692 10.7692 10.7692 11.0448 11.0448 11.0448 11.0448 11.0993 11.0993 11.0993 11.0993 12.7521 12.7521 12.7521 12.7521 12.8336 12.8336 12.8336 12.8336 13.4028 13.4028 13.4028 13.4028 13.4670 13.4670 13.4670 13.4670 k = 0.3448 0.5000-0.0000 ( 5652 PWs) bands (ev): -4.3983 -4.3983 -4.3983 -4.3983 -3.7273 -3.7273 -3.7273 -3.7273 -0.9311 -0.9311 -0.9311 -0.9311 -0.8620 -0.8620 -0.8620 -0.8620 4.1200 4.1200 4.1200 4.1200 4.2491 4.2491 4.2491 4.2491 5.3744 5.3744 5.3744 5.3744 6.2679 6.2679 6.2679 6.2679 7.3627 7.3627 7.3627 7.3627 7.3955 7.3955 7.3955 7.3955 7.7545 7.7545 7.7545 7.7545 7.8601 7.8601 7.8601 7.8601 8.6925 8.6925 8.6925 8.6925 9.2026 9.2026 9.2026 9.2026 10.2030 10.2030 10.2030 10.2030 10.3847 10.3847 10.3847 10.3847 10.7287 10.7287 10.7287 10.7287 10.7759 10.7759 10.7759 10.7759 11.0451 11.0451 11.0451 11.0451 11.0933 11.0933 11.0933 11.0933 12.7704 12.7704 12.7704 12.7704 12.8418 12.8418 12.8418 12.8418 13.3691 13.3691 13.3691 13.3691 13.4396 13.4396 13.4396 13.4396 k = 0.3621 0.5000-0.0000 ( 5658 PWs) bands (ev): -4.3647 -4.3647 -4.3647 -4.3647 -3.7625 -3.7625 -3.7625 -3.7625 -0.9303 -0.9303 -0.9303 -0.9303 -0.8714 -0.8714 -0.8714 -0.8714 4.1060 4.1060 4.1060 4.1060 4.2215 4.2215 4.2215 4.2215 5.4485 5.4485 5.4485 5.4485 6.2495 6.2495 6.2495 6.2495 7.3610 7.3610 7.3610 7.3610 7.4038 7.4038 7.4038 7.4038 7.7710 7.7710 7.7710 7.7710 7.8623 7.8623 7.8623 7.8623 8.7013 8.7013 8.7013 8.7013 9.1888 9.1888 9.1888 9.1888 10.2139 10.2139 10.2139 10.2139 10.3840 10.3840 10.3840 10.3840 10.7296 10.7296 10.7296 10.7296 10.7842 10.7842 10.7842 10.7842 11.0454 11.0454 11.0454 11.0454 11.0876 11.0876 11.0876 11.0876 12.7923 12.7923 12.7923 12.7923 12.8528 12.8528 12.8528 12.8528 13.3347 13.3347 13.3347 13.3347 13.4092 13.4092 13.4092 13.4092 k = 0.3793 0.5000-0.0000 ( 5654 PWs) bands (ev): -4.3302 -4.3302 -4.3302 -4.3302 -3.7987 -3.7987 -3.7987 -3.7987 -0.9294 -0.9294 -0.9294 -0.9294 -0.8799 -0.8799 -0.8799 -0.8799 4.0940 4.0940 4.0940 4.0940 4.1954 4.1954 4.1954 4.1954 5.5226 5.5226 5.5226 5.5226 6.2285 6.2285 6.2285 6.2285 7.3592 7.3592 7.3592 7.3592 7.4058 7.4058 7.4058 7.4058 7.7897 7.7897 7.7897 7.7897 7.8650 7.8650 7.8650 7.8650 8.7135 8.7135 8.7135 8.7135 9.1666 9.1666 9.1666 9.1666 10.2265 10.2265 10.2265 10.2265 10.3848 10.3848 10.3848 10.3848 10.7313 10.7313 10.7313 10.7313 10.7923 10.7923 10.7923 10.7923 11.0455 11.0455 11.0455 11.0455 11.0826 11.0826 11.0826 11.0826 12.8176 12.8176 12.8176 12.8176 12.8668 12.8668 12.8668 12.8668 13.2997 13.2997 13.2997 13.2997 13.3761 13.3761 13.3761 13.3761 k = 0.3966 0.5000-0.0000 ( 5646 PWs) bands (ev): -4.2946 -4.2946 -4.2946 -4.2946 -3.8357 -3.8357 -3.8357 -3.8357 -0.9284 -0.9284 -0.9284 -0.9284 -0.8876 -0.8876 -0.8876 -0.8876 4.0842 4.0842 4.0842 4.0842 4.1711 4.1711 4.1711 4.1711 5.5956 5.5956 5.5956 5.5956 6.2046 6.2046 6.2046 6.2046 7.3577 7.3577 7.3577 7.3577 7.4035 7.4035 7.4035 7.4035 7.8086 7.8086 7.8086 7.8086 7.8679 7.8679 7.8679 7.8679 8.7294 8.7294 8.7294 8.7294 9.1376 9.1376 9.1376 9.1376 10.2404 10.2404 10.2404 10.2404 10.3853 10.3853 10.3853 10.3853 10.7350 10.7350 10.7350 10.7350 10.7990 10.7990 10.7990 10.7990 11.0454 11.0454 11.0454 11.0454 11.0782 11.0782 11.0782 11.0782 12.8462 12.8462 12.8462 12.8462 12.8838 12.8838 12.8838 12.8838 13.2641 13.2641 13.2641 13.2641 13.3404 13.3404 13.3404 13.3404 k = 0.4138 0.5000-0.0000 ( 5646 PWs) bands (ev): -4.2583 -4.2583 -4.2583 -4.2583 -3.8734 -3.8734 -3.8734 -3.8734 -0.9272 -0.9272 -0.9272 -0.9272 -0.8943 -0.8943 -0.8943 -0.8943 4.0767 4.0767 4.0767 4.0767 4.1492 4.1492 4.1492 4.1492 5.6670 5.6670 5.6670 5.6670 6.1772 6.1772 6.1772 6.1772 7.3567 7.3567 7.3567 7.3567 7.3984 7.3984 7.3984 7.3984 7.8263 7.8263 7.8263 7.8263 7.8708 7.8708 7.8708 7.8708 8.7493 8.7493 8.7493 8.7493 9.1034 9.1034 9.1034 9.1034 10.2553 10.2553 10.2553 10.2553 10.3842 10.3842 10.3842 10.3842 10.7407 10.7407 10.7407 10.7407 10.8039 10.8039 10.8039 10.8039 11.0451 11.0451 11.0451 11.0451 11.0746 11.0746 11.0746 11.0746 12.8775 12.8775 12.8775 12.8775 12.9043 12.9043 12.9043 12.9043 13.2281 13.2281 13.2281 13.2281 13.3025 13.3025 13.3025 13.3025 k = 0.4310 0.5000-0.0000 ( 5648 PWs) bands (ev): -4.2211 -4.2211 -4.2211 -4.2211 -3.9117 -3.9117 -3.9117 -3.9117 -0.9258 -0.9258 -0.9258 -0.9258 -0.9003 -0.9003 -0.9003 -0.9003 4.0716 4.0716 4.0716 4.0716 4.1296 4.1296 4.1296 4.1296 5.7359 5.7359 5.7359 5.7359 6.1459 6.1459 6.1459 6.1459 7.3564 7.3564 7.3564 7.3564 7.3919 7.3919 7.3919 7.3919 7.8417 7.8417 7.8417 7.8417 7.8734 7.8734 7.8734 7.8734 8.7732 8.7732 8.7732 8.7732 9.0656 9.0656 9.0656 9.0656 10.2709 10.2709 10.2709 10.2709 10.3806 10.3806 10.3806 10.3806 10.7487 10.7487 10.7487 10.7487 10.8063 10.8063 10.8063 10.8063 11.0446 11.0446 11.0446 11.0446 11.0718 11.0718 11.0718 11.0718 12.9102 12.9102 12.9102 12.9102 12.9288 12.9288 12.9288 12.9288 13.1921 13.1921 13.1921 13.1921 13.2628 13.2628 13.2628 13.2628 k = 0.4483 0.5000-0.0000 ( 5650 PWs) bands (ev): -4.1834 -4.1834 -4.1834 -4.1834 -3.9504 -3.9504 -3.9504 -3.9504 -0.9242 -0.9242 -0.9242 -0.9242 -0.9055 -0.9055 -0.9055 -0.9055 4.0692 4.0692 4.0692 4.0692 4.1127 4.1127 4.1127 4.1127 5.8018 5.8018 5.8018 5.8018 6.1104 6.1104 6.1104 6.1104 7.3570 7.3570 7.3570 7.3570 7.3849 7.3849 7.3849 7.3849 7.8542 7.8542 7.8542 7.8542 7.8755 7.8755 7.8755 7.8755 8.8010 8.8010 8.8010 8.8010 9.0257 9.0257 9.0257 9.0257 10.2868 10.2868 10.2868 10.2868 10.3742 10.3742 10.3742 10.3742 10.7581 10.7581 10.7581 10.7581 10.8061 10.8061 10.8061 10.8061 11.0441 11.0441 11.0441 11.0441 11.0698 11.0698 11.0698 11.0698 12.9419 12.9419 12.9419 12.9419 12.9588 12.9588 12.9588 12.9588 13.1568 13.1568 13.1568 13.1568 13.2219 13.2219 13.2219 13.2219 k = 0.4655 0.5000-0.0000 ( 5658 PWs) bands (ev): -4.1451 -4.1451 -4.1451 -4.1451 -3.9894 -3.9894 -3.9894 -3.9894 -0.9223 -0.9223 -0.9223 -0.9223 -0.9099 -0.9099 -0.9099 -0.9099 4.0694 4.0694 4.0694 4.0694 4.0985 4.0985 4.0985 4.0985 5.8641 5.8641 5.8641 5.8641 6.0704 6.0704 6.0704 6.0704 7.3586 7.3586 7.3586 7.3586 7.3781 7.3781 7.3781 7.3781 7.8637 7.8637 7.8637 7.8637 7.8766 7.8766 7.8766 7.8766 8.8326 8.8326 8.8326 8.8326 8.9848 8.9848 8.9848 8.9848 10.3025 10.3025 10.3025 10.3025 10.3654 10.3654 10.3654 10.3654 10.7683 10.7683 10.7683 10.7683 10.8032 10.8032 10.8032 10.8032 11.0436 11.0436 11.0436 11.0436 11.0685 11.0685 11.0685 11.0685 12.9717 12.9717 12.9717 12.9717 12.9927 12.9927 12.9927 12.9927 13.1239 13.1239 13.1239 13.1239 13.1805 13.1805 13.1805 13.1805 k = 0.4828 0.5000-0.0000 ( 5658 PWs) bands (ev): -4.1065 -4.1065 -4.1065 -4.1065 -4.0284 -4.0284 -4.0284 -4.0284 -0.9200 -0.9200 -0.9200 -0.9200 -0.9137 -0.9137 -0.9137 -0.9137 4.0722 4.0722 4.0722 4.0722 4.0872 4.0872 4.0872 4.0872 5.9224 5.9224 5.9224 5.9224 6.0258 6.0258 6.0258 6.0258 7.3612 7.3612 7.3612 7.3612 7.3723 7.3723 7.3723 7.3723 7.8703 7.8703 7.8703 7.8703 7.8765 7.8765 7.8765 7.8765 8.8673 8.8673 8.8673 8.8673 8.9442 8.9442 8.9442 8.9442 10.3165 10.3165 10.3165 10.3165 10.3555 10.3555 10.3555 10.3555 10.7780 10.7780 10.7780 10.7780 10.7983 10.7983 10.7983 10.7983 11.0432 11.0432 11.0432 11.0432 11.0678 11.0678 11.0678 11.0678 13.0003 13.0003 13.0003 13.0003 13.0220 13.0220 13.0220 13.0220 13.0996 13.0996 13.0996 13.0996 13.1405 13.1405 13.1405 13.1405 k = 0.5000 0.5000-0.0000 ( 5656 PWs) bands (ev): -4.0677 -4.0677 -4.0677 -4.0677 -4.0673 -4.0673 -4.0673 -4.0673 -0.9179 -0.9179 -0.9179 -0.9179 -0.9164 -0.9164 -0.9164 -0.9164 4.0764 4.0764 4.0764 4.0764 4.0802 4.0802 4.0802 4.0802 5.9737 5.9737 5.9737 5.9737 5.9790 5.9790 5.9790 5.9790 7.3632 7.3632 7.3632 7.3632 7.3691 7.3691 7.3691 7.3691 7.8737 7.8737 7.8737 7.8737 7.8753 7.8753 7.8753 7.8753 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 10.3238 10.3238 10.3238 10.3238 10.3496 10.3496 10.3496 10.3496 10.7837 10.7837 10.7837 10.7837 10.7943 10.7943 10.7943 10.7943 11.0431 11.0431 11.0431 11.0431 11.0676 11.0676 11.0676 11.0676 13.0232 13.0232 13.0232 13.0232 13.0242 13.0242 13.0242 13.0242 13.1015 13.1015 13.1015 13.1015 13.1114 13.1114 13.1114 13.1114 k = 0.5000 0.5000-0.0000 ( 5656 PWs) bands (ev): -4.0677 -4.0677 -4.0677 -4.0677 -4.0673 -4.0673 -4.0673 -4.0673 -0.9179 -0.9179 -0.9179 -0.9179 -0.9164 -0.9164 -0.9164 -0.9164 4.0764 4.0764 4.0764 4.0764 4.0802 4.0802 4.0802 4.0802 5.9737 5.9737 5.9737 5.9737 5.9790 5.9790 5.9790 5.9790 7.3632 7.3632 7.3632 7.3632 7.3691 7.3691 7.3691 7.3691 7.8737 7.8737 7.8737 7.8737 7.8753 7.8753 7.8753 7.8753 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 10.3238 10.3238 10.3238 10.3238 10.3496 10.3496 10.3496 10.3496 10.7837 10.7837 10.7837 10.7837 10.7943 10.7943 10.7943 10.7943 11.0431 11.0431 11.0431 11.0431 11.0676 11.0676 11.0676 11.0676 13.0232 13.0232 13.0232 13.0232 13.0242 13.0242 13.0242 13.0242 13.1015 13.1015 13.1015 13.1015 13.1114 13.1114 13.1114 13.1114 k = 0.4881 0.4881-0.0000 ( 5656 PWs) bands (ev): -4.1221 -4.1221 -4.0670 -4.0670 -4.0667 -4.0667 -4.0140 -4.0140 -0.9313 -0.9313 -0.9272 -0.9272 -0.9068 -0.9068 -0.9021 -0.9021 4.0467 4.0467 4.0573 4.0573 4.1017 4.1017 4.1123 4.1123 5.9175 5.9175 5.9607 5.9607 5.9923 5.9923 6.0282 6.0282 7.3369 7.3369 7.3429 7.3429 7.3854 7.3854 7.3995 7.3995 7.8577 7.8577 7.8626 7.8626 7.8854 7.8854 7.8893 7.8893 8.8458 8.8458 8.8996 8.8996 8.9109 8.9109 8.9637 8.9637 10.3088 10.3088 10.3321 10.3321 10.3419 10.3419 10.3645 10.3645 10.7669 10.7669 10.7823 10.7823 10.7953 10.7953 10.8099 10.8099 11.0313 11.0313 11.0539 11.0539 11.0577 11.0577 11.0766 11.0766 12.9897 12.9897 13.0187 13.0187 13.0239 13.0239 13.0302 13.0302 13.0856 13.0856 13.1131 13.1131 13.1223 13.1223 13.1429 13.1429 k = 0.4762 0.4762-0.0000 ( 5660 PWs) bands (ev): -4.1774 -4.1774 -4.0651 -4.0651 -4.0645 -4.0645 -3.9618 -3.9618 -0.9446 -0.9446 -0.9369 -0.9369 -0.8962 -0.8962 -0.8864 -0.8864 4.0179 4.0179 4.0385 4.0385 4.1284 4.1284 4.1478 4.1478 5.8536 5.8536 5.9456 5.9456 6.0085 6.0085 6.0708 6.0708 7.3071 7.3071 7.3230 7.3230 7.3989 7.3989 7.4362 7.4362 7.8395 7.8395 7.8493 7.8493 7.8951 7.8951 7.9023 7.9023 8.7870 8.7870 8.8961 8.8961 8.9172 8.9172 9.0222 9.0222 10.2912 10.2912 10.3360 10.3360 10.3388 10.3388 10.3835 10.3835 10.7475 10.7475 10.7722 10.7722 10.8040 10.8040 10.8262 10.8262 11.0185 11.0185 11.0473 11.0473 11.0636 11.0636 11.0846 11.0846 12.9492 12.9492 12.9950 12.9950 13.0194 13.0194 13.0287 13.0287 13.0758 13.0758 13.1339 13.1339 13.1554 13.1554 13.1872 13.1872 k = 0.4643 0.4643-0.0000 ( 5648 PWs) bands (ev): -4.2334 -4.2334 -4.0619 -4.0619 -4.0610 -4.0610 -3.9111 -3.9111 -0.9572 -0.9572 -0.9459 -0.9459 -0.8857 -0.8857 -0.8698 -0.8698 3.9918 3.9918 4.0224 4.0224 4.1577 4.1577 4.1853 4.1853 5.7863 5.7863 5.9310 5.9310 6.0248 6.0248 6.1025 6.1025 7.2704 7.2704 7.3152 7.3152 7.4052 7.4052 7.4757 7.4757 7.8196 7.8196 7.8352 7.8352 7.9032 7.9032 7.9137 7.9137 8.7288 8.7288 8.8943 8.8943 8.9227 8.9227 9.0801 9.0801 10.2744 10.2744 10.3352 10.3352 10.3404 10.3404 10.4027 10.4027 10.7282 10.7282 10.7621 10.7621 10.8118 10.8118 10.8407 10.8407 11.0047 11.0047 11.0369 11.0369 11.0722 11.0722 11.0917 11.0917 12.9082 12.9082 12.9632 12.9632 13.0153 13.0153 13.0287 13.0287 13.0693 13.0693 13.1537 13.1537 13.2009 13.2009 13.2355 13.2355 k = 0.4524 0.4524-0.0000 ( 5644 PWs) bands (ev): -4.2898 -4.2898 -4.0574 -4.0574 -4.0562 -4.0562 -3.8621 -3.8621 -0.9692 -0.9692 -0.9542 -0.9542 -0.8755 -0.8755 -0.8521 -0.8521 3.9684 3.9684 4.0088 4.0088 4.1897 4.1897 4.2242 4.2242 5.7171 5.7171 5.9168 5.9168 6.0408 6.0408 6.1222 6.1222 7.2294 7.2294 7.3187 7.3187 7.4052 7.4052 7.5155 7.5155 7.7986 7.7986 7.8203 7.8203 7.9097 7.9097 7.9235 7.9235 8.6716 8.6716 8.8942 8.8942 8.9261 8.9261 9.1372 9.1372 10.2601 10.2601 10.3330 10.3330 10.3436 10.3436 10.4203 10.4203 10.7100 10.7100 10.7518 10.7518 10.8192 10.8192 10.8521 10.8521 10.9900 10.9900 11.0273 11.0273 11.0797 11.0797 11.0977 11.0977 12.8679 12.8679 12.9322 12.9322 13.0115 13.0115 13.0282 13.0282 13.0658 13.0658 13.1745 13.1745 13.2501 13.2501 13.2864 13.2864 k = 0.4405 0.4405-0.0000 ( 5650 PWs) bands (ev): -4.3465 -4.3465 -4.0515 -4.0515 -4.0501 -4.0501 -3.8150 -3.8150 -0.9805 -0.9805 -0.9616 -0.9616 -0.8658 -0.8658 -0.8334 -0.8334 3.9480 3.9480 3.9978 3.9978 4.2243 4.2243 4.2643 4.2643 5.6473 5.6473 5.9031 5.9031 6.0562 6.0562 6.1296 6.1296 7.1852 7.1852 7.3321 7.3321 7.4005 7.4005 7.5529 7.5529 7.7774 7.7774 7.8050 7.8050 7.9146 7.9146 7.9319 7.9319 8.6156 8.6156 8.8952 8.8952 8.9265 8.9265 9.1930 9.1930 10.2491 10.2491 10.3305 10.3305 10.3472 10.3472 10.4355 10.4355 10.6940 10.6940 10.7409 10.7409 10.8264 10.8264 10.8596 10.8596 10.9742 10.9742 11.0193 11.0193 11.0860 11.0860 11.1028 11.1028 12.8288 12.8288 12.9036 12.9036 13.0089 13.0089 13.0271 13.0271 13.0648 13.0648 13.1961 13.1961 13.3010 13.3010 13.3389 13.3389 k = 0.4286 0.4286-0.0000 ( 5648 PWs) bands (ev): -4.4032 -4.4032 -4.0444 -4.0444 -4.0427 -4.0427 -3.7701 -3.7701 -0.9912 -0.9912 -0.9679 -0.9679 -0.8567 -0.8567 -0.8135 -0.8135 3.9306 3.9306 3.9891 3.9891 4.2616 4.2616 4.3051 4.3051 5.5782 5.5782 5.8898 5.8898 6.0693 6.0693 6.1266 6.1266 7.1388 7.1388 7.3479 7.3479 7.3984 7.3984 7.5841 7.5841 7.7581 7.7581 7.7898 7.7898 7.9180 7.9180 7.9390 7.9390 8.5615 8.5615 8.8964 8.8964 8.9230 8.9230 9.2473 9.2473 10.2423 10.2423 10.3276 10.3276 10.3513 10.3513 10.4475 10.4475 10.6809 10.6809 10.7297 10.7297 10.8334 10.8334 10.8627 10.8627 10.9573 10.9573 11.0139 11.0139 11.0910 11.0910 11.1073 11.1073 12.7912 12.7912 12.8775 12.8775 13.0083 13.0083 13.0256 13.0256 13.0661 13.0661 13.2182 13.2182 13.3530 13.3530 13.3925 13.3925 k = 0.4167 0.4167-0.0000 ( 5652 PWs) bands (ev): -4.4598 -4.4598 -4.0359 -4.0359 -4.0340 -4.0340 -3.7276 -3.7276 -1.0014 -1.0014 -0.9733 -0.9733 -0.8485 -0.8485 -0.7924 -0.7924 3.9164 3.9164 3.9829 3.9829 4.3015 4.3015 4.3463 4.3463 5.5107 5.5107 5.8769 5.8769 6.0747 6.0747 6.1199 6.1199 7.0909 7.0909 7.3466 7.3466 7.4167 7.4167 7.6029 7.6029 7.7453 7.7453 7.7756 7.7756 7.9205 7.9205 7.9451 7.9451 8.5095 8.5095 8.8964 8.8964 8.9150 8.9150 9.2998 9.2998 10.2396 10.2396 10.3241 10.3241 10.3559 10.3559 10.4562 10.4562 10.6711 10.6711 10.7180 10.7180 10.8399 10.8399 10.8619 10.8619 10.9394 10.9394 11.0113 11.0113 11.0947 11.0947 11.1115 11.1115 12.7551 12.7551 12.8539 12.8539 13.0105 13.0105 13.0238 13.0238 13.0693 13.0693 13.2402 13.2402 13.4057 13.4057 13.4466 13.4466 k = 0.4048 0.4048-0.0000 ( 5652 PWs) bands (ev): -4.5161 -4.5161 -4.0262 -4.0262 -4.0240 -4.0240 -3.6875 -3.6875 -1.0111 -1.0111 -0.9776 -0.9776 -0.8412 -0.8412 -0.7698 -0.7698 3.9054 3.9054 3.9789 3.9789 4.3441 4.3441 4.3871 4.3871 5.4460 5.4460 5.8642 5.8642 6.0613 6.0613 6.1221 6.1221 7.0426 7.0426 7.3290 7.3290 7.4517 7.4517 7.6023 7.6023 7.7431 7.7431 7.7649 7.7649 7.9229 7.9229 7.9507 7.9507 8.4602 8.4602 8.8925 8.8925 8.9039 8.9039 9.3502 9.3502 10.2414 10.2414 10.3201 10.3201 10.3610 10.3610 10.4621 10.4621 10.6647 10.6647 10.7060 10.7060 10.8439 10.8439 10.8598 10.8598 10.9208 10.9208 11.0112 11.0112 11.0969 11.0969 11.1157 11.1157 12.7206 12.7206 12.8326 12.8326 13.0150 13.0150 13.0224 13.0224 13.0747 13.0747 13.2613 13.2613 13.4586 13.4586 13.5008 13.5008 k = 0.3929 0.3929-0.0000 ( 5656 PWs) bands (ev): -4.5720 -4.5720 -4.0153 -4.0153 -4.0128 -4.0128 -3.6502 -3.6502 -1.0202 -1.0202 -0.9809 -0.9809 -0.8350 -0.8350 -0.7458 -0.7458 3.8977 3.8977 3.9773 3.9773 4.3892 4.3892 4.4271 4.4271 5.3850 5.3850 5.8517 5.8517 6.0318 6.0318 6.1321 6.1321 6.9944 6.9944 7.3052 7.3052 7.4886 7.4886 7.5834 7.5834 7.7463 7.7463 7.7622 7.7622 7.9269 7.9269 7.9565 7.9565 8.4138 8.4138 8.8779 8.8779 8.8950 8.8950 9.3979 9.3979 10.2473 10.2473 10.3158 10.3158 10.3666 10.3666 10.4660 10.4660 10.6610 10.6610 10.6935 10.6935 10.8399 10.8399 10.8623 10.8623 10.9022 10.9022 11.0129 11.0129 11.0975 11.0975 11.1201 11.1201 12.6878 12.6878 12.8134 12.8134 13.0155 13.0155 13.0279 13.0279 13.0828 13.0828 13.2806 13.2806 13.5116 13.5116 13.5544 13.5544 k = 0.3810 0.3810-0.0000 ( 5654 PWs) bands (ev): -4.6273 -4.6273 -4.0031 -4.0031 -4.0005 -4.0005 -3.6156 -3.6156 -1.0289 -1.0289 -0.9833 -0.9833 -0.8302 -0.8302 -0.7201 -0.7201 3.8933 3.8933 3.9778 3.9778 4.4368 4.4368 4.4653 4.4653 5.3289 5.3289 5.8391 5.8391 5.9942 5.9942 6.1436 6.1436 6.9472 6.9472 7.2786 7.2786 7.5174 7.5174 7.5534 7.5534 7.7510 7.7510 7.7664 7.7664 7.9345 7.9345 7.9639 7.9639 8.3705 8.3705 8.8545 8.8545 8.8854 8.8854 9.4425 9.4425 10.2565 10.2565 10.3119 10.3119 10.3725 10.3725 10.4694 10.4694 10.6589 10.6589 10.6809 10.6809 10.8297 10.8297 10.8658 10.8658 10.8870 10.8870 11.0154 11.0154 11.0969 11.0969 11.1247 11.1247 12.6566 12.6566 12.7960 12.7960 13.0114 13.0114 13.0402 13.0402 13.0946 13.0946 13.2968 13.2968 13.5642 13.5642 13.6069 13.6069 k = 0.3690 0.3690-0.0000 ( 5646 PWs) bands (ev): -4.6819 -4.6819 -3.9898 -3.9898 -3.9870 -3.9870 -3.5839 -3.5839 -1.0370 -1.0370 -0.9849 -0.9849 -0.8266 -0.8266 -0.6928 -0.6928 3.8922 3.8922 3.9805 3.9805 4.4865 4.4865 4.5010 4.5010 5.2788 5.2788 5.8264 5.8264 5.9520 5.9520 6.1543 6.1543 6.9015 6.9015 7.2508 7.2508 7.5139 7.5139 7.5335 7.5335 7.7548 7.7548 7.7769 7.7769 7.9467 7.9467 7.9750 7.9750 8.3301 8.3301 8.8258 8.8258 8.8714 8.8714 9.4833 9.4833 10.2672 10.2672 10.3099 10.3099 10.3788 10.3788 10.4735 10.4735 10.6559 10.6559 10.6699 10.6699 10.8164 10.8164 10.8575 10.8575 10.8864 10.8864 11.0181 11.0181 11.0950 11.0950 11.1295 11.1295 12.6270 12.6270 12.7801 12.7801 13.0057 13.0057 13.0554 13.0554 13.1112 13.1112 13.3082 13.3082 13.6162 13.6162 13.6578 13.6578 k = 0.3571 0.3571-0.0000 ( 5646 PWs) bands (ev): -4.7357 -4.7357 -3.9754 -3.9754 -3.9724 -3.9724 -3.5552 -3.5552 -1.0448 -1.0448 -0.9858 -0.9858 -0.8246 -0.8246 -0.6636 -0.6636 3.8945 3.8945 3.9852 3.9852 4.5304 4.5304 4.5407 4.5407 5.2361 5.2361 5.8133 5.8133 5.9073 5.9073 6.1632 6.1632 6.8579 6.8579 7.2233 7.2233 7.4731 7.4731 7.5302 7.5302 7.7461 7.7461 7.7996 7.7996 7.9626 7.9626 7.9935 7.9935 8.2923 8.2923 8.7930 8.7930 8.8518 8.8518 9.5195 9.5195 10.2759 10.2759 10.3133 10.3133 10.3851 10.3851 10.4793 10.4793 10.6466 10.6466 10.6651 10.6651 10.8006 10.8006 10.8432 10.8432 10.8947 10.8947 11.0202 11.0202 11.0921 11.0921 11.1344 11.1344 12.5989 12.5989 12.7657 12.7657 12.9987 12.9987 13.0722 13.0722 13.1342 13.1342 13.3133 13.3133 13.6672 13.6672 13.7064 13.7064 k = 0.3452 0.3452-0.0000 ( 5646 PWs) bands (ev): -4.7885 -4.7885 -3.9598 -3.9598 -3.9567 -3.9567 -3.5294 -3.5294 -1.0521 -1.0521 -0.9862 -0.9862 -0.8240 -0.8240 -0.6326 -0.6326 3.9001 3.9001 3.9920 3.9920 4.5573 4.5573 4.5943 4.5943 5.2021 5.2021 5.7996 5.7996 5.8615 5.8615 6.1695 6.1695 6.8170 6.8170 7.1971 7.1971 7.4283 7.4283 7.5157 7.5157 7.7284 7.7284 7.8226 7.8226 7.9799 7.9799 8.0234 8.0234 8.2564 8.2564 8.7574 8.7574 8.8262 8.8262 9.5505 9.5505 10.2795 10.2795 10.3248 10.3248 10.3916 10.3916 10.4871 10.4871 10.6325 10.6325 10.6645 10.6645 10.7824 10.7824 10.8309 10.8309 10.9045 10.9045 11.0215 11.0215 11.0882 11.0882 11.1393 11.1393 12.5723 12.5723 12.7525 12.7525 12.9904 12.9904 13.0900 13.0900 13.1641 13.1641 13.3104 13.3104 13.7170 13.7170 13.7521 13.7521 k = 0.3333 0.3333-0.0000 ( 5646 PWs) bands (ev): -4.8403 -4.8403 -3.9433 -3.9433 -3.9400 -3.9400 -3.5066 -3.5066 -1.0590 -1.0590 -0.9863 -0.9863 -0.8251 -0.8251 -0.5997 -0.5997 3.9089 3.9089 4.0007 4.0007 4.5771 4.5771 4.6504 4.6504 5.1782 5.1782 5.7846 5.7846 5.8163 5.8163 6.1725 6.1725 6.7792 6.7792 7.1732 7.1732 7.3809 7.3809 7.4937 7.4937 7.7045 7.7045 7.8382 7.8382 7.9961 7.9961 8.0663 8.0663 8.2218 8.2218 8.7201 8.7201 8.7944 8.7944 9.5754 9.5754 10.2807 10.2807 10.3416 10.3416 10.3986 10.3986 10.4973 10.4973 10.6169 10.6169 10.6647 10.6647 10.7626 10.7626 10.8217 10.8217 10.9146 10.9146 11.0216 11.0216 11.0835 11.0835 11.1444 11.1444 12.5471 12.5471 12.7405 12.7405 12.9808 12.9808 13.1088 13.1088 13.2009 13.2009 13.2984 13.2984 13.7649 13.7649 13.7949 13.7949 k = 0.3214 0.3214-0.0000 ( 5640 PWs) bands (ev): -4.8910 -4.8910 -3.9257 -3.9257 -3.9224 -3.9224 -3.4867 -3.4867 -1.0655 -1.0655 -0.9863 -0.9863 -0.8277 -0.8277 -0.5649 -0.5649 3.9209 3.9209 4.0112 4.0112 4.5895 4.5895 4.7083 4.7083 5.1652 5.1652 5.7641 5.7641 5.7766 5.7766 6.1719 6.1719 6.7446 6.7446 7.1527 7.1527 7.3319 7.3319 7.4669 7.4669 7.6763 7.6763 7.8457 7.8457 8.0094 8.0094 8.1185 8.1185 8.1878 8.1878 8.6826 8.6826 8.7569 8.7569 9.5934 9.5934 10.2826 10.2826 10.3591 10.3591 10.4070 10.4070 10.5097 10.5097 10.6006 10.6006 10.6647 10.6647 10.7423 10.7423 10.8153 10.8153 10.9243 10.9243 11.0206 11.0206 11.0782 11.0782 11.1494 11.1494 12.5232 12.5232 12.7296 12.7296 12.9699 12.9699 13.1293 13.1293 13.2434 13.2434 13.2777 13.2777 13.8100 13.8100 13.8353 13.8353 k = 0.3095 0.3095-0.0000 ( 5634 PWs) bands (ev): -4.9404 -4.9404 -3.9073 -3.9073 -3.9039 -3.9039 -3.4696 -3.4696 -1.0717 -1.0717 -0.9864 -0.9864 -0.8320 -0.8320 -0.5283 -0.5283 3.9361 3.9361 4.0235 4.0235 4.5947 4.5947 4.7672 4.7672 5.1630 5.1630 5.7260 5.7260 5.7556 5.7556 6.1669 6.1669 6.7134 6.7134 7.1362 7.1362 7.2819 7.2819 7.4369 7.4369 7.6449 7.6449 7.8472 7.8472 8.0182 8.0182 8.1482 8.1482 8.1811 8.1811 8.6462 8.6462 8.7142 8.7142 9.6038 9.6038 10.2870 10.2870 10.3731 10.3731 10.4193 10.4193 10.5238 10.5238 10.5842 10.5842 10.6639 10.6639 10.7228 10.7228 10.8115 10.8115 10.9331 10.9331 11.0182 11.0182 11.0723 11.0723 11.1544 11.1544 12.5004 12.5004 12.7197 12.7197 12.9577 12.9577 13.1520 13.1520 13.2453 13.2453 13.2946 13.2946 13.8501 13.8501 13.8752 13.8752 k = 0.2976 0.2976-0.0000 ( 5642 PWs) bands (ev): -4.9886 -4.9886 -3.8880 -3.8880 -3.8845 -3.8845 -3.4552 -3.4552 -1.0775 -1.0775 -0.9868 -0.9868 -0.8379 -0.8379 -0.4899 -0.4899 3.9542 3.9542 4.0376 4.0376 4.5936 4.5936 4.8268 4.8268 5.1707 5.1707 5.6869 5.6869 5.7373 5.7373 6.1574 6.1574 6.6855 6.6855 7.1243 7.1243 7.2319 7.2319 7.4045 7.4045 7.6115 7.6115 7.8448 7.8448 8.0199 8.0199 8.1155 8.1155 8.2377 8.2377 8.6125 8.6125 8.6675 8.6675 9.6063 9.6063 10.2947 10.2947 10.3810 10.3810 10.4367 10.4367 10.5379 10.5379 10.5695 10.5695 10.6608 10.6608 10.7060 10.7060 10.8098 10.8098 10.9406 10.9406 11.0145 11.0145 11.0657 11.0657 11.1592 11.1592 12.4785 12.4785 12.7109 12.7109 12.9443 12.9443 13.1774 13.1774 13.2086 13.2086 13.3480 13.3480 13.8840 13.8840 13.9165 13.9165 k = 0.2857 0.2857-0.0000 ( 5636 PWs) bands (ev): -5.0354 -5.0354 -3.8679 -3.8679 -3.8644 -3.8644 -3.4433 -3.4433 -1.0830 -1.0830 -0.9877 -0.9877 -0.8453 -0.8453 -0.4499 -0.4499 3.9751 3.9751 4.0534 4.0534 4.5879 4.5879 4.8861 4.8861 5.1867 5.1867 5.6515 5.6515 5.7182 5.7182 6.1432 6.1432 6.6604 6.6604 7.1172 7.1172 7.1829 7.1829 7.3705 7.3705 7.5765 7.5765 7.8400 7.8400 8.0100 8.0100 8.0840 8.0840 8.2936 8.2936 8.5826 8.5826 8.6189 8.6189 9.6010 9.6010 10.3058 10.3058 10.3834 10.3834 10.4574 10.4574 10.5417 10.5417 10.5671 10.5671 10.6534 10.6534 10.6943 10.6943 10.8099 10.8099 10.9464 10.9464 11.0097 11.0097 11.0586 11.0586 11.1639 11.1639 12.4573 12.4573 12.7030 12.7030 12.9299 12.9299 13.1659 13.1659 13.2060 13.2060 13.4065 13.4065 13.9126 13.9126 13.9584 13.9584 k = 0.2738 0.2738-0.0000 ( 5654 PWs) bands (ev): -5.0807 -5.0807 -3.8471 -3.8471 -3.8437 -3.8437 -3.4337 -3.4337 -1.0882 -1.0882 -0.9892 -0.9892 -0.8542 -0.8542 -0.4085 -0.4085 3.9988 3.9988 4.0707 4.0707 4.5793 4.5793 4.9442 4.9442 5.2091 5.2091 5.6213 5.6213 5.6980 5.6980 6.1243 6.1243 6.6373 6.6373 7.1144 7.1144 7.1362 7.1362 7.3355 7.3355 7.5406 7.5406 7.8336 7.8336 7.9823 7.9823 8.0607 8.0607 8.3413 8.3413 8.5575 8.5575 8.5731 8.5731 9.5882 9.5882 10.3199 10.3199 10.3820 10.3820 10.4768 10.4768 10.5324 10.5324 10.5818 10.5818 10.6410 10.6410 10.6887 10.6887 10.8114 10.8114 10.9503 10.9503 11.0038 11.0038 11.0508 11.0508 11.1681 11.1681 12.4363 12.4363 12.6960 12.6960 12.9144 12.9144 13.1200 13.1200 13.2376 13.2376 13.4690 13.4690 13.9375 13.9375 13.9998 13.9998 k = 0.2619 0.2619-0.0000 ( 5654 PWs) bands (ev): -5.1244 -5.1244 -3.8258 -3.8258 -3.8223 -3.8223 -3.4264 -3.4264 -1.0931 -1.0931 -0.9914 -0.9914 -0.8646 -0.8646 -0.3658 -0.3658 4.0251 4.0251 4.0897 4.0897 4.5697 4.5697 4.9995 4.9995 5.2361 5.2361 5.5981 5.5981 5.6769 5.6769 6.1012 6.1012 6.6153 6.6153 7.0909 7.0909 7.1177 7.1177 7.3002 7.3002 7.5040 7.5040 7.8260 7.8260 7.9393 7.9393 8.0432 8.0432 8.3684 8.3684 8.5382 8.5382 8.5418 8.5418 9.5684 9.5684 10.3367 10.3367 10.3780 10.3780 10.4852 10.4852 10.5318 10.5318 10.5997 10.5997 10.6263 10.6263 10.6872 10.6872 10.8140 10.8140 10.9520 10.9520 10.9973 10.9973 11.0426 11.0426 11.1719 11.1719 12.4153 12.4153 12.6900 12.6900 12.8981 12.8981 13.0727 13.0727 13.2727 13.2727 13.5349 13.5349 13.9593 13.9593 14.0403 14.0403 k = 0.2500 0.2500-0.0000 ( 5670 PWs) bands (ev): -5.1666 -5.1666 -3.8039 -3.8039 -3.8005 -3.8005 -3.4210 -3.4210 -1.0977 -1.0977 -0.9944 -0.9944 -0.8763 -0.8763 -0.3222 -0.3222 4.0537 4.0537 4.1102 4.1102 4.5604 4.5604 5.0500 5.0500 5.2662 5.2662 5.5837 5.5837 5.6551 5.6551 6.0743 6.0743 6.5929 6.5929 7.0518 7.0518 7.1217 7.1217 7.2662 7.2662 7.4669 7.4669 7.8175 7.8175 7.8875 7.8875 8.0250 8.0250 8.3564 8.3564 8.5242 8.5242 8.5440 8.5440 9.5424 9.5424 10.3544 10.3544 10.3725 10.3725 10.4766 10.4766 10.5476 10.5476 10.6089 10.6089 10.6203 10.6203 10.6878 10.6878 10.8175 10.8175 10.9513 10.9513 10.9904 10.9904 11.0339 11.0339 11.1749 11.1749 12.3936 12.3936 12.6850 12.6850 12.8812 12.8812 13.0258 13.0258 13.3112 13.3112 13.6035 13.6035 13.9787 13.9787 14.0799 14.0799 k = 0.2381 0.2381-0.0000 ( 5658 PWs) bands (ev): -5.2072 -5.2072 -3.7816 -3.7816 -3.7783 -3.7783 -3.4174 -3.4174 -1.1021 -1.1021 -0.9984 -0.9984 -0.8892 -0.8892 -0.2779 -0.2779 4.0844 4.0844 4.1323 4.1323 4.5524 4.5524 5.0935 5.0935 5.2984 5.2984 5.5801 5.5801 5.6331 5.6331 6.0445 6.0445 6.5689 6.5689 7.0180 7.0180 7.1243 7.1243 7.2373 7.2373 7.4296 7.4296 7.8074 7.8074 7.8319 7.8319 8.0035 8.0035 8.3125 8.3125 8.5152 8.5152 8.5728 8.5728 9.5110 9.5110 10.3595 10.3595 10.3787 10.3787 10.4615 10.4615 10.5684 10.5684 10.5963 10.5963 10.6375 10.6375 10.6902 10.6902 10.8215 10.8215 10.9484 10.9484 10.9833 10.9833 11.0247 11.0247 11.1772 11.1772 12.3709 12.3709 12.6810 12.6810 12.8638 12.8638 12.9807 12.9807 13.3532 13.3532 13.6741 13.6741 13.9960 13.9960 14.1187 14.1187 k = 0.2262 0.2262-0.0000 ( 5654 PWs) bands (ev): -5.2461 -5.2461 -3.7590 -3.7590 -3.7558 -3.7558 -3.4154 -3.4154 -1.1062 -1.1062 -1.0033 -1.0033 -0.9032 -0.9032 -0.2332 -0.2332 4.1170 4.1170 4.1559 4.1559 4.5462 4.5462 5.1279 5.1279 5.3319 5.3319 5.5878 5.5878 5.6125 5.6125 6.0126 6.0126 6.5419 6.5419 6.9904 6.9904 7.1164 7.1164 7.2218 7.2218 7.3919 7.3919 7.7678 7.7678 7.8027 7.8027 7.9778 7.9778 8.2557 8.2557 8.5110 8.5110 8.6093 8.6093 9.4751 9.4751 10.3503 10.3503 10.3970 10.3970 10.4452 10.4452 10.5753 10.5753 10.5986 10.5986 10.6541 10.6541 10.6948 10.6948 10.8258 10.8258 10.9435 10.9435 10.9761 10.9761 11.0153 11.0153 11.1786 11.1786 12.3463 12.3463 12.6780 12.6780 12.8460 12.8460 12.9388 12.9388 13.3985 13.3985 13.7458 13.7458 14.0118 14.0118 14.1570 14.1570 k = 0.2143 0.2143-0.0000 ( 5646 PWs) bands (ev): -5.2832 -5.2832 -3.7361 -3.7361 -3.7331 -3.7331 -3.4147 -3.4147 -1.1100 -1.1100 -1.0091 -1.0091 -0.9182 -0.9182 -0.1884 -0.1884 4.1513 4.1513 4.1810 4.1810 4.5422 4.5422 5.1523 5.1523 5.3658 5.3658 5.5854 5.5854 5.6153 5.6153 5.9799 5.9799 6.5115 6.5115 6.9688 6.9688 7.0919 7.0919 7.2254 7.2254 7.3539 7.3539 7.7071 7.7071 7.7929 7.7929 7.9482 7.9482 8.1946 8.1946 8.5111 8.5111 8.6457 8.6457 9.4353 9.4353 10.3389 10.3389 10.4100 10.4100 10.4334 10.4334 10.5644 10.5644 10.6192 10.6192 10.6681 10.6681 10.7027 10.7027 10.8302 10.8302 10.9370 10.9370 10.9690 10.9690 11.0057 11.0057 11.1791 11.1791 12.3194 12.3194 12.6760 12.6760 12.8280 12.8280 12.9014 12.9014 13.4470 13.4470 13.8175 13.8175 14.0264 14.0264 14.1952 14.1952 k = 0.2024 0.2024-0.0000 ( 5642 PWs) bands (ev): -5.3185 -5.3185 -3.7133 -3.7133 -3.7104 -3.7104 -3.4152 -3.4152 -1.1137 -1.1137 -1.0159 -1.0159 -0.9340 -0.9340 -0.1439 -0.1439 4.1869 4.1869 4.2077 4.2077 4.5407 4.5407 5.1679 5.1679 5.3994 5.3994 5.5671 5.5671 5.6455 5.6455 5.9488 5.9488 6.4776 6.4776 6.9521 6.9521 7.0560 7.0560 7.2421 7.2421 7.3153 7.3153 7.6460 7.6460 7.7840 7.7840 7.9149 7.9149 8.1325 8.1325 8.5147 8.5147 8.6792 8.6792 9.3924 9.3924 10.3263 10.3263 10.4011 10.4011 10.4402 10.4402 10.5540 10.5540 10.6394 10.6394 10.6795 10.6795 10.7145 10.7145 10.8344 10.8344 10.9293 10.9293 10.9618 10.9618 10.9962 10.9962 11.1787 11.1787 12.2896 12.2896 12.6751 12.6751 12.8099 12.8099 12.8690 12.8690 13.4983 13.4983 13.8879 13.8879 14.0405 14.0405 14.2341 14.2341 k = 0.1905 0.1905-0.0000 ( 5638 PWs) bands (ev): -5.3521 -5.3521 -3.6905 -3.6905 -3.6878 -3.6878 -3.4167 -3.4167 -1.1171 -1.1171 -1.0235 -1.0235 -0.9505 -0.9505 -0.0999 -0.0999 4.2233 4.2233 4.2360 4.2360 4.5414 4.5414 5.1772 5.1772 5.4305 5.4305 5.5516 5.5516 5.6804 5.6804 5.9234 5.9234 6.4411 6.4411 6.9383 6.9383 7.0146 7.0146 7.2627 7.2627 7.2787 7.2787 7.5872 7.5872 7.7753 7.7753 7.8787 7.8787 8.0713 8.0713 8.5214 8.5214 8.7088 8.7088 9.3469 9.3469 10.3130 10.3130 10.3834 10.3834 10.4497 10.4497 10.5480 10.5480 10.6555 10.6555 10.6914 10.6914 10.7288 10.7288 10.8384 10.8384 10.9212 10.9212 10.9547 10.9547 10.9868 10.9868 11.1774 11.1774 12.2566 12.2566 12.6752 12.6752 12.7921 12.7921 12.8422 12.8422 13.5521 13.5521 13.9549 13.9549 14.0544 14.0544 14.2749 14.2749 k = 0.1786 0.1786-0.0000 ( 5645 PWs) bands (ev): -5.3837 -5.3837 -3.6679 -3.6679 -3.6654 -3.6654 -3.4190 -3.4190 -1.1202 -1.1202 -1.0319 -1.0319 -0.9674 -0.9674 -0.0567 -0.0567 4.2600 4.2600 4.2662 4.2662 4.5443 4.5443 5.1829 5.1829 5.4539 5.4539 5.5455 5.5455 5.7076 5.7076 5.9123 5.9123 6.4028 6.4028 6.9247 6.9247 6.9704 6.9704 7.2320 7.2320 7.2953 7.2953 7.5330 7.5330 7.7667 7.7667 7.8403 7.8403 8.0126 8.0126 8.5307 8.5307 8.7338 8.7338 9.2995 9.2995 10.2992 10.2992 10.3642 10.3642 10.4508 10.4508 10.5494 10.5494 10.6660 10.6660 10.7066 10.7066 10.7441 10.7441 10.8421 10.8421 10.9130 10.9130 10.9477 10.9477 10.9778 10.9778 11.1755 11.1755 12.2202 12.2202 12.6762 12.6762 12.7752 12.7752 12.8204 12.8204 13.6080 13.6080 14.0160 14.0160 14.0688 14.0688 14.3187 14.3187 k = 0.1667 0.1667-0.0000 ( 5655 PWs) bands (ev): -5.4135 -5.4135 -3.6457 -3.6457 -3.6434 -3.6434 -3.4219 -3.4219 -1.1232 -1.1232 -1.0409 -1.0409 -0.9846 -0.9846 -0.0148 -0.0148 4.2943 4.2943 4.3002 4.3002 4.5491 4.5491 5.1874 5.1874 5.4613 5.4613 5.5576 5.5576 5.7140 5.7140 5.9263 5.9263 6.3639 6.3639 6.9072 6.9072 6.9258 6.9258 7.1873 7.1873 7.3249 7.3249 7.4861 7.4861 7.7576 7.7576 7.8007 7.8007 7.9576 7.9576 8.5422 8.5422 8.7542 8.7542 9.2505 9.2505 10.2853 10.2853 10.3447 10.3447 10.4420 10.4420 10.5585 10.5585 10.6723 10.6723 10.7241 10.7241 10.7592 10.7592 10.8454 10.8454 10.9052 10.9052 10.9410 10.9410 10.9694 10.9694 11.1731 11.1731 12.1807 12.1807 12.6782 12.6782 12.7602 12.7602 12.8028 12.8028 13.6653 13.6653 14.0660 14.0660 14.0872 14.0872 14.3664 14.3664 k = 0.1548 0.1548-0.0000 ( 5649 PWs) bands (ev): -5.4413 -5.4413 -3.6240 -3.6240 -3.6219 -3.6219 -3.4253 -3.4253 -1.1260 -1.1260 -1.0505 -1.0505 -1.0018 -1.0018 0.0257 0.0257 4.3269 4.3269 4.3371 4.3371 4.5555 4.5555 5.1925 5.1925 5.4548 5.4548 5.5861 5.5861 5.6985 5.6985 5.9649 5.9649 6.3257 6.3257 6.8717 6.8717 6.8930 6.8930 7.1381 7.1381 7.3559 7.3559 7.4490 7.4490 7.7461 7.7461 7.7626 7.7626 7.9081 7.9081 8.5556 8.5556 8.7701 8.7701 9.2007 9.2007 10.2714 10.2714 10.3253 10.3253 10.4256 10.4256 10.5725 10.5725 10.6766 10.6766 10.7421 10.7421 10.7737 10.7737 10.8481 10.8481 10.8984 10.8984 10.9349 10.9349 10.9618 10.9618 11.1704 11.1704 12.1386 12.1386 12.6809 12.6809 12.7478 12.7478 12.7883 12.7883 13.7237 13.7237 14.0914 14.0914 14.1217 14.1217 14.4139 14.4139 k = 0.1429 0.1429-0.0000 ( 5641 PWs) bands (ev): -5.4672 -5.4672 -3.6029 -3.6029 -3.6010 -3.6010 -3.4290 -3.4290 -1.1285 -1.1285 -1.0604 -1.0604 -1.0189 -1.0189 0.0644 0.0644 4.3597 4.3597 4.3739 4.3739 4.5631 4.5631 5.1993 5.1993 5.4436 5.4436 5.6224 5.6224 5.6707 5.6707 6.0168 6.0168 6.2893 6.2893 6.8237 6.8237 6.8651 6.8651 7.0839 7.0839 7.3865 7.3865 7.4232 7.4232 7.7162 7.7162 7.7421 7.7421 7.8658 7.8658 8.5705 8.5705 8.7813 8.7813 9.1503 9.1503 10.2575 10.2575 10.3062 10.3062 10.4045 10.4045 10.5884 10.5884 10.6800 10.6800 10.7593 10.7593 10.7872 10.7872 10.8501 10.8501 10.8930 10.8930 10.9294 10.9294 10.9551 10.9551 11.1676 11.1676 12.0944 12.0944 12.6844 12.6844 12.7382 12.7382 12.7764 12.7764 13.7824 13.7824 14.1076 14.1076 14.1569 14.1569 14.4284 14.4284 k = 0.1310 0.1310-0.0000 ( 5645 PWs) bands (ev): -5.4911 -5.4911 -3.5827 -3.5827 -3.5810 -3.5810 -3.4329 -3.4329 -1.1309 -1.1309 -1.0706 -1.0706 -1.0357 -1.0357 0.1011 0.1011 4.3930 4.3930 4.4098 4.4098 4.5715 4.5715 5.2085 5.2085 5.4316 5.4316 5.6371 5.6371 5.6634 5.6634 6.0738 6.0738 6.2555 6.2555 6.7741 6.7741 6.8311 6.8311 7.0250 7.0250 7.4049 7.4049 7.4188 7.4188 7.6778 7.6778 7.7294 7.7294 7.8327 7.8327 8.5866 8.5866 8.7882 8.7882 9.1000 9.1000 10.2439 10.2439 10.2878 10.2878 10.3804 10.3804 10.6044 10.6044 10.6829 10.6829 10.7752 10.7752 10.7994 10.7994 10.8512 10.8512 10.8895 10.8895 10.9247 10.9247 10.9494 10.9494 11.1646 11.1646 12.0490 12.0490 12.6883 12.6883 12.7312 12.7312 12.7665 12.7665 13.8408 13.8408 14.1233 14.1233 14.1851 14.1851 14.4399 14.4399 k = 0.1190 0.1190-0.0000 ( 5637 PWs) bands (ev): -5.5130 -5.5130 -3.5635 -3.5635 -3.5620 -3.5620 -3.4368 -3.4368 -1.1330 -1.1330 -1.0808 -1.0808 -1.0519 -1.0519 0.1354 0.1354 4.4264 4.4264 4.4445 4.4445 4.5804 4.5804 5.2206 5.2206 5.4206 5.4206 5.6026 5.6026 5.7063 5.7063 6.1310 6.1310 6.2257 6.2257 6.7242 6.7242 6.7905 6.7905 6.9623 6.9623 7.3996 7.3996 7.4438 7.4438 7.6405 7.6405 7.7166 7.7166 7.8101 7.8101 8.6035 8.6035 8.7911 8.7911 9.0502 9.0502 10.2306 10.2306 10.2703 10.2703 10.3544 10.3544 10.6201 10.6201 10.6856 10.6856 10.7895 10.7895 10.8102 10.8102 10.8514 10.8514 10.8883 10.8883 10.9209 10.9209 10.9447 10.9447 11.1618 11.1618 12.0032 12.0032 12.6925 12.6925 12.7264 12.7264 12.7582 12.7582 13.8983 13.8983 14.1392 14.1392 14.2071 14.2071 14.4502 14.4502 k = 0.1071 0.1071-0.0000 ( 5627 PWs) bands (ev): -5.5329 -5.5329 -3.5455 -3.5455 -3.5442 -3.5442 -3.4407 -3.4407 -1.1350 -1.1350 -1.0908 -1.0908 -1.0674 -1.0674 0.1673 0.1673 4.4593 4.4593 4.4773 4.4773 4.5894 4.5894 5.2356 5.2356 5.4111 5.4111 5.5680 5.5680 5.7517 5.7517 6.1815 6.1815 6.2049 6.2049 6.6752 6.6752 6.7440 6.7440 6.8966 6.8966 7.3997 7.3997 7.4644 7.4644 7.6055 7.6055 7.7062 7.7062 7.7968 7.7968 8.6209 8.6209 8.7902 8.7902 9.0015 9.0015 10.2176 10.2176 10.2541 10.2541 10.3276 10.3276 10.6347 10.6347 10.6881 10.6881 10.8020 10.8020 10.8193 10.8193 10.8508 10.8508 10.8892 10.8892 10.9180 10.9180 10.9410 10.9410 11.1591 11.1591 11.9578 11.9578 12.6969 12.6969 12.7234 12.7234 12.7516 12.7516 13.9541 13.9541 14.1554 14.1554 14.2243 14.2243 14.4594 14.4594 k = 0.0952 0.0952-0.0000 ( 5617 PWs) bands (ev): -5.5507 -5.5507 -3.5288 -3.5288 -3.5277 -3.5277 -3.4444 -3.4444 -1.1368 -1.1368 -1.1005 -1.1005 -1.0818 -1.0818 0.1964 0.1964 4.4912 4.4912 4.5080 4.5080 4.5982 4.5982 5.2532 5.2532 5.4032 5.4032 5.5345 5.5345 5.7994 5.7994 6.1762 6.1762 6.2404 6.2404 6.6283 6.6283 6.6929 6.6929 6.8290 6.8290 7.4040 7.4040 7.4773 7.4773 7.5736 7.5736 7.7027 7.7027 7.7901 7.7901 8.6381 8.6381 8.7861 8.7861 8.9545 8.9545 10.2051 10.2051 10.2394 10.2394 10.3010 10.3010 10.6481 10.6481 10.6904 10.6904 10.8126 10.8126 10.8267 10.8267 10.8497 10.8497 10.8919 10.8919 10.9161 10.9161 10.9383 10.9383 11.1566 11.1566 11.9139 11.9139 12.7012 12.7012 12.7219 12.7219 12.7463 12.7463 14.0073 14.0073 14.1719 14.1719 14.2377 14.2377 14.4674 14.4674 k = 0.0833 0.0833-0.0000 ( 5621 PWs) bands (ev): -5.5665 -5.5665 -3.5136 -3.5136 -3.5127 -3.5127 -3.4479 -3.4479 -1.1384 -1.1384 -1.1096 -1.1096 -1.0951 -1.0951 0.2225 0.2225 4.5215 4.5215 4.5361 4.5361 4.6064 4.6064 5.2731 5.2731 5.3970 5.3970 5.5029 5.5029 5.8494 5.8494 6.1622 6.1622 6.2833 6.2833 6.5856 6.5856 6.6387 6.6387 6.7599 6.7599 7.4109 7.4109 7.4816 7.4816 7.5451 7.5451 7.7083 7.7083 7.7877 7.7877 8.6548 8.6548 8.7794 8.7794 8.9100 8.9100 10.1931 10.1931 10.2263 10.2263 10.2754 10.2754 10.6600 10.6600 10.6924 10.6924 10.8214 10.8214 10.8325 10.8325 10.8486 10.8486 10.8959 10.8959 10.9151 10.9151 10.9363 10.9363 11.1544 11.1544 11.8722 11.8722 12.7052 12.7052 12.7211 12.7211 12.7423 12.7423 14.0571 14.0571 14.1885 14.1885 14.2483 14.2483 14.4740 14.4740 k = 0.0714 0.0714-0.0000 ( 5629 PWs) bands (ev): -5.5802 -5.5802 -3.5001 -3.5001 -3.4994 -3.4994 -3.4511 -3.4511 -1.1398 -1.1398 -1.1179 -1.1179 -1.1070 -1.1070 0.2456 0.2456 4.5495 4.5495 4.5614 4.5614 4.6140 4.6140 5.2944 5.2944 5.3923 5.3923 5.4739 5.4739 5.9017 5.9017 6.1543 6.1543 6.3162 6.3162 6.5497 6.5497 6.5836 6.5836 6.6899 6.6899 7.4189 7.4189 7.4791 7.4791 7.5204 7.5204 7.7218 7.7218 7.7882 7.7882 8.6702 8.6702 8.7709 8.7709 8.8688 8.8688 10.1817 10.1817 10.2150 10.2150 10.2518 10.2518 10.6704 10.6704 10.6942 10.6942 10.8284 10.8284 10.8367 10.8367 10.8475 10.8475 10.9005 10.9005 10.9149 10.9149 10.9351 10.9351 11.1524 11.1524 11.8338 11.8338 12.7089 12.7089 12.7209 12.7209 12.7395 12.7395 14.1025 14.1025 14.2053 14.2053 14.2571 14.2571 14.4793 14.4793 k = 0.0595 0.0595-0.0000 ( 5645 PWs) bands (ev): -5.5918 -5.5918 -3.4884 -3.4884 -3.4878 -3.4878 -3.4539 -3.4539 -1.1411 -1.1411 -1.1253 -1.1253 -1.1173 -1.1173 0.2653 0.2653 4.5744 4.5744 4.5834 4.5834 4.6206 4.6206 5.3161 5.3161 5.3889 5.3889 5.4480 5.4480 5.9562 5.9562 6.1534 6.1534 6.3342 6.3342 6.5168 6.5168 6.5377 6.5377 6.6195 6.6195 7.4269 7.4269 7.4728 7.4728 7.4997 7.4997 7.7399 7.7399 7.7904 7.7904 8.6834 8.6834 8.7617 8.7617 8.8318 8.8318 10.1711 10.1711 10.2054 10.2054 10.2310 10.2310 10.6792 10.6792 10.6957 10.6957 10.8338 10.8338 10.8397 10.8397 10.8466 10.8466 10.9052 10.9052 10.9152 10.9152 10.9344 10.9344 11.1507 11.1507 11.7994 11.7994 12.7120 12.7120 12.7207 12.7207 12.7379 12.7379 14.1421 14.1421 14.2221 14.2221 14.2645 14.2645 14.4831 14.4831 k = 0.0476 0.0476-0.0000 ( 5651 PWs) bands (ev): -5.6013 -5.6013 -3.4787 -3.4787 -3.4781 -3.4781 -3.4563 -3.4563 -1.1424 -1.1424 -1.1315 -1.1315 -1.1259 -1.1259 0.2817 0.2817 4.5958 4.5958 4.6020 4.6020 4.6262 4.6262 5.3369 5.3369 5.3866 5.3866 5.4260 5.4260 6.0129 6.0129 6.1598 6.1598 6.3354 6.3354 6.4663 6.4663 6.5245 6.5245 6.5501 6.5501 7.4341 7.4341 7.4651 7.4651 7.4834 7.4834 7.7591 7.7591 7.7936 7.7936 8.6933 8.6933 8.7531 8.7531 8.8003 8.8003 10.1615 10.1615 10.1975 10.1975 10.2137 10.2137 10.6864 10.6864 10.6970 10.6970 10.8381 10.8381 10.8418 10.8418 10.8459 10.8459 10.9095 10.9095 10.9158 10.9158 10.9343 10.9343 11.1493 11.1493 11.7699 11.7699 12.7146 12.7146 12.7205 12.7205 12.7374 12.7374 14.1742 14.1742 14.2392 14.2392 14.2712 14.2712 14.4855 14.4855 k = 0.0357 0.0357-0.0000 ( 5649 PWs) bands (ev): -5.6087 -5.6087 -3.4710 -3.4710 -3.4704 -3.4704 -3.4582 -3.4582 -1.1438 -1.1438 -1.1363 -1.1363 -1.1326 -1.1326 0.2945 0.2945 4.6129 4.6129 4.6170 4.6170 4.6307 4.6307 5.3553 5.3553 5.3851 5.3851 5.4084 5.4084 6.0717 6.0717 6.1736 6.1736 6.3247 6.3247 6.4139 6.4139 6.4782 6.4782 6.5298 6.5298 7.4399 7.4399 7.4576 7.4576 7.4716 7.4716 7.7768 7.7768 7.7972 7.7972 8.6985 8.6985 8.7470 8.7470 8.7755 8.7755 10.1532 10.1532 10.1915 10.1915 10.2003 10.2003 10.6920 10.6920 10.6980 10.6980 10.8411 10.8411 10.8433 10.8433 10.8454 10.8454 10.9131 10.9131 10.9165 10.9165 10.9344 10.9344 11.1481 11.1481 11.7461 11.7461 12.7167 12.7167 12.7201 12.7201 12.7375 12.7375 14.1974 14.1974 14.2565 14.2565 14.2773 14.2773 14.4864 14.4864 k = 0.0238 0.0238-0.0000 ( 5647 PWs) bands (ev): -5.6140 -5.6140 -3.4654 -3.4654 -3.4649 -3.4649 -3.4595 -3.4595 -1.1454 -1.1454 -1.1392 -1.1392 -1.1372 -1.1372 0.3037 0.3037 4.6251 4.6251 4.6281 4.6281 4.6340 4.6340 5.3691 5.3691 5.3844 5.3844 5.3959 5.3959 6.1320 6.1320 6.1941 6.1941 6.3098 6.3098 6.3656 6.3656 6.4106 6.4106 6.5367 6.5367 7.4436 7.4436 7.4513 7.4513 7.4646 7.4646 7.7909 7.7909 7.8002 7.8002 8.6984 8.6984 8.7446 8.7446 8.7582 8.7582 10.1467 10.1467 10.1871 10.1871 10.1909 10.1909 10.6961 10.6961 10.6987 10.6987 10.8433 10.8433 10.8443 10.8443 10.8452 10.8452 10.9157 10.9157 10.9172 10.9172 10.9348 10.9348 11.1474 11.1474 11.7286 11.7286 12.7182 12.7182 12.7197 12.7197 12.7378 12.7378 14.2120 14.2120 14.2723 14.2723 14.2825 14.2825 14.4862 14.4862 k = 0.0119 0.0119-0.0000 ( 5663 PWs) bands (ev): -5.6172 -5.6172 -3.4621 -3.4621 -3.4616 -3.4616 -3.4603 -3.4603 -1.1470 -1.1470 -1.1406 -1.1406 -1.1400 -1.1400 0.3093 0.3093 4.6320 4.6320 4.6351 4.6351 4.6364 4.6364 5.3755 5.3755 5.3857 5.3857 5.3891 5.3891 6.1920 6.1920 6.2188 6.2188 6.2928 6.2928 6.3275 6.3275 6.3482 6.3482 6.5426 6.5426 7.4451 7.4451 7.4469 7.4469 7.4616 7.4616 7.8000 7.8000 7.8023 7.8023 8.6958 8.6958 8.7446 8.7446 8.7481 8.7481 10.1425 10.1425 10.1845 10.1845 10.1854 10.1854 10.6984 10.6984 10.6991 10.6991 10.8445 10.8445 10.8447 10.8447 10.8449 10.8449 10.9173 10.9173 10.9176 10.9176 10.9350 10.9350 11.1468 11.1468 11.7179 11.7179 12.7190 12.7190 12.7194 12.7194 12.7381 12.7381 14.2196 14.2196 14.2834 14.2834 14.2861 14.2861 14.4855 14.4855 k = 0.0000 0.0000 0.0000 ( 5695 PWs) bands (ev): -5.6182 -5.6182 -3.4610 -3.4610 -3.4610 -3.4610 -3.4601 -3.4601 -1.1476 -1.1476 -1.1409 -1.1409 -1.1409 -1.1409 0.3111 0.3111 4.6339 4.6339 4.6374 4.6374 4.6374 4.6374 5.3762 5.3762 5.3873 5.3873 5.3873 5.3873 6.2345 6.2345 6.2345 6.2345 6.2709 6.2709 6.3140 6.3140 6.3140 6.3140 6.5448 6.5448 7.4454 7.4454 7.4454 7.4454 7.4608 7.4608 7.8031 7.8031 7.8031 7.8031 8.6944 8.6944 8.7449 8.7449 8.7449 8.7449 10.1410 10.1410 10.1835 10.1835 10.1835 10.1835 10.6991 10.6991 10.6991 10.6991 10.8448 10.8448 10.8448 10.8448 10.8448 10.8448 10.9177 10.9177 10.9177 10.9177 10.9351 10.9351 11.1466 11.1466 11.7143 11.7143 12.7193 12.7193 12.7193 12.7193 12.7382 12.7382 14.2220 14.2220 14.2874 14.2874 14.2874 14.2874 14.4852 14.4852 k = 0.0000 0.0000 0.0000 ( 5695 PWs) bands (ev): -5.6182 -5.6182 -3.4610 -3.4610 -3.4610 -3.4610 -3.4601 -3.4601 -1.1476 -1.1476 -1.1409 -1.1409 -1.1409 -1.1409 0.3111 0.3111 4.6339 4.6339 4.6374 4.6374 4.6374 4.6374 5.3762 5.3762 5.3873 5.3873 5.3873 5.3873 6.2345 6.2345 6.2345 6.2345 6.2709 6.2709 6.3140 6.3140 6.3140 6.3140 6.5448 6.5448 7.4454 7.4454 7.4454 7.4454 7.4608 7.4608 7.8031 7.8031 7.8031 7.8031 8.6944 8.6944 8.7449 8.7449 8.7449 8.7449 10.1410 10.1410 10.1835 10.1835 10.1835 10.1835 10.6991 10.6991 10.6991 10.6991 10.8448 10.8448 10.8448 10.8448 10.8448 10.8448 10.9177 10.9177 10.9177 10.9177 10.9351 10.9351 11.1466 11.1466 11.7143 11.7143 12.7193 12.7193 12.7193 12.7193 12.7382 12.7382 14.2220 14.2220 14.2874 14.2874 14.2874 14.2874 14.4852 14.4852 k = 0.0098 0.0098 0.0098 ( 5653 PWs) bands (ev): -5.6171 -5.6171 -3.4617 -3.4617 -3.4616 -3.4616 -3.4608 -3.4608 -1.1470 -1.1470 -1.1406 -1.1406 -1.1399 -1.1399 0.3093 0.3093 4.6322 4.6322 4.6355 4.6355 4.6358 4.6358 5.3760 5.3760 5.3865 5.3865 5.3879 5.3879 6.1995 6.1995 6.2080 6.2080 6.2952 6.2952 6.3331 6.3331 6.3437 6.3437 6.5426 6.5426 7.4455 7.4455 7.4466 7.4466 7.4615 7.4615 7.8011 7.8011 7.8011 7.8011 8.6959 8.6959 8.7455 8.7455 8.7473 8.7473 10.1426 10.1426 10.1849 10.1849 10.1851 10.1851 10.6988 10.6988 10.6988 10.6988 10.8446 10.8446 10.8448 10.8448 10.8448 10.8448 10.9173 10.9173 10.9177 10.9177 10.9351 10.9351 11.1469 11.1469 11.7179 11.7179 12.7192 12.7192 12.7194 12.7194 12.7382 12.7382 14.2196 14.2196 14.2833 14.2833 14.2862 14.2862 14.4855 14.4855 k = 0.0196 0.0196 0.0196 ( 5647 PWs) bands (ev): -5.6139 -5.6139 -3.4638 -3.4638 -3.4634 -3.4634 -3.4627 -3.4627 -1.1454 -1.1454 -1.1396 -1.1396 -1.1368 -1.1368 0.3036 0.3036 4.6265 4.6265 4.6297 4.6297 4.6306 4.6306 5.3744 5.3744 5.3854 5.3854 5.3897 5.3897 6.1525 6.1525 6.1642 6.1642 6.3160 6.3160 6.3830 6.3830 6.3969 6.3969 6.5369 6.5369 7.4457 7.4457 7.4502 7.4502 7.4637 7.4637 7.7953 7.7953 7.7955 7.7955 8.6998 8.6998 8.7474 8.7474 8.7543 8.7543 10.1470 10.1470 10.1887 10.1887 10.1894 10.1894 10.6973 10.6973 10.6974 10.6974 10.8436 10.8436 10.8445 10.8445 10.8446 10.8446 10.9157 10.9157 10.9172 10.9172 10.9347 10.9347 11.1474 11.1474 11.7288 11.7288 12.7186 12.7186 12.7194 12.7194 12.7378 12.7378 14.2115 14.2115 14.2723 14.2723 14.2825 14.2825 14.4864 14.4864 k = 0.0294 0.0294 0.0294 ( 5650 PWs) bands (ev): -5.6085 -5.6085 -3.4675 -3.4675 -3.4665 -3.4665 -3.4659 -3.4659 -1.1432 -1.1432 -1.1380 -1.1380 -1.1311 -1.1311 0.2942 0.2942 4.6164 4.6164 4.6206 4.6206 4.6222 4.6222 5.3699 5.3699 5.3864 5.3864 5.3927 5.3927 6.1080 6.1080 6.1209 6.1209 6.3364 6.3364 6.4412 6.4412 6.4556 6.4556 6.5314 6.5314 7.4455 7.4455 7.4559 7.4559 7.4679 7.4679 7.7863 7.7863 7.7868 7.7868 8.7047 8.7047 8.7519 8.7519 8.7655 8.7655 10.1542 10.1542 10.1949 10.1949 10.1966 10.1966 10.6948 10.6948 10.6951 10.6951 10.8417 10.8417 10.8440 10.8440 10.8441 10.8441 10.9132 10.9132 10.9165 10.9165 10.9342 10.9342 11.1481 11.1481 11.7466 11.7466 12.7176 12.7176 12.7194 12.7194 12.7372 12.7372 14.1957 14.1957 14.2582 14.2582 14.2764 14.2764 14.4876 14.4876 k = 0.0392 0.0392 0.0392 ( 5638 PWs) bands (ev): -5.6010 -5.6010 -3.4726 -3.4726 -3.4708 -3.4708 -3.4702 -3.4702 -1.1407 -1.1407 -1.1358 -1.1358 -1.1229 -1.1229 0.2811 0.2811 4.6018 4.6018 4.6088 4.6088 4.6105 4.6105 5.3640 5.3640 5.3894 5.3894 5.3969 5.3969 6.0677 6.0677 6.0812 6.0812 6.3514 6.3514 6.4996 6.4996 6.5163 6.5163 6.5361 6.5361 7.4451 7.4451 7.4635 7.4635 7.4739 7.4739 7.7750 7.7750 7.7760 7.7760 8.7084 8.7084 8.7604 8.7604 8.7806 8.7806 10.1641 10.1641 10.2033 10.2033 10.2066 10.2066 10.6914 10.6914 10.6919 10.6919 10.8391 10.8391 10.8434 10.8434 10.8435 10.8435 10.9100 10.9100 10.9155 10.9155 10.9337 10.9337 11.1493 11.1493 11.7708 11.7708 12.7163 12.7163 12.7194 12.7194 12.7368 12.7368 14.1702 14.1702 14.2446 14.2446 14.2681 14.2681 14.4888 14.4888 k = 0.0490 0.0490 0.0490 ( 5644 PWs) bands (ev): -5.5913 -5.5913 -3.4791 -3.4791 -3.4762 -3.4762 -3.4757 -3.4757 -1.1377 -1.1377 -1.1331 -1.1331 -1.1123 -1.1123 0.2645 0.2645 4.5830 4.5830 4.5942 4.5942 4.5959 4.5959 5.3584 5.3584 5.3939 5.3939 5.4021 5.4021 6.0322 6.0322 6.0460 6.0460 6.3492 6.3492 6.5453 6.5453 6.5730 6.5730 6.5778 6.5778 7.4450 7.4450 7.4724 7.4724 7.4811 7.4811 7.7628 7.7628 7.7645 7.7645 8.7092 8.7092 8.7738 8.7738 8.7988 8.7988 10.1763 10.1763 10.2139 10.2139 10.2192 10.2192 10.6869 10.6869 10.6877 10.6877 10.8353 10.8353 10.8426 10.8426 10.8427 10.8427 10.9064 10.9064 10.9143 10.9143 10.9333 10.9333 11.1508 11.1508 11.8006 11.8006 12.7147 12.7147 12.7193 12.7193 12.7366 12.7366 14.1358 14.1358 14.2323 14.2323 14.2577 14.2577 14.4894 14.4894 k = 0.0588 0.0588 0.0588 ( 5641 PWs) bands (ev): -5.5795 -5.5795 -3.4869 -3.4869 -3.4827 -3.4827 -3.4822 -3.4822 -1.1344 -1.1344 -1.1300 -1.1300 -1.0996 -1.0996 0.2443 0.2443 4.5603 4.5603 4.5769 4.5769 4.5785 4.5785 5.3545 5.3545 5.3995 5.3995 5.4085 5.4085 6.0019 6.0019 6.0159 6.0159 6.3263 6.3263 6.5900 6.5900 6.6317 6.6317 6.6389 6.6389 7.4457 7.4457 7.4819 7.4819 7.4885 7.4885 7.7514 7.7514 7.7543 7.7543 8.7071 8.7071 8.7914 8.7914 8.8195 8.8195 10.1904 10.1904 10.2265 10.2265 10.2343 10.2343 10.6815 10.6815 10.6827 10.6827 10.8302 10.8302 10.8416 10.8416 10.8417 10.8417 10.9028 10.9028 10.9130 10.9130 10.9330 10.9330 11.1525 11.1525 11.8352 11.8352 12.7130 12.7130 12.7191 12.7191 12.7371 12.7371 14.0944 14.0944 14.2202 14.2202 14.2453 14.2453 14.4891 14.4891 k = 0.0686 0.0686 0.0686 ( 5635 PWs) bands (ev): -5.5656 -5.5656 -3.4958 -3.4958 -3.4902 -3.4902 -3.4898 -3.4898 -1.1308 -1.1308 -1.1265 -1.1265 -1.0849 -1.0849 0.2207 0.2207 4.5341 4.5341 4.5573 4.5573 4.5589 4.5589 5.3533 5.3533 5.4060 5.4060 5.4158 5.4158 5.9771 5.9771 5.9911 5.9911 6.2881 6.2881 6.6467 6.6467 6.6920 6.6920 6.6986 6.6986 7.4479 7.4479 7.4905 7.4905 7.4948 7.4948 7.7431 7.7431 7.7476 7.7476 8.7026 8.7026 8.8119 8.8119 8.8421 8.8421 10.2058 10.2058 10.2411 10.2411 10.2519 10.2519 10.6751 10.6751 10.6768 10.6768 10.8234 10.8234 10.8405 10.8405 10.8405 10.8405 10.8998 10.8998 10.9115 10.9115 10.9331 10.9331 11.1545 11.1545 11.8739 11.8739 12.7113 12.7113 12.7185 12.7185 12.7389 12.7389 14.0478 14.0478 14.2075 14.2075 14.2311 14.2311 14.4871 14.4871 k = 0.0784 0.0784 0.0784 ( 5641 PWs) bands (ev): -5.5495 -5.5495 -3.5059 -3.5059 -3.4987 -3.4987 -3.4983 -3.4983 -1.1270 -1.1270 -1.1229 -1.1229 -1.0685 -1.0685 0.1938 0.1938 4.5050 4.5050 4.5358 4.5358 4.5372 4.5372 5.3552 5.3552 5.4133 5.4133 5.4238 5.4238 5.9578 5.9578 5.9718 5.9718 6.2397 6.2397 6.7111 6.7111 6.7510 6.7510 6.7560 6.7560 7.4522 7.4522 7.4968 7.4968 7.4985 7.4985 7.7404 7.7404 7.7467 7.7467 8.6959 8.6959 8.8343 8.8343 8.8660 8.8660 10.2216 10.2216 10.2579 10.2579 10.2715 10.2715 10.6678 10.6678 10.6700 10.6700 10.8147 10.8147 10.8390 10.8390 10.8392 10.8392 10.8978 10.8978 10.9100 10.9100 10.9336 10.9336 11.1568 11.1568 11.9155 11.9155 12.7096 12.7096 12.7177 12.7177 12.7422 12.7422 13.9973 13.9973 14.1936 14.1936 14.2150 14.2150 14.4827 14.4827 k = 0.0882 0.0882 0.0882 ( 5635 PWs) bands (ev): -5.5314 -5.5314 -3.5169 -3.5169 -3.5081 -3.5081 -3.5077 -3.5077 -1.1232 -1.1232 -1.1192 -1.1192 -1.0505 -1.0505 0.1638 0.1638 4.4734 4.4734 4.5128 4.5128 4.5142 4.5142 5.3604 5.3604 5.4212 5.4212 5.4324 5.4324 5.9442 5.9442 5.9580 5.9580 6.1840 6.1840 6.7786 6.7786 6.8088 6.8088 6.8101 6.8101 7.4590 7.4590 7.4987 7.4987 7.4995 7.4995 7.7454 7.7454 7.7535 7.7535 8.6872 8.6872 8.8577 8.8577 8.8906 8.8906 10.2369 10.2369 10.2772 10.2772 10.2930 10.2930 10.6596 10.6596 10.6626 10.6626 10.8040 10.8040 10.8373 10.8373 10.8377 10.8377 10.8971 10.8971 10.9086 10.9086 10.9347 10.9347 11.1595 11.1595 11.9593 11.9593 12.7082 12.7082 12.7167 12.7167 12.7475 12.7475 13.9439 13.9439 14.1779 14.1779 14.1970 14.1970 14.4748 14.4748 k = 0.0980 0.0980 0.0980 ( 5647 PWs) bands (ev): -5.5112 -5.5112 -3.5288 -3.5288 -3.5183 -3.5183 -3.5179 -3.5179 -1.1194 -1.1194 -1.1156 -1.1156 -1.0313 -1.0313 0.1309 0.1309 4.4400 4.4400 4.4888 4.4888 4.4902 4.4902 5.3691 5.3691 5.4294 5.4294 5.4414 5.4414 5.9361 5.9361 5.9500 5.9500 6.1230 6.1230 6.8418 6.8418 6.8599 6.8599 6.8690 6.8690 7.4688 7.4688 7.4961 7.4961 7.4983 7.4983 7.7592 7.7592 7.7687 7.7687 8.6765 8.6765 8.8816 8.8816 8.9155 8.9155 10.2509 10.2509 10.2989 10.2989 10.3158 10.3158 10.6505 10.6505 10.6545 10.6545 10.7912 10.7912 10.8352 10.8352 10.8361 10.8361 10.8977 10.8977 10.9073 10.9073 10.9365 10.9365 11.1623 11.1623 12.0043 12.0043 12.7073 12.7073 12.7159 12.7159 12.7550 12.7550 13.8884 13.8884 14.1603 14.1603 14.1768 14.1768 14.4625 14.4625 k = 0.1078 0.1078 0.1078 ( 5647 PWs) bands (ev): -5.4889 -5.4889 -3.5413 -3.5413 -3.5291 -3.5291 -3.5289 -3.5289 -1.1158 -1.1158 -1.1121 -1.1121 -1.0110 -1.0110 0.0952 0.0952 4.4052 4.4052 4.4643 4.4643 4.4657 4.4657 5.3809 5.3809 5.4376 5.4376 5.4503 5.4503 5.9333 5.9333 5.9476 5.9476 6.0585 6.0585 6.8932 6.8932 6.9046 6.9046 6.9362 6.9362 7.4790 7.4790 7.4944 7.4944 7.4954 7.4954 7.7816 7.7816 7.7918 7.7918 8.6639 8.6639 8.9056 8.9056 8.9402 8.9402 10.2637 10.2637 10.3226 10.3226 10.3398 10.3398 10.6407 10.6407 10.6458 10.6458 10.7767 10.7767 10.8327 10.8327 10.8345 10.8345 10.8996 10.8996 10.9061 10.9061 10.9391 10.9391 11.1653 11.1653 12.0497 12.0497 12.7070 12.7070 12.7155 12.7155 12.7648 12.7648 13.8315 13.8315 14.1402 14.1402 14.1542 14.1542 14.4449 14.4449 k = 0.1176 0.1176 0.1176 ( 5650 PWs) bands (ev): -5.4646 -5.4646 -3.5546 -3.5546 -3.5407 -3.5407 -3.5404 -3.5404 -1.1125 -1.1125 -1.1090 -1.1090 -0.9901 -0.9901 0.0569 0.0569 4.3696 4.3696 4.4399 4.4399 4.4414 4.4414 5.3958 5.3958 5.4457 5.4457 5.4591 5.4591 5.9336 5.9336 5.9508 5.9508 5.9935 5.9935 6.9346 6.9346 6.9431 6.9431 7.0053 7.0053 7.4797 7.4797 7.4899 7.4899 7.5099 7.5099 7.8112 7.8112 7.8215 7.8215 8.6492 8.6492 8.9291 8.9291 8.9645 8.9645 10.2749 10.2749 10.3477 10.3477 10.3642 10.3642 10.6300 10.6300 10.6367 10.6367 10.7605 10.7605 10.8300 10.8300 10.8331 10.8331 10.9023 10.9023 10.9052 10.9052 10.9425 10.9425 11.1685 11.1685 12.0947 12.0947 12.7076 12.7076 12.7158 12.7158 12.7774 12.7774 13.7740 13.7740 14.1173 14.1173 14.1289 14.1289 14.4214 14.4214 k = 0.1275 0.1275 0.1275 ( 5656 PWs) bands (ev): -5.4383 -5.4383 -3.5683 -3.5683 -3.5527 -3.5527 -3.5525 -3.5525 -1.1096 -1.1096 -1.1063 -1.1063 -0.9686 -0.9686 0.0162 0.0162 4.3336 4.3336 4.4161 4.4161 4.4177 4.4177 5.4133 5.4133 5.4535 5.4535 5.4674 5.4674 5.9090 5.9090 5.9570 5.9570 5.9596 5.9596 6.9677 6.9677 6.9745 6.9745 7.0717 7.0717 7.4776 7.4776 7.4872 7.4872 7.5360 7.5360 7.8464 7.8464 7.8563 7.8563 8.6325 8.6325 8.9521 8.9521 8.9881 8.9881 10.2849 10.2849 10.3734 10.3734 10.3885 10.3885 10.6187 10.6187 10.6272 10.6272 10.7430 10.7430 10.8273 10.8273 10.8321 10.8321 10.9045 10.9045 10.9057 10.9057 10.9467 10.9467 11.1717 11.1717 12.1388 12.1388 12.7094 12.7094 12.7171 12.7171 12.7928 12.7928 13.7165 13.7165 14.0910 14.0910 14.1004 14.1004 14.3920 14.3920 k = 0.1373 0.1373 0.1373 ( 5647 PWs) bands (ev): -5.4099 -5.4099 -3.5823 -3.5823 -3.5652 -3.5652 -3.5650 -3.5650 -1.1074 -1.1074 -1.1042 -1.1042 -0.9471 -0.9471 -0.0267 -0.0267 4.2976 4.2976 4.3933 4.3933 4.3951 4.3951 5.4331 5.4331 5.4607 5.4607 5.4750 5.4750 5.8430 5.8430 5.9661 5.9661 5.9738 5.9738 6.9926 6.9926 6.9983 6.9983 7.1330 7.1330 7.4790 7.4790 7.4884 7.4884 7.5707 7.5707 7.8857 7.8857 7.8949 7.8949 8.6136 8.6136 8.9741 8.9741 9.0107 9.0107 10.2938 10.2938 10.3990 10.3990 10.4119 10.4119 10.6069 10.6069 10.6175 10.6175 10.7244 10.7244 10.8247 10.8247 10.8316 10.8316 10.9043 10.9043 10.9094 10.9094 10.9515 10.9515 11.1749 11.1749 12.1813 12.1813 12.7126 12.7126 12.7197 12.7197 12.8113 12.8113 13.6599 13.6599 14.0608 14.0608 14.0681 14.0681 14.3585 14.3585 k = 0.1471 0.1471 0.1471 ( 5653 PWs) bands (ev): -5.3797 -5.3797 -3.5967 -3.5967 -3.5780 -3.5780 -3.5779 -3.5779 -1.1059 -1.1059 -1.1029 -1.1029 -0.9257 -0.9257 -0.0716 -0.0716 4.2620 4.2620 4.3721 4.3721 4.3740 4.3740 5.4548 5.4548 5.4674 5.4674 5.4818 5.4818 5.7724 5.7724 5.9846 5.9846 5.9930 5.9930 7.0091 7.0091 7.0142 7.0142 7.1878 7.1878 7.4857 7.4857 7.4946 7.4946 7.6137 7.6137 7.9275 7.9275 7.9359 7.9359 8.5926 8.5926 8.9951 8.9951 9.0322 9.0322 10.3017 10.3017 10.4236 10.4236 10.4336 10.4336 10.5946 10.5946 10.6079 10.6079 10.7049 10.7049 10.8224 10.8224 10.8319 10.8319 10.9044 10.9044 10.9133 10.9133 10.9566 10.9566 11.1779 11.1779 12.2220 12.2220 12.7174 12.7174 12.7239 12.7239 12.8329 12.8329 13.6046 13.6046 14.0263 14.0263 14.0318 14.0318 14.3237 14.3237 k = 0.1569 0.1569 0.1569 ( 5647 PWs) bands (ev): -5.3475 -5.3475 -3.6111 -3.6111 -3.5911 -3.5911 -3.5910 -3.5910 -1.1052 -1.1052 -1.1024 -1.1024 -0.9048 -0.9048 -0.1182 -0.1182 4.2271 4.2271 4.3528 4.3528 4.3549 4.3549 5.4718 5.4718 5.4796 5.4796 5.4878 5.4878 5.7016 5.7016 6.0085 6.0085 6.0172 6.0172 7.0178 7.0178 7.0226 7.0226 7.2358 7.2358 7.4984 7.4984 7.5067 7.5067 7.6642 7.6642 7.9708 7.9708 7.9783 7.9783 8.5694 8.5694 9.0147 9.0147 9.0523 9.0523 10.3090 10.3090 10.4465 10.4465 10.4527 10.4527 10.5821 10.5821 10.5986 10.5986 10.6849 10.6849 10.8208 10.8208 10.8332 10.8332 10.9050 10.9050 10.9174 10.9174 10.9618 10.9618 11.1805 11.1805 12.2605 12.2605 12.7243 12.7243 12.7300 12.7300 12.8576 12.8576 13.5514 13.5514 13.9874 13.9874 13.9911 13.9911 14.2891 14.2891 k = 0.1667 0.1667 0.1667 ( 5677 PWs) bands (ev): -5.3134 -5.3134 -3.6257 -3.6257 -3.6044 -3.6044 -3.6043 -3.6043 -1.1054 -1.1054 -1.1028 -1.1028 -0.8847 -0.8847 -0.1664 -0.1664 4.1932 4.1932 4.3357 4.3357 4.3380 4.3380 5.4772 5.4772 5.4929 5.4929 5.5039 5.5039 5.6319 5.6319 6.0371 6.0371 6.0457 6.0457 7.0196 7.0196 7.0245 7.0245 7.2778 7.2778 7.5169 7.5169 7.5245 7.5245 7.7207 7.7207 8.0144 8.0144 8.0209 8.0209 8.5442 8.5442 9.0330 9.0330 9.0709 9.0709 10.3160 10.3160 10.4665 10.4665 10.4682 10.4682 10.5695 10.5695 10.5896 10.5896 10.6644 10.6644 10.8198 10.8198 10.8355 10.8355 10.9063 10.9063 10.9215 10.9215 10.9664 10.9664 11.1825 11.1825 12.2969 12.2969 12.7334 12.7334 12.7383 12.7383 12.8851 12.8851 13.5008 13.5008 13.9441 13.9441 13.9464 13.9464 14.2550 14.2550 k = 0.1765 0.1765 0.1765 ( 5659 PWs) bands (ev): -5.2775 -5.2775 -3.6402 -3.6402 -3.6178 -3.6178 -3.6178 -3.6178 -1.1067 -1.1067 -1.1042 -1.1042 -0.8658 -0.8658 -0.2159 -0.2159 4.1606 4.1606 4.3213 4.3213 4.3238 4.3238 5.4812 5.4812 5.4972 5.4972 5.5284 5.5284 5.5652 5.5652 6.0698 6.0698 6.0784 6.0784 7.0160 7.0160 7.0212 7.0212 7.3153 7.3153 7.5407 7.5407 7.5474 7.5474 7.7807 7.7807 8.0575 8.0575 8.0630 8.0630 8.5172 8.5172 9.0496 9.0496 9.0878 9.0878 10.3233 10.3233 10.4793 10.4793 10.4825 10.4825 10.5577 10.5577 10.5816 10.5816 10.6440 10.6440 10.8199 10.8199 10.8389 10.8389 10.9087 10.9087 10.9261 10.9261 10.9704 10.9704 11.1840 11.1840 12.3311 12.3311 12.7450 12.7450 12.7491 12.7491 12.9153 12.9153 13.4537 13.4537 13.8971 13.8971 13.8980 13.8980 14.2224 14.2224 k = 0.1863 0.1863 0.1863 ( 5665 PWs) bands (ev): -5.2398 -5.2398 -3.6546 -3.6546 -3.6312 -3.6312 -3.6312 -3.6312 -1.1091 -1.1091 -1.1068 -1.1068 -0.8484 -0.8484 -0.2665 -0.2665 4.1295 4.1295 4.3096 4.3096 4.3124 4.3124 5.4808 5.4808 5.4996 5.4996 5.5008 5.5008 5.5585 5.5585 6.1061 6.1061 6.1146 6.1146 7.0087 7.0087 7.0142 7.0142 7.3498 7.3498 7.5688 7.5688 7.5745 7.5745 7.8413 7.8413 8.0993 8.0993 8.1038 8.1038 8.4892 8.4892 9.0645 9.0645 9.1030 9.1030 10.3309 10.3309 10.4854 10.4854 10.4927 10.4927 10.5475 10.5475 10.5744 10.5744 10.6236 10.6236 10.8208 10.8208 10.8426 10.8426 10.9126 10.9126 10.9309 10.9309 10.9733 10.9733 11.1845 11.1845 12.3631 12.3631 12.7594 12.7594 12.7626 12.7626 12.9478 12.9478 13.4107 13.4107 13.8466 13.8466 13.8472 13.8472 14.1915 14.1919 k = 0.1961 0.1961 0.1961 ( 5656 PWs) bands (ev): -5.2003 -5.2003 -3.6688 -3.6688 -3.6446 -3.6446 -3.6446 -3.6446 -1.1126 -1.1126 -1.1105 -1.1105 -0.8328 -0.8328 -0.3179 -0.3179 4.1002 4.1002 4.3010 4.3010 4.3040 4.3040 5.4301 5.4301 5.4901 5.4901 5.5037 5.5037 5.5850 5.5850 6.1455 6.1455 6.1540 6.1540 6.9989 6.9989 7.0049 7.0049 7.3828 7.3828 7.6003 7.6003 7.6051 7.6051 7.8993 7.8993 8.1393 8.1393 8.1428 8.1428 8.4613 8.4613 9.0777 9.0777 9.1163 9.1163 10.3395 10.3395 10.4865 10.4865 10.4948 10.4948 10.5409 10.5409 10.5682 10.5682 10.6038 10.6038 10.8225 10.8225 10.8459 10.8459 10.9186 10.9186 10.9363 10.9363 10.9750 10.9750 11.1841 11.1841 12.3929 12.3929 12.7769 12.7769 12.7791 12.7791 12.9819 12.9819 13.3727 13.3727 13.7932 13.7932 13.7952 13.7952 14.1624 14.1624 k = 0.2059 0.2059 0.2059 ( 5665 PWs) bands (ev): -5.1591 -5.1591 -3.6827 -3.6827 -3.6579 -3.6579 -3.6578 -3.6578 -1.1173 -1.1173 -1.1153 -1.1153 -0.8195 -0.8195 -0.3700 -0.3700 4.0730 4.0730 4.2956 4.2956 4.2988 4.2988 5.3698 5.3698 5.4920 5.4920 5.5061 5.5061 5.6122 5.6122 6.1875 6.1875 6.1960 6.1960 6.9880 6.9880 6.9945 6.9945 7.4152 7.4152 7.6344 7.6344 7.6384 7.6384 7.9508 7.9508 8.1769 8.1769 8.1794 8.1794 8.4358 8.4358 9.0888 9.0888 9.1276 9.1276 10.3491 10.3491 10.4833 10.4833 10.4887 10.4887 10.5370 10.5370 10.5623 10.5623 10.5853 10.5853 10.8242 10.8242 10.8479 10.8479 10.9268 10.9268 10.9420 10.9420 10.9754 10.9754 11.1827 11.1827 12.4205 12.4205 12.7974 12.7974 12.7986 12.7986 13.0165 13.0165 13.3408 13.3408 13.7385 13.7385 13.7420 13.7420 14.1346 14.1346 k = 0.2157 0.2157 0.2157 ( 5659 PWs) bands (ev): -5.1163 -5.1163 -3.6962 -3.6962 -3.6711 -3.6711 -3.6709 -3.6709 -1.1231 -1.1231 -1.1214 -1.1214 -0.8086 -0.8086 -0.4226 -0.4226 4.0482 4.0482 4.2934 4.2934 4.2968 4.2968 5.3121 5.3121 5.4941 5.4941 5.5080 5.5080 5.6392 5.6392 6.2316 6.2316 6.2401 6.2401 6.9770 6.9770 6.9839 6.9839 7.4481 7.4481 7.6707 7.6707 7.6739 7.6739 7.9909 7.9909 8.2118 8.2118 8.2133 8.2133 8.4168 8.4168 9.0979 9.0979 9.1369 9.1369 10.3602 10.3602 10.4766 10.4766 10.4774 10.4774 10.5317 10.5317 10.5562 10.5562 10.5696 10.5696 10.8254 10.8254 10.8480 10.8480 10.9373 10.9373 10.9477 10.9477 10.9748 10.9748 11.1801 11.1801 12.4460 12.4460 12.8212 12.8212 12.8214 12.8214 13.0500 13.0500 13.3167 13.3167 13.6832 13.6832 13.6884 13.6884 14.1080 14.1080 k = 0.2255 0.2255 0.2255 ( 5641 PWs) bands (ev): -5.0719 -5.0719 -3.7093 -3.7093 -3.6840 -3.6840 -3.6838 -3.6838 -1.1302 -1.1302 -1.1286 -1.1286 -0.8007 -0.8007 -0.4753 -0.4753 4.0260 4.0260 4.2945 4.2945 4.2982 4.2982 5.2577 5.2577 5.4959 5.4959 5.5096 5.5096 5.6658 5.6658 6.2773 6.2773 6.2856 6.2856 6.9666 6.9666 6.9741 6.9741 7.4818 7.4818 7.7087 7.7087 7.7111 7.7111 8.0135 8.0135 8.2438 8.2438 8.2444 8.2444 8.4093 8.4093 9.1050 9.1050 9.1441 9.1441 10.3726 10.3726 10.4639 10.4639 10.4675 10.4675 10.5210 10.5210 10.5494 10.5494 10.5584 10.5584 10.8255 10.8255 10.8460 10.8460 10.9492 10.9492 10.9522 10.9522 10.9743 10.9743 11.1766 11.1766 12.4693 12.4693 12.8475 12.8475 12.8482 12.8482 13.0795 13.0795 13.3033 13.3033 13.6279 13.6279 13.6349 13.6349 14.0822 14.0822 k = 0.2353 0.2353 0.2353 ( 5647 PWs) bands (ev): -5.0259 -5.0259 -3.7220 -3.7220 -3.6966 -3.6966 -3.6964 -3.6964 -1.1385 -1.1385 -1.1370 -1.1370 -0.7959 -0.7959 -0.5279 -0.5279 4.0069 4.0069 4.2990 4.2990 4.3028 4.3028 5.2068 5.2068 5.4975 5.4975 5.5110 5.5110 5.6917 5.6917 6.3238 6.3238 6.3320 6.3320 6.9576 6.9576 6.9656 6.9656 7.5164 7.5164 7.7479 7.7479 7.7497 7.7497 8.0144 8.0144 8.2726 8.2726 8.2729 8.2729 8.4175 8.4175 9.1101 9.1101 9.1492 9.1492 10.3861 10.3861 10.4493 10.4493 10.4564 10.4564 10.5051 10.5051 10.5417 10.5417 10.5506 10.5506 10.8239 10.8239 10.8418 10.8418 10.9527 10.9527 10.9618 10.9618 10.9763 10.9763 11.1719 11.1719 12.4903 12.4903 12.8766 12.8766 12.8783 12.8783 13.1013 13.1013 13.3040 13.3040 13.5730 13.5730 13.5820 13.5820 14.0570 14.0570 k = 0.2451 0.2451 0.2451 ( 5644 PWs) bands (ev): -4.9786 -4.9786 -3.7342 -3.7342 -3.7089 -3.7089 -3.7086 -3.7086 -1.1479 -1.1479 -1.1466 -1.1466 -0.7946 -0.7946 -0.5801 -0.5801 3.9910 3.9910 4.3067 4.3067 4.3107 4.3107 5.1595 5.1595 5.4992 5.4992 5.5123 5.5123 5.7165 5.7165 6.3705 6.3705 6.3786 6.3786 6.9506 6.9506 6.9592 6.9592 7.5517 7.5517 7.7881 7.7881 7.7894 7.7894 7.9944 7.9944 8.2979 8.2979 8.2990 8.2990 8.4408 8.4408 9.1131 9.1131 9.1524 9.1524 10.3990 10.3990 10.4359 10.4359 10.4437 10.4437 10.4866 10.4866 10.5331 10.5331 10.5436 10.5436 10.8203 10.8203 10.8357 10.8357 10.9480 10.9480 10.9742 10.9742 10.9814 10.9814 11.1662 11.1662 12.5090 12.5090 12.9088 12.9088 12.9114 12.9114 13.1128 13.1128 13.3209 13.3209 13.5189 13.5189 13.5302 13.5302 14.0324 14.0324 k = 0.2549 0.2549 0.2549 ( 5650 PWs) bands (ev): -4.9299 -4.9299 -3.7459 -3.7459 -3.7208 -3.7208 -3.7205 -3.7205 -1.1583 -1.1583 -1.1572 -1.1572 -0.7973 -0.7973 -0.6316 -0.6316 3.9788 3.9788 4.3175 4.3175 4.3218 4.3218 5.1157 5.1157 5.5008 5.5008 5.5137 5.5137 5.7402 5.7402 6.4166 6.4166 6.4243 6.4243 6.9460 6.9460 6.9553 6.9553 7.5866 7.5866 7.8290 7.8290 7.8300 7.8300 7.9593 7.9593 8.3206 8.3206 8.3224 8.3224 8.4749 8.4749 9.1143 9.1143 9.1537 9.1537 10.4028 10.4028 10.4297 10.4297 10.4320 10.4320 10.4672 10.4672 10.5238 10.5238 10.5361 10.5361 10.8144 10.8144 10.8276 10.8276 10.9398 10.9398 10.9857 10.9857 10.9877 10.9877 11.1595 11.1595 12.5254 12.5254 12.9437 12.9437 12.9471 12.9471 13.1155 13.1155 13.3514 13.3514 13.4659 13.4659 13.4800 13.4800 14.0081 14.0081 k = 0.2647 0.2647 0.2647 ( 5647 PWs) bands (ev): -4.8800 -4.8800 -3.7570 -3.7570 -3.7324 -3.7324 -3.7321 -3.7321 -1.1698 -1.1698 -1.1688 -1.1688 -0.8045 -0.8045 -0.6817 -0.6817 3.9705 3.9705 4.3314 4.3314 4.3359 4.3359 5.0756 5.0756 5.5027 5.5027 5.5152 5.5152 5.7625 5.7625 6.4611 6.4611 6.4685 6.4685 6.9446 6.9446 6.9545 6.9545 7.6178 7.6178 7.8695 7.8695 7.8712 7.8712 7.9183 7.9183 8.3409 8.3409 8.3434 8.3434 8.5150 8.5150 9.1137 9.1137 9.1533 9.1533 10.3909 10.3909 10.4146 10.4146 10.4414 10.4414 10.4498 10.4498 10.5137 10.5137 10.5278 10.5278 10.8062 10.8062 10.8176 10.8176 10.9292 10.9292 10.9936 10.9936 10.9957 10.9957 11.1518 11.1518 12.5397 12.5397 12.9809 12.9809 12.9850 12.9850 13.1130 13.1130 13.3870 13.3870 13.4141 13.4141 13.4359 13.4359 13.9842 13.9842 k = 0.2745 0.2745 0.2745 ( 5659 PWs) bands (ev): -4.8289 -4.8289 -3.7675 -3.7675 -3.7435 -3.7435 -3.7431 -3.7431 -1.1822 -1.1822 -1.1813 -1.1813 -0.8174 -0.8174 -0.7293 -0.7293 3.9664 3.9664 4.3482 4.3482 4.3528 4.3528 5.0390 5.0390 5.5049 5.5049 5.5170 5.5170 5.7832 5.7832 6.5030 6.5030 6.5101 6.5101 6.9467 6.9467 6.9572 6.9572 7.6370 7.6370 7.8771 7.8771 7.9127 7.9127 7.9158 7.9158 8.3592 8.3592 8.3624 8.3624 8.5577 8.5577 9.1116 9.1116 9.1514 9.1514 10.3743 10.3743 10.3984 10.3984 10.4254 10.4254 10.4619 10.4619 10.5031 10.5031 10.5185 10.5185 10.7956 10.7956 10.8056 10.8056 10.9167 10.9167 10.9982 10.9982 11.0037 11.0037 11.1430 11.1430 12.5518 12.5518 13.0196 13.0196 13.0245 13.0245 13.1080 13.1080 13.3640 13.3640 13.3738 13.3738 13.4480 13.4480 13.9606 13.9606 k = 0.2843 0.2843 0.2843 ( 5659 PWs) bands (ev): -4.7769 -4.7769 -3.7774 -3.7774 -3.7541 -3.7541 -3.7537 -3.7537 -1.1954 -1.1954 -1.1947 -1.1947 -0.8380 -0.8380 -0.7720 -0.7720 3.9669 3.9669 4.3676 4.3676 4.3724 4.3724 5.0059 5.0059 5.5076 5.5076 5.5194 5.5194 5.8023 5.8023 6.5415 6.5415 6.5482 6.5482 6.9527 6.9527 6.9638 6.9638 7.6287 7.6287 7.8647 7.8647 7.9545 7.9545 7.9565 7.9565 8.3761 8.3761 8.3801 8.3801 8.6012 8.6012 9.1082 9.1082 9.1483 9.1483 10.3563 10.3563 10.3814 10.3814 10.4046 10.4046 10.4789 10.4789 10.4919 10.4919 10.5085 10.5085 10.7827 10.7827 10.7917 10.7917 10.9029 10.9029 11.0013 11.0013 11.0096 11.0096 11.1331 11.1331 12.5621 12.5621 13.0580 13.0580 13.0647 13.0647 13.1025 13.1025 13.3159 13.3159 13.3300 13.3300 13.4964 13.4964 13.9374 13.9374 k = 0.2941 0.2941 0.2941 ( 5665 PWs) bands (ev): -4.7239 -4.7239 -3.7867 -3.7867 -3.7643 -3.7643 -3.7639 -3.7639 -1.2092 -1.2092 -1.2087 -1.2087 -0.8689 -0.8689 -0.8073 -0.8073 3.9719 3.9719 4.3894 4.3894 4.3944 4.3944 4.9759 4.9759 5.5110 5.5110 5.5225 5.5225 5.8197 5.8197 6.5756 6.5756 6.5819 6.5819 6.9626 6.9626 6.9743 6.9743 7.5855 7.5855 7.8830 7.8830 7.9964 7.9964 7.9985 7.9985 8.3924 8.3924 8.3970 8.3970 8.6442 8.6442 9.1039 9.1039 9.1442 9.1442 10.3376 10.3376 10.3636 10.3636 10.3833 10.3833 10.4802 10.4802 10.4934 10.4934 10.4995 10.4995 10.7675 10.7675 10.7756 10.7756 10.8880 10.8880 11.0024 11.0024 11.0131 11.0131 11.1220 11.1220 12.5708 12.5708 13.0822 13.0822 13.1034 13.1034 13.1088 13.1088 13.2715 13.2715 13.2868 13.2868 13.5493 13.5493 13.9147 13.9147 k = 0.3039 0.3039 0.3039 ( 5656 PWs) bands (ev): -4.6701 -4.6701 -3.7954 -3.7954 -3.7740 -3.7740 -3.7735 -3.7735 -1.2237 -1.2237 -1.2233 -1.2233 -0.9082 -0.9082 -0.8368 -0.8368 3.9819 3.9819 4.4133 4.4133 4.4184 4.4184 4.9491 4.9491 5.5153 5.5153 5.5265 5.5265 5.8353 5.8353 6.6050 6.6050 6.6108 6.6108 6.9760 6.9760 6.9882 6.9882 7.5189 7.5189 7.9230 7.9230 8.0381 8.0381 8.0404 8.0404 8.4089 8.4089 8.4142 8.4142 8.6862 8.6862 9.0988 9.0988 9.1394 9.1394 10.3186 10.3186 10.3452 10.3452 10.3617 10.3617 10.4679 10.4679 10.4849 10.4849 10.5110 10.5110 10.7501 10.7501 10.7575 10.7575 10.8728 10.8728 11.0014 11.0014 11.0141 11.0141 11.1097 11.1097 12.5782 12.5782 13.0756 13.0756 13.1339 13.1339 13.1384 13.1384 13.2370 13.2370 13.2500 13.2500 13.6040 13.6040 13.8925 13.8925 k = 0.3137 0.3137 0.3137 ( 5662 PWs) bands (ev): -4.6158 -4.6158 -3.8034 -3.8034 -3.7831 -3.7831 -3.7827 -3.7827 -1.2386 -1.2386 -1.2383 -1.2383 -0.9511 -0.9511 -0.8650 -0.8650 3.9968 3.9968 4.4389 4.4389 4.4441 4.4441 4.9253 4.9253 5.5209 5.5209 5.5317 5.5317 5.8491 5.8491 6.6294 6.6294 6.6350 6.6350 6.9920 6.9920 7.0044 7.0044 7.4395 7.4395 7.9747 7.9747 8.0795 8.0795 8.0820 8.0820 8.4263 8.4263 8.4322 8.4322 8.7271 8.7271 9.0933 9.0933 9.1343 9.1343 10.2993 10.2993 10.3263 10.3263 10.3398 10.3398 10.4550 10.4550 10.4723 10.4723 10.5229 10.5229 10.7305 10.7305 10.7371 10.7371 10.8576 10.8576 10.9982 10.9982 11.0126 11.0126 11.0960 11.0960 12.5844 12.5844 13.0615 13.0615 13.1343 13.1343 13.1496 13.1496 13.2337 13.2337 13.2368 13.2368 13.6595 13.6595 13.8709 13.8709 k = 0.3235 0.3235 0.3235 ( 5668 PWs) bands (ev): -4.5610 -4.5610 -3.8108 -3.8108 -3.7918 -3.7918 -3.7913 -3.7913 -1.2538 -1.2538 -1.2536 -1.2536 -0.9947 -0.9947 -0.8944 -0.8944 4.0167 4.0167 4.4658 4.4658 4.4712 4.4712 4.9041 4.9041 5.5278 5.5278 5.5383 5.5383 5.8612 5.8612 6.6495 6.6495 6.6548 6.6548 7.0090 7.0090 7.0216 7.0216 7.3527 7.3527 8.0332 8.0332 8.1208 8.1208 8.1235 8.1235 8.4456 8.4456 8.4521 8.4521 8.7666 8.7666 9.0876 9.0876 9.1289 9.1289 10.2798 10.2798 10.3071 10.3071 10.3174 10.3174 10.4413 10.4413 10.4586 10.4586 10.5309 10.5309 10.7088 10.7088 10.7145 10.7145 10.8433 10.8433 10.9928 10.9928 11.0088 11.0088 11.0810 11.0810 12.5898 12.5898 13.0430 13.0430 13.1034 13.1034 13.1252 13.1252 13.2604 13.2604 13.2623 13.2623 13.7152 13.7152 13.8499 13.8499 k = 0.3333 0.3333 0.3333 ( 5674 PWs) bands (ev): -4.5061 -4.5061 -3.8176 -3.8176 -3.7999 -3.7999 -3.7994 -3.7994 -1.2692 -1.2692 -1.2691 -1.2691 -1.0377 -1.0377 -0.9259 -0.9259 4.0416 4.0416 4.4938 4.4938 4.4993 4.4993 4.8855 4.8855 5.5363 5.5363 5.5466 5.5466 5.8716 5.8716 6.6657 6.6657 6.6709 6.6709 7.0253 7.0253 7.0379 7.0379 7.2611 7.2611 8.0964 8.0964 8.1621 8.1621 8.1649 8.1649 8.4675 8.4675 8.4745 8.4745 8.8047 8.8047 9.0821 9.0821 9.1237 9.1237 10.2604 10.2604 10.2876 10.2876 10.2948 10.2948 10.4268 10.4268 10.4441 10.4441 10.5340 10.5340 10.6850 10.6850 10.6897 10.6897 10.8306 10.8306 10.9855 10.9855 11.0028 11.0028 11.0648 11.0648 12.5946 12.5946 13.0204 13.0204 13.0638 13.0638 13.0879 13.0879 13.2972 13.2972 13.2997 13.2997 13.7704 13.7704 13.8297 13.8297 k = 0.3431 0.3431 0.3431 ( 5680 PWs) bands (ev): -4.4511 -4.4511 -3.8239 -3.8239 -3.8075 -3.8075 -3.8070 -3.8070 -1.2846 -1.2846 -1.2846 -1.2846 -1.0795 -1.0795 -0.9597 -0.9597 4.0714 4.0714 4.5223 4.5223 4.5279 4.5279 4.8693 4.8693 5.5469 5.5469 5.5569 5.5569 5.8804 5.8804 6.6789 6.6789 6.6840 6.6840 7.0391 7.0391 7.0514 7.0514 7.1662 7.1662 8.1628 8.1628 8.2040 8.2040 8.2073 8.2073 8.4922 8.4922 8.4997 8.4997 8.8416 8.8416 9.0770 9.0770 9.1188 9.1188 10.2410 10.2410 10.2681 10.2681 10.2719 10.2719 10.4115 10.4115 10.4286 10.4286 10.5312 10.5312 10.6590 10.6590 10.6625 10.6625 10.8201 10.8201 10.9763 10.9763 10.9948 10.9948 11.0474 11.0474 12.5989 12.5989 12.9940 12.9940 13.0227 13.0227 13.0482 13.0482 13.3362 13.3362 13.3382 13.3382 13.8104 13.8104 13.8170 13.8170 k = 0.3529 0.3529 0.3529 ( 5692 PWs) bands (ev): -4.3964 -4.3964 -3.8295 -3.8295 -3.8145 -3.8145 -3.8140 -3.8140 -1.3000 -1.3000 -1.3000 -1.3000 -1.1197 -1.1197 -0.9957 -0.9957 4.1059 4.1059 4.5508 4.5508 4.5566 4.5566 4.8552 4.8552 5.5595 5.5595 5.5693 5.5693 5.8877 5.8877 6.6899 6.6899 6.6950 6.6950 7.0477 7.0477 7.0605 7.0605 7.0698 7.0698 8.2294 8.2294 8.2468 8.2468 8.2534 8.2534 8.5200 8.5200 8.5279 8.5279 8.8772 8.8772 9.0726 9.0726 9.1145 9.1145 10.2217 10.2217 10.2485 10.2485 10.2487 10.2487 10.3953 10.3953 10.4121 10.4121 10.5217 10.5217 10.6309 10.6309 10.6331 10.6331 10.8125 10.8125 10.9656 10.9656 10.9851 10.9851 11.0291 11.0291 12.6028 12.6028 12.9644 12.9644 12.9818 12.9818 13.0085 13.0085 13.3747 13.3747 13.3759 13.3759 13.7919 13.7919 13.8044 13.8044 k = 0.3627 0.3627 0.3627 ( 5701 PWs) bands (ev): -4.3422 -4.3422 -3.8346 -3.8346 -3.8211 -3.8211 -3.8206 -3.8206 -1.3152 -1.3152 -1.3150 -1.3150 -1.1582 -1.1582 -1.0334 -1.0334 4.1451 4.1451 4.5790 4.5790 4.5849 4.5849 4.8431 4.8431 5.5746 5.5746 5.5842 5.5842 5.8937 5.8937 6.6991 6.6991 6.7042 6.7042 6.9694 6.9694 7.0533 7.0533 7.0641 7.0641 8.2850 8.2850 8.2913 8.2913 8.3144 8.3144 8.5505 8.5505 8.5588 8.5588 8.9116 8.9116 9.0692 9.0692 9.1109 9.1109 10.2026 10.2026 10.2255 10.2255 10.2290 10.2290 10.3782 10.3782 10.3947 10.3947 10.5054 10.5054 10.6005 10.6005 10.6016 10.6016 10.8079 10.8079 10.9536 10.9536 10.9740 10.9740 11.0102 11.0102 12.6065 12.6065 12.9325 12.9325 12.9419 12.9419 12.9695 12.9695 13.4118 13.4118 13.4118 13.4118 13.7745 13.7745 13.7872 13.7872 k = 0.3725 0.3725 0.3725 ( 5692 PWs) bands (ev): -4.2888 -4.2888 -3.8392 -3.8392 -3.8271 -3.8271 -3.8266 -3.8266 -1.3299 -1.3299 -1.3297 -1.3297 -1.1946 -1.1946 -1.0726 -1.0726 4.1885 4.1885 4.6065 4.6065 4.6124 4.6124 4.8327 4.8327 5.5923 5.5923 5.6017 5.6017 5.8983 5.8983 6.7071 6.7071 6.7122 6.7122 6.8696 6.8696 7.0510 7.0510 7.0614 7.0614 8.3328 8.3328 8.3379 8.3379 8.3872 8.3872 8.5831 8.5831 8.5919 8.5919 8.9447 8.9447 9.0670 9.0670 9.1084 9.1084 10.1835 10.1835 10.2024 10.2024 10.2096 10.2096 10.3604 10.3604 10.3763 10.3763 10.4828 10.4828 10.5679 10.5679 10.5680 10.5680 10.8059 10.8059 10.9407 10.9407 10.9618 10.9618 10.9909 10.9909 12.6100 12.6100 12.8992 12.8992 12.9032 12.9032 12.9317 12.9317 13.4455 13.4455 13.4468 13.4468 13.7580 13.7580 13.7707 13.7707 k = 0.3824 0.3824 0.3824 ( 5685 PWs) bands (ev): -4.2366 -4.2366 -3.8432 -3.8432 -3.8326 -3.8326 -3.8321 -3.8321 -1.3442 -1.3442 -1.3439 -1.3439 -1.2289 -1.2289 -1.1126 -1.1126 4.2359 4.2359 4.6327 4.6327 4.6387 4.6387 4.8239 4.8239 5.6127 5.6127 5.6219 5.6219 5.9019 5.9019 6.7142 6.7142 6.7193 6.7193 6.7694 6.7694 7.0423 7.0423 7.0521 7.0521 8.3811 8.3811 8.3869 8.3869 8.4634 8.4634 8.6171 8.6171 8.6265 8.6265 8.9767 8.9767 9.0664 9.0664 9.1071 9.1071 10.1643 10.1643 10.1799 10.1799 10.1903 10.1903 10.3418 10.3418 10.3570 10.3570 10.4542 10.4542 10.5325 10.5325 10.5332 10.5332 10.8058 10.8058 10.9272 10.9272 10.9490 10.9490 10.9717 10.9717 12.6133 12.6133 12.8655 12.8655 12.8662 12.8662 12.8952 12.8952 13.4767 13.4767 13.4794 13.4794 13.7427 13.7427 13.7553 13.7553 k = 0.3922 0.3922 0.3922 ( 5688 PWs) bands (ev): -4.1859 -4.1859 -3.8468 -3.8468 -3.8377 -3.8377 -3.8371 -3.8371 -1.3578 -1.3578 -1.3575 -1.3575 -1.2610 -1.2610 -1.1529 -1.1529 4.2868 4.2868 4.6573 4.6573 4.6634 4.6634 4.8165 4.8165 5.6358 5.6358 5.6449 5.6449 5.9045 5.9045 6.6694 6.6694 6.7206 6.7206 6.7256 6.7256 7.0273 7.0273 7.0364 7.0364 8.4311 8.4311 8.4381 8.4381 8.5412 8.5412 8.6516 8.6516 8.6618 8.6618 9.0072 9.0072 9.0678 9.0678 9.1074 9.1074 10.1445 10.1445 10.1583 10.1583 10.1709 10.1709 10.3228 10.3228 10.3369 10.3369 10.4205 10.4205 10.4954 10.4954 10.4964 10.4964 10.8068 10.8068 10.9135 10.9135 10.9357 10.9357 10.9531 10.9531 12.6165 12.6165 12.8311 12.8311 12.8322 12.8322 12.8605 12.8605 13.5052 13.5052 13.5094 13.5094 13.7284 13.7284 13.7409 13.7409 k = 0.4020 0.4020 0.4020 ( 5682 PWs) bands (ev): -4.1372 -4.1372 -3.8499 -3.8499 -3.8422 -3.8422 -3.8417 -3.8417 -1.3706 -1.3706 -1.3703 -1.3703 -1.2907 -1.2907 -1.1930 -1.1930 4.3407 4.3407 4.6801 4.6801 4.6863 4.6863 4.8105 4.8105 5.6615 5.6615 5.6705 5.6705 5.9062 5.9062 6.5706 6.5706 6.7264 6.7264 6.7314 6.7314 7.0063 7.0063 7.0148 7.0148 8.4827 8.4827 8.4911 8.4911 8.6195 8.6195 8.6858 8.6858 8.6969 8.6969 9.0362 9.0362 9.0717 9.0717 9.1094 9.1094 10.1239 10.1239 10.1383 10.1383 10.1514 10.1514 10.3034 10.3034 10.3162 10.3162 10.3823 10.3823 10.4571 10.4571 10.4581 10.4581 10.8084 10.8084 10.9000 10.9000 10.9225 10.9225 10.9352 10.9352 12.6194 12.6194 12.7981 12.7981 12.8001 12.8001 12.8277 12.8277 13.5309 13.5309 13.5367 13.5367 13.7152 13.7152 13.7276 13.7276 k = 0.4118 0.4118 0.4118 ( 5691 PWs) bands (ev): -4.0908 -4.0908 -3.8526 -3.8526 -3.8462 -3.8462 -3.8457 -3.8457 -1.3826 -1.3826 -1.3822 -1.3822 -1.3179 -1.3179 -1.2322 -1.2322 4.3970 4.3970 4.7008 4.7008 4.7070 4.7070 4.8054 4.8054 5.6895 5.6895 5.6984 5.6984 5.9073 5.9073 6.4734 6.4734 6.7316 6.7316 6.7367 6.7367 6.9805 6.9805 6.9884 6.9884 8.5352 8.5352 8.5451 8.5451 8.6957 8.6957 8.7205 8.7205 8.7308 8.7308 9.0627 9.0627 9.0795 9.0795 9.1136 9.1136 10.1027 10.1027 10.1195 10.1195 10.1315 10.1315 10.2843 10.2843 10.2949 10.2949 10.3406 10.3406 10.4181 10.4181 10.4188 10.4188 10.8099 10.8099 10.8871 10.8871 10.9095 10.9095 10.9186 10.9186 12.6222 12.6222 12.7674 12.7674 12.7697 12.7697 12.7972 12.7972 13.5538 13.5538 13.5612 13.5612 13.7033 13.7033 13.7154 13.7154 k = 0.4216 0.4216 0.4216 ( 5685 PWs) bands (ev): -4.0474 -4.0474 -3.8549 -3.8549 -3.8498 -3.8498 -3.8493 -3.8493 -1.3936 -1.3936 -1.3932 -1.3932 -1.3424 -1.3424 -1.2698 -1.2698 4.4549 4.4549 4.7192 4.7192 4.7255 4.7255 4.8014 4.8014 5.7193 5.7193 5.7283 5.7283 5.9078 5.9078 6.3789 6.3789 6.7364 6.7364 6.7414 6.7414 6.9507 6.9507 6.9581 6.9581 8.5877 8.5877 8.5990 8.5990 8.7433 8.7433 8.7629 8.7629 8.7808 8.7808 9.0822 9.0822 9.0956 9.0956 9.1203 9.1203 10.0816 10.0816 10.1015 10.1015 10.1112 10.1112 10.2657 10.2657 10.2720 10.2720 10.2974 10.2974 10.3792 10.3792 10.3792 10.3792 10.8110 10.8110 10.8754 10.8754 10.8971 10.8971 10.9034 10.9034 12.6247 12.6247 12.7394 12.7394 12.7416 12.7416 12.7693 12.7693 13.5739 13.5739 13.5829 13.5829 13.6926 13.6926 13.7044 13.7044 k = 0.4314 0.4314 0.4314 ( 5682 PWs) bands (ev): -4.0073 -4.0073 -3.8569 -3.8569 -3.8530 -3.8530 -3.8524 -3.8524 -1.4036 -1.4036 -1.4031 -1.4031 -1.3643 -1.3643 -1.3052 -1.3052 4.5134 4.5134 4.7353 4.7353 4.7417 4.7417 4.7982 4.7982 5.7503 5.7503 5.7593 5.7593 5.9080 5.9080 6.2879 6.2879 6.7407 6.7407 6.7456 6.7456 6.9184 6.9184 6.9253 6.9253 8.6388 8.6388 8.6514 8.6514 8.7705 8.7705 8.7922 8.7922 8.8565 8.8565 9.0968 9.0968 9.1181 9.1181 9.1296 9.1296 10.0614 10.0614 10.0838 10.0838 10.0903 10.0903 10.2390 10.2390 10.2482 10.2482 10.2626 10.2626 10.3403 10.3403 10.3411 10.3411 10.8113 10.8113 10.8654 10.8654 10.8857 10.8857 10.8898 10.8898 12.6268 12.6268 12.7141 12.7141 12.7161 12.7161 12.7442 12.7442 13.5912 13.5912 13.6018 13.6018 13.6832 13.6832 13.6946 13.6946 k = 0.4412 0.4412 0.4412 ( 5682 PWs) bands (ev): -3.9711 -3.9711 -3.8586 -3.8586 -3.8556 -3.8556 -3.8551 -3.8551 -1.4124 -1.4124 -1.4119 -1.4119 -1.3835 -1.3835 -1.3376 -1.3376 4.5713 4.5713 4.7491 4.7491 4.7555 4.7555 4.7957 4.7957 5.7816 5.7816 5.7907 5.7907 5.9079 5.9079 6.2019 6.2019 6.7445 6.7445 6.7494 6.7494 6.8849 6.8849 6.8914 6.8914 8.6873 8.6873 8.7007 8.7007 8.7925 8.7925 8.8183 8.8183 8.9307 8.9307 9.1130 9.1130 9.1399 9.1399 9.1416 9.1416 10.0423 10.0423 10.0661 10.0661 10.0688 10.0688 10.1927 10.1927 10.2323 10.2323 10.2410 10.2410 10.3032 10.3032 10.3048 10.3048 10.8103 10.8103 10.8574 10.8574 10.8754 10.8754 10.8780 10.8780 12.6285 12.6285 12.6919 12.6919 12.6935 12.6935 12.7223 12.7223 13.6056 13.6056 13.6181 13.6181 13.6752 13.6752 13.6861 13.6861 k = 0.4510 0.4510 0.4510 ( 5679 PWs) bands (ev): -3.9393 -3.9393 -3.8599 -3.8599 -3.8579 -3.8579 -3.8574 -3.8574 -1.4199 -1.4199 -1.4194 -1.4194 -1.3998 -1.3998 -1.3664 -1.3664 4.6270 4.6270 4.7605 4.7605 4.7671 4.7671 4.7939 4.7939 5.8120 5.8120 5.8213 5.8213 5.9076 5.9076 6.1224 6.1224 6.7477 6.7477 6.7526 6.7526 6.8519 6.8519 6.8581 6.8581 8.7316 8.7316 8.7451 8.7451 8.8101 8.8101 8.8410 8.8410 9.0011 9.0011 9.1313 9.1313 9.1558 9.1558 9.1597 9.1597 10.0249 10.0249 10.0471 10.0471 10.0484 10.0484 10.1443 10.1443 10.2185 10.2185 10.2237 10.2237 10.2691 10.2691 10.2716 10.2716 10.8082 10.8082 10.8519 10.8519 10.8663 10.8663 10.8679 10.8679 12.6297 12.6297 12.6728 12.6728 12.6740 12.6740 12.7037 12.7037 13.6172 13.6172 13.6316 13.6316 13.6689 13.6689 13.6787 13.6787 k = 0.4608 0.4608 0.4608 ( 5679 PWs) bands (ev): -3.9125 -3.9125 -3.8611 -3.8611 -3.8596 -3.8596 -3.8592 -3.8592 -1.4262 -1.4262 -1.4257 -1.4257 -1.4132 -1.4132 -1.3911 -1.3911 4.6785 4.6785 4.7696 4.7696 4.7764 4.7764 4.7926 4.7926 5.8401 5.8401 5.8498 5.8498 5.9073 5.9073 6.0514 6.0514 6.7505 6.7505 6.7552 6.7552 6.8211 6.8211 6.8271 6.8271 8.7703 8.7703 8.7825 8.7825 8.8236 8.8236 8.8606 8.8606 9.0655 9.0655 9.1504 9.1504 9.1713 9.1713 9.1768 9.1768 10.0093 10.0093 10.0259 10.0259 10.0310 10.0310 10.0976 10.0976 10.2069 10.2069 10.2093 10.2093 10.2394 10.2394 10.2427 10.2427 10.8051 10.8051 10.8484 10.8484 10.8587 10.8587 10.8596 10.8596 12.6304 12.6304 12.6571 12.6571 12.6578 12.6578 12.6888 12.6888 13.6257 13.6257 13.6426 13.6426 13.6645 13.6645 13.6727 13.6727 k = 0.4706 0.4706 0.4706 ( 5667 PWs) bands (ev): -3.8911 -3.8911 -3.8619 -3.8619 -3.8610 -3.8610 -3.8606 -3.8606 -1.4312 -1.4312 -1.4306 -1.4306 -1.4237 -1.4237 -1.4109 -1.4109 4.7231 4.7231 4.7764 4.7764 4.7835 4.7835 4.7920 4.7920 5.8642 5.8642 5.8745 5.8745 5.9072 5.9072 5.9916 5.9916 6.7527 6.7527 6.7571 6.7571 6.7943 6.7943 6.8002 6.8002 8.8020 8.8020 8.8112 8.8112 8.8333 8.8333 8.8774 8.8774 9.1210 9.1210 9.1690 9.1690 9.1866 9.1866 9.1910 9.1910 9.9962 9.9962 10.0065 10.0065 10.0142 10.0142 10.0565 10.0565 10.1976 10.1976 10.1979 10.1979 10.2152 10.2152 10.2193 10.2193 10.8020 10.8020 10.8465 10.8465 10.8528 10.8528 10.8532 10.8532 12.6303 12.6303 12.6447 12.6447 12.6451 12.6451 12.6777 12.6777 13.6312 13.6312 13.6511 13.6511 13.6621 13.6621 13.6680 13.6680 k = 0.4804 0.4804 0.4804 ( 5634 PWs) bands (ev): -3.8754 -3.8754 -3.8626 -3.8626 -3.8618 -3.8618 -3.8616 -3.8616 -1.4347 -1.4347 -1.4342 -1.4342 -1.4312 -1.4312 -1.4254 -1.4254 4.7577 4.7577 4.7815 4.7815 4.7885 4.7885 4.7920 4.7920 5.8821 5.8821 5.8938 5.8938 5.9077 5.9077 5.9460 5.9460 6.7543 6.7543 6.7581 6.7581 6.7735 6.7735 6.7798 6.7798 8.8254 8.8254 8.8306 8.8306 8.8398 8.8398 8.8912 8.8912 9.1627 9.1627 9.1862 9.1862 9.1996 9.1996 9.2020 9.2020 9.9858 9.9858 9.9907 9.9907 9.9978 9.9978 10.0261 10.0261 10.1897 10.1897 10.1906 10.1906 10.1975 10.1975 10.2024 10.2024 10.7993 10.7993 10.8456 10.8456 10.8485 10.8485 10.8487 10.8487 12.6298 12.6298 12.6359 12.6359 12.6361 12.6361 12.6703 12.6703 13.6340 13.6340 13.6572 13.6572 13.6615 13.6615 13.6647 13.6647 k = 0.4902 0.4902 0.4902 ( 5616 PWs) bands (ev): -3.8660 -3.8660 -3.8630 -3.8630 -3.8623 -3.8623 -3.8622 -3.8622 -1.4368 -1.4368 -1.4365 -1.4365 -1.4357 -1.4357 -1.4341 -1.4341 4.7768 4.7768 4.7874 4.7874 4.7915 4.7915 4.7923 4.7923 5.8911 5.8911 5.9061 5.9061 5.9091 5.9091 5.9184 5.9184 6.7552 6.7552 6.7571 6.7571 6.7601 6.7601 6.7682 6.7682 8.8399 8.8399 8.8414 8.8414 8.8436 8.8436 8.9005 8.9005 9.1836 9.1836 9.2035 9.2035 9.2085 9.2085 9.2091 9.2091 9.9790 9.9790 9.9803 9.9803 9.9829 9.9829 10.0102 10.0102 10.1847 10.1847 10.1853 10.1853 10.1867 10.1867 10.1932 10.1932 10.7976 10.7976 10.8452 10.8452 10.8460 10.8460 10.8460 10.8460 12.6291 12.6291 12.6306 12.6306 12.6306 12.6306 12.6662 12.6662 13.6351 13.6351 13.6608 13.6608 13.6618 13.6618 13.6626 13.6626 k = 0.5000 0.5000 0.5000 ( 5616 PWs) bands (ev): -3.8636 -3.8636 -3.8624 -3.8624 -3.8624 -3.8624 -3.8624 -3.8624 -1.4376 -1.4376 -1.4376 -1.4376 -1.4376 -1.4376 -1.4364 -1.4364 4.7802 4.7802 4.7925 4.7925 4.7925 4.7925 4.7925 4.7925 5.8921 5.8921 5.9103 5.9103 5.9103 5.9103 5.9103 5.9103 6.7555 6.7555 6.7555 6.7555 6.7555 6.7555 6.7655 6.7655 8.8448 8.8448 8.8448 8.8448 8.8448 8.8448 8.9039 8.9039 9.1887 9.1887 9.2116 9.2116 9.2116 9.2116 9.2116 9.2116 9.9766 9.9766 9.9766 9.9766 9.9766 9.9766 10.0057 10.0057 10.1831 10.1831 10.1831 10.1831 10.1831 10.1831 10.1905 10.1905 10.7970 10.7970 10.8451 10.8451 10.8451 10.8451 10.8451 10.8451 12.6288 12.6288 12.6288 12.6288 12.6288 12.6288 12.6649 12.6649 13.6353 13.6353 13.6620 13.6620 13.6620 13.6620 13.6620 13.6620 k = 0.5000 0.5000 0.5000 ( 5616 PWs) bands (ev): -3.8636 -3.8636 -3.8624 -3.8624 -3.8624 -3.8624 -3.8624 -3.8624 -1.4376 -1.4376 -1.4376 -1.4376 -1.4376 -1.4376 -1.4364 -1.4364 4.7802 4.7802 4.7925 4.7925 4.7925 4.7925 4.7925 4.7925 5.8921 5.8921 5.9103 5.9103 5.9103 5.9103 5.9103 5.9103 6.7555 6.7555 6.7555 6.7555 6.7555 6.7555 6.7655 6.7655 8.8448 8.8448 8.8448 8.8448 8.8448 8.8448 8.9039 8.9039 9.1887 9.1887 9.2116 9.2116 9.2116 9.2116 9.2116 9.2116 9.9766 9.9766 9.9766 9.9766 9.9766 9.9766 10.0057 10.0057 10.1831 10.1831 10.1831 10.1831 10.1831 10.1831 10.1905 10.1905 10.7970 10.7970 10.8451 10.8451 10.8451 10.8451 10.8451 10.8451 12.6288 12.6288 12.6288 12.6288 12.6288 12.6288 12.6649 12.6649 13.6353 13.6353 13.6620 13.6620 13.6620 13.6620 13.6620 13.6620 k = 0.4881 0.5000 0.4881 ( 5616 PWs) bands (ev): -3.8650 -3.8650 -3.8643 -3.8643 -3.8623 -3.8623 -3.8618 -3.8618 -1.4369 -1.4369 -1.4365 -1.4365 -1.4353 -1.4353 -1.4345 -1.4345 4.7773 4.7773 4.7873 4.7873 4.7907 4.7907 4.7928 4.7928 5.8913 5.8913 5.9058 5.9058 5.9120 5.9120 5.9157 5.9157 6.7556 6.7556 6.7572 6.7572 6.7598 6.7598 6.7681 6.7681 8.8401 8.8401 8.8417 8.8417 8.8432 8.8432 8.9006 8.9006 9.1839 9.1839 9.2042 9.2042 9.2072 9.2072 9.2098 9.2098 9.9790 9.9790 9.9805 9.9805 9.9826 9.9826 10.0100 10.0100 10.1848 10.1848 10.1855 10.1855 10.1865 10.1865 10.1931 10.1931 10.7976 10.7976 10.8453 10.8453 10.8457 10.8457 10.8461 10.8461 12.6293 12.6293 12.6300 12.6300 12.6308 12.6308 12.6661 12.6661 13.6351 13.6351 13.6609 13.6609 13.6618 13.6618 13.6625 13.6625 k = 0.4762 0.5000 0.4762 ( 5644 PWs) bands (ev): -3.8706 -3.8706 -3.8700 -3.8700 -3.8607 -3.8607 -3.8601 -3.8601 -1.4349 -1.4349 -1.4344 -1.4344 -1.4286 -1.4286 -1.4280 -1.4280 4.7648 4.7648 4.7722 4.7722 4.7892 4.7892 4.7938 4.7938 5.8813 5.8813 5.8923 5.8923 5.9245 5.9245 5.9313 5.9313 6.7556 6.7556 6.7591 6.7591 6.7720 6.7720 6.7785 6.7785 8.8261 8.8261 8.8319 8.8319 8.8386 8.8386 8.8911 8.8911 9.1673 9.1673 9.1827 9.1827 9.1971 9.1971 9.2046 9.2046 9.9858 9.9858 9.9900 9.9900 9.9995 9.9995 10.0241 10.0241 10.1898 10.1898 10.1913 10.1913 10.1965 10.1965 10.2018 10.2018 10.7993 10.7993 10.8459 10.8459 10.8476 10.8476 10.8490 10.8490 12.6310 12.6310 12.6336 12.6336 12.6368 12.6368 12.6701 12.6701 13.6341 13.6341 13.6577 13.6577 13.6613 13.6613 13.6641 13.6641 k = 0.4643 0.5000 0.4643 ( 5660 PWs) bands (ev): -3.8799 -3.8799 -3.8793 -3.8793 -3.8578 -3.8578 -3.8572 -3.8572 -1.4316 -1.4316 -1.4310 -1.4310 -1.4176 -1.4176 -1.4170 -1.4170 4.7420 4.7420 4.7482 4.7482 4.7899 4.7899 4.7954 4.7954 5.8611 5.8611 5.8708 5.8708 5.9488 5.9488 5.9563 5.9563 6.7556 6.7556 6.7598 6.7598 6.7915 6.7915 6.7973 6.7973 8.8032 8.8032 8.8140 8.8140 8.8309 8.8309 8.8770 8.8770 9.1380 9.1380 9.1498 9.1498 9.1859 9.1859 9.1968 9.1968 9.9961 9.9961 10.0015 10.0015 10.0250 10.0250 10.0486 10.0486 10.1981 10.1981 10.1994 10.1994 10.2133 10.2133 10.2180 10.2180 10.8021 10.8021 10.8471 10.8471 10.8510 10.8510 10.8540 10.8540 12.6338 12.6338 12.6390 12.6390 12.6468 12.6468 12.6773 12.6773 13.6318 13.6318 13.6524 13.6524 13.6614 13.6614 13.6668 13.6668 k = 0.4524 0.5000 0.4524 ( 5672 PWs) bands (ev): -3.8927 -3.8927 -3.8922 -3.8922 -3.8537 -3.8537 -3.8531 -3.8531 -1.4269 -1.4269 -1.4264 -1.4264 -1.4025 -1.4025 -1.4018 -1.4018 4.7112 4.7112 4.7166 4.7166 4.7918 4.7918 4.7977 4.7977 5.8334 5.8334 5.8425 5.8425 5.9817 5.9817 5.9893 5.9893 6.7557 6.7557 6.7601 6.7601 6.8169 6.8169 6.8226 6.8226 8.7716 8.7716 8.7868 8.7868 8.8200 8.8200 8.8597 8.8597 9.0993 9.0993 9.1084 9.1084 9.1744 9.1744 9.1873 9.1873 10.0091 10.0091 10.0140 10.0140 10.0561 10.0561 10.0807 10.0807 10.2096 10.2096 10.2099 10.2099 10.2366 10.2366 10.2406 10.2406 10.8057 10.8057 10.8488 10.8488 10.8561 10.8561 10.8609 10.8609 12.6376 12.6376 12.6454 12.6454 12.6608 12.6608 12.6885 12.6885 13.6272 13.6272 13.6449 13.6449 13.6628 13.6628 13.6705 13.6705 k = 0.4405 0.5000 0.4405 ( 5676 PWs) bands (ev): -3.9089 -3.9089 -3.9083 -3.9083 -3.8486 -3.8486 -3.8480 -3.8480 -1.4210 -1.4210 -1.4205 -1.4205 -1.3835 -1.3835 -1.3828 -1.3828 4.6742 4.6742 4.6790 4.6790 4.7945 4.7945 4.8006 4.8006 5.8000 5.8000 5.8087 5.8087 6.0214 6.0214 6.0288 6.0288 6.7557 6.7557 6.7601 6.7601 6.8469 6.8469 6.8527 6.8527 8.7322 8.7322 8.7499 8.7499 8.8059 8.8059 8.8403 8.8403 9.0549 9.0549 9.0616 9.0616 9.1631 9.1631 9.1772 9.1772 10.0237 10.0237 10.0274 10.0274 10.0899 10.0899 10.1167 10.1167 10.2230 10.2230 10.2241 10.2241 10.2657 10.2657 10.2688 10.2688 10.8099 10.8099 10.8511 10.8511 10.8630 10.8630 10.8696 10.8696 12.6426 12.6426 12.6524 12.6524 12.6786 12.6786 12.7038 12.7038 13.6198 13.6198 13.6351 13.6351 13.6658 13.6658 13.6752 13.6752 k = 0.4286 0.5000 0.4286 ( 5674 PWs) bands (ev): -3.9281 -3.9281 -3.9275 -3.9275 -3.8423 -3.8423 -3.8417 -3.8417 -1.4137 -1.4137 -1.4133 -1.4133 -1.3610 -1.3610 -1.3602 -1.3602 4.6327 4.6327 4.6369 4.6369 4.7979 4.7979 4.8042 4.8042 5.7622 5.7622 5.7705 5.7705 6.0660 6.0660 6.0731 6.0731 6.7556 6.7556 6.7600 6.7600 6.8803 6.8803 6.8860 6.8860 8.6858 8.6858 8.7042 8.7042 8.7888 8.7888 8.8188 8.8188 9.0075 9.0075 9.0119 9.0119 9.1526 9.1526 9.1671 9.1671 10.0393 10.0393 10.0418 10.0418 10.1241 10.1241 10.1533 10.1533 10.2390 10.2390 10.2413 10.2413 10.2999 10.2999 10.3017 10.3017 10.8144 10.8144 10.8539 10.8539 10.8719 10.8719 10.8801 10.8801 12.6485 12.6485 12.6595 12.6595 12.7001 12.7001 12.7235 12.7235 13.6096 13.6096 13.6228 13.6228 13.6702 13.6702 13.6807 13.6807 k = 0.4167 0.5000 0.4167 ( 5682 PWs) bands (ev): -3.9500 -3.9500 -3.9495 -3.9495 -3.8349 -3.8349 -3.8343 -3.8343 -1.4052 -1.4052 -1.4049 -1.4049 -1.3353 -1.3353 -1.3344 -1.3344 4.5880 4.5880 4.5916 4.5916 4.8019 4.8019 4.8083 4.8083 5.7210 5.7210 5.7290 5.7290 6.1141 6.1141 6.1209 6.1209 6.7554 6.7554 6.7596 6.7596 6.9156 6.9156 6.9215 6.9215 8.6335 8.6335 8.6513 8.6513 8.7686 8.7686 8.7950 8.7950 8.9590 8.9590 8.9610 8.9610 9.1434 9.1434 9.1578 9.1578 10.0556 10.0556 10.0570 10.0570 10.1571 10.1571 10.1880 10.1880 10.2578 10.2578 10.2605 10.2605 10.3381 10.3381 10.3381 10.3381 10.8192 10.8192 10.8572 10.8572 10.8828 10.8828 10.8922 10.8922 12.6552 12.6552 12.6669 12.6669 12.7249 12.7249 12.7470 12.7470 13.5965 13.5965 13.6079 13.6079 13.6757 13.6757 13.6870 13.6870 k = 0.4048 0.5000 0.4048 ( 5688 PWs) bands (ev): -3.9744 -3.9744 -3.9739 -3.9739 -3.8264 -3.8264 -3.8258 -3.8258 -1.3956 -1.3956 -1.3953 -1.3953 -1.3068 -1.3068 -1.3058 -1.3058 4.5412 4.5412 4.5444 4.5444 4.8064 4.8064 4.8130 4.8130 5.6775 5.6775 5.6852 5.6852 6.1643 6.1643 6.1708 6.1708 6.7551 6.7551 6.7591 6.7591 6.9520 6.9520 6.9578 6.9578 8.5765 8.5765 8.5930 8.5930 8.7459 8.7459 8.7689 8.7689 8.9104 8.9104 8.9108 8.9108 9.1356 9.1356 9.1496 9.1496 10.0723 10.0723 10.0729 10.0729 10.1881 10.1881 10.2193 10.2193 10.2793 10.2793 10.2812 10.2812 10.3771 10.3771 10.3789 10.3789 10.8243 10.8243 10.8611 10.8611 10.8956 10.8956 10.9058 10.9058 12.6627 12.6627 12.6746 12.6746 12.7530 12.7530 12.7741 12.7741 13.5807 13.5807 13.5903 13.5903 13.6821 13.6821 13.6938 13.6938 k = 0.3929 0.5000 0.3929 ( 5696 PWs) bands (ev): -4.0010 -4.0010 -4.0005 -4.0005 -3.8169 -3.8169 -3.8163 -3.8163 -1.3847 -1.3847 -1.3845 -1.3845 -1.2759 -1.2759 -1.2748 -1.2748 4.4935 4.4935 4.4962 4.4962 4.8115 4.8115 4.8183 4.8183 5.6324 5.6324 5.6397 5.6397 6.2154 6.2154 6.2216 6.2216 6.7547 6.7547 6.7584 6.7584 6.9884 6.9884 6.9943 6.9943 8.5161 8.5161 8.5310 8.5310 8.7210 8.7210 8.7409 8.7409 8.8610 8.8610 8.8636 8.8636 9.1292 9.1292 9.1426 9.1426 10.0894 10.0894 10.0895 10.0895 10.2170 10.2170 10.2469 10.2469 10.3026 10.3026 10.3029 10.3029 10.4174 10.4174 10.4211 10.4211 10.8297 10.8297 10.8655 10.8655 10.9101 10.9101 10.9206 10.9206 12.6708 12.6708 12.6826 12.6826 12.7840 12.7840 12.8043 12.8043 13.5620 13.5620 13.5697 13.5697 13.6891 13.6891 13.7010 13.7010 k = 0.3810 0.5000 0.3810 ( 5690 PWs) bands (ev): -4.0294 -4.0294 -4.0290 -4.0290 -3.8064 -3.8064 -3.8057 -3.8057 -1.3727 -1.3727 -1.3726 -1.3726 -1.2431 -1.2431 -1.2419 -1.2419 4.4456 4.4456 4.4479 4.4479 4.8172 4.8172 4.8240 4.8240 5.5861 5.5861 5.5932 5.5932 6.2661 6.2661 6.2722 6.2722 6.7543 6.7543 6.7576 6.7576 7.0241 7.0241 7.0299 7.0299 8.4536 8.4536 8.4666 8.4666 8.6946 8.6946 8.7115 8.7115 8.8132 8.8132 8.8179 8.8179 9.1242 9.1242 9.1368 9.1368 10.1065 10.1065 10.1072 10.1072 10.2440 10.2440 10.2715 10.2715 10.3239 10.3239 10.3273 10.3273 10.4578 10.4578 10.4634 10.4634 10.8357 10.8357 10.8705 10.8705 10.9261 10.9261 10.9366 10.9366 12.6794 12.6794 12.6907 12.6907 12.8176 12.8176 12.8371 12.8371 13.5404 13.5404 13.5462 13.5462 13.6964 13.6964 13.7084 13.7084 k = 0.3690 0.5000 0.3690 ( 5686 PWs) bands (ev): -4.0594 -4.0594 -4.0590 -4.0590 -3.7948 -3.7948 -3.7942 -3.7942 -1.3597 -1.3597 -1.3596 -1.3596 -1.2088 -1.2088 -1.2075 -1.2075 4.3983 4.3983 4.4002 4.4002 4.8233 4.8233 4.8303 4.8303 5.5393 5.5393 5.5460 5.5460 6.3154 6.3154 6.3214 6.3214 6.7544 6.7544 6.7572 6.7572 7.0583 7.0583 7.0640 7.0640 8.3901 8.3901 8.4012 8.4012 8.6674 8.6674 8.6816 8.6816 8.7673 8.7673 8.7738 8.7738 9.1204 9.1204 9.1321 9.1321 10.1240 10.1240 10.1252 10.1252 10.2692 10.2692 10.2938 10.2938 10.3444 10.3444 10.3513 10.3513 10.4969 10.4969 10.5049 10.5049 10.8422 10.8422 10.8760 10.8760 10.9432 10.9432 10.9533 10.9533 12.6882 12.6882 12.6989 12.6989 12.8535 12.8535 12.8722 12.8722 13.5160 13.5160 13.5198 13.5198 13.7037 13.7037 13.7157 13.7157 k = 0.3571 0.5000 0.3571 ( 5674 PWs) bands (ev): -4.0906 -4.0906 -4.0902 -4.0902 -3.7824 -3.7824 -3.7817 -3.7817 -1.3457 -1.3457 -1.3456 -1.3456 -1.1735 -1.1735 -1.1720 -1.1720 4.3522 4.3522 4.3537 4.3537 4.8299 4.8299 4.8371 4.8371 5.4923 5.4923 5.4987 5.4987 6.3617 6.3617 6.3678 6.3678 6.7554 6.7554 6.7575 6.7575 7.0905 7.0905 7.0960 7.0960 8.3267 8.3267 8.3360 8.3360 8.6402 8.6402 8.6520 8.6520 8.7233 8.7233 8.7313 8.7313 9.1174 9.1174 9.1285 9.1285 10.1420 10.1420 10.1437 10.1437 10.2928 10.2928 10.3145 10.3145 10.3637 10.3637 10.3741 10.3741 10.5339 10.5339 10.5445 10.5445 10.8494 10.8494 10.8820 10.8820 10.9610 10.9610 10.9706 10.9706 12.6969 12.6969 12.7069 12.7069 12.8912 12.8912 12.9091 12.9091 13.4889 13.4889 13.4905 13.4905 13.7108 13.7108 13.7226 13.7226 k = 0.3452 0.5000 0.3452 ( 5674 PWs) bands (ev): -4.1228 -4.1228 -4.1224 -4.1224 -3.7690 -3.7690 -3.7684 -3.7684 -1.3308 -1.3308 -1.3305 -1.3305 -1.1375 -1.1375 -1.1359 -1.1359 4.3077 4.3077 4.3088 4.3088 4.8368 4.8368 4.8442 4.8442 5.4454 5.4454 5.4514 5.4514 6.4035 6.4035 6.4099 6.4099 6.7582 6.7582 6.7596 6.7596 7.1201 7.1201 7.1254 7.1254 8.2644 8.2644 8.2719 8.2719 8.6137 8.6137 8.6235 8.6235 8.6813 8.6813 8.6902 8.6902 9.1152 9.1152 9.1256 9.1256 10.1603 10.1603 10.1624 10.1624 10.3148 10.3148 10.3338 10.3338 10.3817 10.3817 10.3956 10.3956 10.5679 10.5679 10.5817 10.5817 10.8575 10.8575 10.8885 10.8885 10.9793 10.9793 10.9882 10.9882 12.7054 12.7054 12.7145 12.7145 12.9303 12.9303 12.9471 12.9471 13.4587 13.4587 13.4595 13.4595 13.7174 13.7174 13.7288 13.7288 k = 0.3333 0.5000 0.3333 ( 5682 PWs) bands (ev): -4.1557 -4.1557 -4.1553 -4.1553 -3.7548 -3.7548 -3.7542 -3.7542 -1.3150 -1.3150 -1.3146 -1.3146 -1.1012 -1.1012 -1.0995 -1.0995 4.2654 4.2654 4.2661 4.2661 4.8442 4.8442 4.8518 4.8518 5.3988 5.3988 5.4045 5.4045 6.4388 6.4388 6.4455 6.4455 6.7642 6.7642 6.7647 6.7647 7.1466 7.1466 7.1516 7.1516 8.2040 8.2040 8.2098 8.2098 8.5883 8.5883 8.5967 8.5967 8.6414 8.6414 8.6508 8.6508 9.1134 9.1134 9.1232 9.1232 10.1786 10.1786 10.1814 10.1814 10.3350 10.3350 10.3517 10.3517 10.3987 10.3987 10.4157 10.4157 10.5983 10.5983 10.6158 10.6158 10.8666 10.8666 10.8954 10.8954 10.9975 10.9975 11.0056 11.0056 12.7131 12.7131 12.7213 12.7213 12.9703 12.9703 12.9859 12.9859 13.4250 13.4250 13.4284 13.4284 13.7230 13.7230 13.7340 13.7340 k = 0.3214 0.5000 0.3214 ( 5666 PWs) bands (ev): -4.1890 -4.1890 -4.1887 -4.1887 -3.7398 -3.7398 -3.7391 -3.7391 -1.2984 -1.2984 -1.2979 -1.2979 -1.0651 -1.0651 -1.0633 -1.0633 4.2256 4.2256 4.2260 4.2260 4.8520 4.8520 4.8598 4.8598 5.3528 5.3528 5.3581 5.3581 6.4657 6.4657 6.4728 6.4728 6.7746 6.7746 6.7751 6.7751 7.1699 7.1699 7.1744 7.1744 8.1463 8.1463 8.1503 8.1503 8.5638 8.5638 8.5715 8.5715 8.6045 8.6045 8.6135 8.6135 9.1118 9.1118 9.1211 9.1211 10.1969 10.1969 10.2004 10.2004 10.3533 10.3533 10.3680 10.3680 10.4150 10.4150 10.4350 10.4350 10.6248 10.6248 10.6466 10.6466 10.8769 10.8769 10.9029 10.9029 11.0153 11.0153 11.0226 11.0226 12.7198 12.7198 12.7271 12.7271 13.0107 13.0107 13.0247 13.0247 13.3903 13.3903 13.3967 13.3967 13.7277 13.7277 13.7380 13.7380 k = 0.3095 0.5000 0.3095 ( 5660 PWs) bands (ev): -4.2226 -4.2226 -4.2223 -4.2223 -3.7240 -3.7240 -3.7234 -3.7234 -1.2812 -1.2812 -1.2805 -1.2805 -1.0295 -1.0295 -1.0275 -1.0275 4.1886 4.1886 4.1886 4.1886 4.8600 4.8600 4.8680 4.8680 5.3075 5.3075 5.3124 5.3124 6.4826 6.4826 6.4899 6.4899 6.7905 6.7905 6.7918 6.7918 7.1895 7.1895 7.1935 7.1935 8.0918 8.0918 8.0941 8.0941 8.5376 8.5376 8.5461 8.5461 8.5732 8.5732 8.5806 8.5806 9.1099 9.1099 9.1190 9.1190 10.2148 10.2148 10.2191 10.2191 10.3693 10.3693 10.3828 10.3828 10.4312 10.4312 10.4535 10.4535 10.6471 10.6471 10.6736 10.6736 10.8882 10.8882 10.9109 10.9109 11.0322 11.0322 11.0388 11.0388 12.7250 12.7250 12.7313 12.7313 13.0509 13.0509 13.0627 13.0627 13.3559 13.3559 13.3656 13.3656 13.7311 13.7311 13.7407 13.7407 k = 0.2976 0.5000 0.2976 ( 5672 PWs) bands (ev): -4.2562 -4.2562 -4.2559 -4.2559 -3.7076 -3.7076 -3.7069 -3.7069 -1.2633 -1.2633 -1.2624 -1.2624 -0.9948 -0.9948 -0.9926 -0.9926 4.1543 4.1543 4.1546 4.1546 4.8683 4.8683 4.8765 4.8765 5.2631 5.2631 5.2677 5.2677 6.4891 6.4891 6.4965 6.4965 6.8127 6.8127 6.8146 6.8146 7.2053 7.2053 7.2088 7.2088 8.0410 8.0410 8.0415 8.0415 8.5069 8.5069 8.5169 8.5169 8.5509 8.5509 8.5557 8.5557 9.1077 9.1077 9.1165 9.1165 10.2319 10.2319 10.2372 10.2372 10.3831 10.3831 10.3961 10.3961 10.4476 10.4476 10.4716 10.4716 10.6652 10.6652 10.6967 10.6967 10.9006 10.9006 10.9195 10.9195 11.0478 11.0478 11.0538 11.0538 12.7284 12.7284 12.7338 12.7338 13.0898 13.0898 13.0983 13.0983 13.3234 13.3234 13.3373 13.3373 13.7332 13.7332 13.7421 13.7421 k = 0.2857 0.5000 0.2857 ( 5664 PWs) bands (ev): -4.2896 -4.2896 -4.2893 -4.2893 -3.6905 -3.6905 -3.6899 -3.6899 -1.2449 -1.2449 -1.2439 -1.2439 -0.9611 -0.9611 -0.9588 -0.9588 4.1233 4.1233 4.1239 4.1239 4.8768 4.8768 4.8852 4.8852 5.2198 5.2198 5.2240 5.2240 6.4863 6.4863 6.4935 6.4935 6.8399 6.8399 6.8423 6.8423 7.2175 7.2175 7.2202 7.2202 7.9930 7.9930 7.9943 7.9943 8.4728 8.4728 8.4836 8.4836 8.5363 8.5363 8.5395 8.5395 9.1045 9.1045 9.1133 9.1133 10.2478 10.2478 10.2542 10.2542 10.3951 10.3951 10.4084 10.4084 10.4645 10.4645 10.4895 10.4895 10.6794 10.6794 10.7159 10.7159 10.9139 10.9139 10.9289 10.9289 11.0618 11.0618 11.0673 11.0673 12.7295 12.7295 12.7341 12.7341 13.1255 13.1255 13.1292 13.1292 13.2954 13.2954 13.3149 13.3149 13.7343 13.7343 13.7423 13.7423 k = 0.2738 0.5000 0.2738 ( 5660 PWs) bands (ev): -4.3226 -4.3226 -4.3224 -4.3224 -3.6730 -3.6730 -3.6723 -3.6723 -1.2260 -1.2260 -1.2248 -1.2248 -0.9289 -0.9289 -0.9263 -0.9263 4.0956 4.0956 4.0966 4.0966 4.8852 4.8852 4.8939 4.8939 5.1778 5.1778 5.1817 5.1817 6.4761 6.4761 6.4830 6.4830 6.8704 6.8704 6.8730 6.8730 7.2260 7.2260 7.2280 7.2280 7.9489 7.9489 7.9519 7.9519 8.4378 8.4378 8.4487 8.4487 8.5270 8.5270 8.5292 8.5292 9.1002 9.1002 9.1090 9.1090 10.2619 10.2619 10.2695 10.2695 10.4061 10.4061 10.4202 10.4202 10.4816 10.4816 10.5072 10.5072 10.6900 10.6900 10.7313 10.7313 10.9278 10.9278 10.9389 10.9389 11.0739 11.0739 11.0791 11.0791 12.7281 12.7281 12.7322 12.7322 13.1507 13.1507 13.1535 13.1535 13.2771 13.2771 13.3034 13.3034 13.7346 13.7346 13.7416 13.7416 k = 0.2619 0.5000 0.2619 ( 5664 PWs) bands (ev): -4.3552 -4.3552 -4.3550 -4.3550 -3.6549 -3.6549 -3.6543 -3.6543 -1.2069 -1.2069 -1.2055 -1.2055 -0.8983 -0.8983 -0.8955 -0.8955 4.0715 4.0715 4.0728 4.0728 4.8932 4.8932 4.9023 4.9023 5.1375 5.1375 5.1410 5.1410 6.4602 6.4602 6.4667 6.4667 6.9021 6.9021 6.9049 6.9049 7.2313 7.2313 7.2324 7.2324 7.9091 7.9091 7.9139 7.9139 8.4028 8.4028 8.4137 8.4137 8.5217 8.5217 8.5232 8.5232 9.0942 9.0942 9.1031 9.1031 10.2737 10.2737 10.2824 10.2824 10.4172 10.4172 10.4324 10.4324 10.4987 10.4987 10.5244 10.5244 10.6977 10.6977 10.7431 10.7431 10.9421 10.9421 10.9495 10.9495 11.0840 11.0840 11.0891 11.0891 12.7242 12.7242 12.7279 12.7279 13.1585 13.1585 13.1657 13.1657 13.2769 13.2769 13.3077 13.3077 13.7343 13.7343 13.7405 13.7405 k = 0.2500 0.5000 0.2500 ( 5660 PWs) bands (ev): -4.3871 -4.3871 -4.3869 -4.3869 -3.6365 -3.6365 -3.6359 -3.6359 -1.1876 -1.1876 -1.1860 -1.1860 -0.8695 -0.8695 -0.8666 -0.8666 4.0509 4.0509 4.0526 4.0526 4.9002 4.9002 4.9097 4.9097 5.0995 5.0995 5.1028 5.1028 6.4403 6.4403 6.4464 6.4464 6.9333 6.9333 6.9361 6.9361 7.2341 7.2341 7.2342 7.2342 7.8738 7.8738 7.8803 7.8803 8.3686 8.3686 8.3792 8.3792 8.5196 8.5196 8.5206 8.5206 9.0861 9.0861 9.0951 9.0951 10.2827 10.2827 10.2922 10.2922 10.4293 10.4293 10.4455 10.4455 10.5156 10.5156 10.5411 10.5411 10.7029 10.7029 10.7515 10.7515 10.9564 10.9564 10.9607 10.9607 11.0921 11.0921 11.0974 11.0974 12.7180 12.7180 12.7216 12.7216 13.1540 13.1540 13.1608 13.1608 13.2962 13.2962 13.3265 13.3265 13.7340 13.7340 13.7394 13.7394 k = 0.2381 0.5000 0.2381 ( 5664 PWs) bands (ev): -4.4182 -4.4182 -4.4180 -4.4180 -3.6178 -3.6178 -3.6172 -3.6172 -1.1682 -1.1682 -1.1664 -1.1664 -0.8426 -0.8426 -0.8395 -0.8395 4.0338 4.0338 4.0359 4.0359 4.9048 4.9048 4.9146 4.9146 5.0653 5.0653 5.0685 5.0685 6.4178 6.4178 6.4234 6.4234 6.9621 6.9621 6.9649 6.9649 7.2344 7.2344 7.2352 7.2352 7.8429 7.8429 7.8510 7.8510 8.3351 8.3351 8.3455 8.3455 8.5200 8.5200 8.5207 8.5207 9.0754 9.0754 9.0847 9.0847 10.2887 10.2887 10.2986 10.2986 10.4430 10.4430 10.4600 10.4600 10.5321 10.5321 10.5569 10.5569 10.7065 10.7065 10.7573 10.7573 10.9705 10.9705 10.9721 10.9721 11.0982 11.0982 11.1038 11.1038 12.7099 12.7099 12.7136 12.7136 13.1434 13.1434 13.1482 13.1482 13.3250 13.3250 13.3530 13.3530 13.7342 13.7342 13.7388 13.7388 k = 0.2262 0.5000 0.2262 ( 5660 PWs) bands (ev): -4.4484 -4.4484 -4.4483 -4.4483 -3.5990 -3.5990 -3.5983 -3.5983 -1.1490 -1.1490 -1.1469 -1.1469 -0.8178 -0.8178 -0.8145 -0.8145 4.0202 4.0202 4.0226 4.0226 4.9043 4.9043 4.9143 4.9143 5.0379 5.0379 5.0407 5.0407 6.3940 6.3940 6.3991 6.3991 6.9868 6.9868 6.9896 6.9896 7.2345 7.2345 7.2362 7.2362 7.8162 7.8162 7.8259 7.8259 8.3027 8.3027 8.3128 8.3128 8.5224 8.5224 8.5230 8.5230 9.0619 9.0619 9.0714 9.0714 10.2918 10.2918 10.3018 10.3018 10.4585 10.4585 10.4761 10.4761 10.5480 10.5480 10.5716 10.5716 10.7091 10.7091 10.7609 10.7609 10.9835 10.9835 10.9842 10.9842 11.1025 11.1025 11.1088 11.1088 12.7005 12.7005 12.7045 12.7045 13.1311 13.1311 13.1343 13.1343 13.3566 13.3566 13.3823 13.3823 13.7352 13.7352 13.7392 13.7392 k = 0.2143 0.5000 0.2143 ( 5662 PWs) bands (ev): -4.4776 -4.4776 -4.4775 -4.4775 -3.5800 -3.5800 -3.5794 -3.5794 -1.1299 -1.1299 -1.1277 -1.1277 -0.7951 -0.7951 -0.7916 -0.7916 4.0099 4.0099 4.0127 4.0127 4.8947 4.8947 4.9041 4.9041 5.0218 5.0218 5.0234 5.0234 6.3698 6.3698 6.3744 6.3744 7.0051 7.0051 7.0078 7.0078 7.2367 7.2367 7.2391 7.2391 7.7935 7.7935 7.8047 7.8047 8.2715 8.2715 8.2813 8.2813 8.5264 8.5264 8.5269 8.5269 9.0450 9.0450 9.0548 9.0548 10.2924 10.2924 10.3021 10.3021 10.4754 10.4754 10.4934 10.4934 10.5632 10.5632 10.5849 10.5849 10.7115 10.7115 10.7631 10.7631 10.9946 10.9946 10.9970 10.9970 11.1055 11.1055 11.1126 11.1126 12.6907 12.6907 12.6951 12.6951 13.1189 13.1189 13.1210 13.1210 13.3877 13.3877 13.4117 13.4117 13.7376 13.7376 13.7412 13.7412 k = 0.2024 0.5000 0.2024 ( 5666 PWs) bands (ev): -4.5057 -4.5057 -4.5056 -4.5056 -3.5611 -3.5611 -3.5604 -3.5604 -1.1111 -1.1111 -1.1087 -1.1087 -0.7745 -0.7745 -0.7708 -0.7708 4.0029 4.0029 4.0060 4.0060 4.8743 4.8743 4.8826 4.8826 5.0185 5.0185 5.0185 5.0185 6.3461 6.3461 6.3502 6.3502 7.0151 7.0151 7.0178 7.0178 7.2428 7.2428 7.2459 7.2459 7.7745 7.7745 7.7869 7.7869 8.2416 8.2416 8.2511 8.2511 8.5312 8.5312 8.5319 8.5319 9.0245 9.0245 9.0345 9.0345 10.2909 10.2909 10.3003 10.3003 10.4930 10.4930 10.5117 10.5117 10.5777 10.5777 10.5965 10.5965 10.7145 10.7145 10.7645 10.7645 11.0050 11.0050 11.0088 11.0088 11.1076 11.1076 11.1156 11.1156 12.6812 12.6812 12.6861 12.6861 13.1071 13.1071 13.1086 13.1086 13.4171 13.4171 13.4396 13.4396 13.7418 13.7418 13.7452 13.7452 k = 0.1905 0.5000 0.1905 ( 5652 PWs) bands (ev): -4.5326 -4.5326 -4.5325 -4.5325 -3.5422 -3.5422 -3.5416 -3.5416 -1.0929 -1.0929 -1.0903 -1.0903 -0.7559 -0.7559 -0.7521 -0.7521 3.9988 3.9988 4.0023 4.0023 4.8459 4.8459 4.8534 4.8534 5.0231 5.0231 5.0243 5.0243 6.3237 6.3237 6.3272 6.3272 7.0157 7.0157 7.0184 7.0184 7.2542 7.2542 7.2575 7.2575 7.7591 7.7591 7.7725 7.7725 8.2132 8.2132 8.2224 8.2224 8.5366 8.5366 8.5375 8.5375 9.0003 9.0003 9.0105 9.0105 10.2880 10.2880 10.2968 10.2968 10.5106 10.5106 10.5302 10.5302 10.5917 10.5917 10.6064 10.6064 10.7187 10.7187 10.7657 10.7657 11.0146 11.0146 11.0193 11.0193 11.1095 11.1095 11.1183 11.1183 12.6726 12.6726 12.6780 12.6780 13.0957 13.0957 13.0969 13.0969 13.4440 13.4440 13.4651 13.4651 13.7485 13.7485 13.7516 13.7516 k = 0.1786 0.5000 0.1786 ( 5652 PWs) bands (ev): -4.5582 -4.5582 -4.5581 -4.5581 -3.5237 -3.5237 -3.5231 -3.5231 -1.0752 -1.0752 -1.0725 -1.0725 -0.7393 -0.7393 -0.7354 -0.7354 3.9975 3.9975 4.0013 4.0013 4.8133 4.8133 4.8204 4.8204 5.0335 5.0335 5.0354 5.0354 6.3034 6.3034 6.3063 6.3063 7.0074 7.0074 7.0100 7.0100 7.2702 7.2702 7.2736 7.2736 7.7470 7.7470 7.7611 7.7611 8.1865 8.1865 8.1953 8.1953 8.5419 8.5419 8.5432 8.5432 8.9723 8.9723 8.9828 8.9828 10.2839 10.2839 10.2923 10.2923 10.5275 10.5275 10.5482 10.5482 10.6053 10.6053 10.6149 10.6149 10.7245 10.7245 10.7671 10.7671 11.0228 11.0228 11.0281 11.0281 11.1115 11.1115 11.1210 11.1210 12.6654 12.6654 12.6713 12.6713 13.0844 13.0844 13.0854 13.0854 13.4677 13.4677 13.4875 13.4875 13.7578 13.7578 13.7607 13.7607 k = 0.1667 0.5000 0.1667 ( 5640 PWs) bands (ev): -4.5824 -4.5824 -4.5823 -4.5823 -3.5055 -3.5055 -3.5049 -3.5049 -1.0584 -1.0584 -1.0554 -1.0554 -0.7246 -0.7246 -0.7206 -0.7206 3.9988 3.9988 4.0029 4.0029 4.7787 4.7787 4.7857 4.7857 5.0475 5.0475 5.0497 5.0497 6.2857 6.2857 6.2880 6.2880 6.9917 6.9917 6.9942 6.9942 7.2892 7.2892 7.2926 7.2926 7.7382 7.7382 7.7529 7.7529 8.1614 8.1614 8.1699 8.1699 8.5468 8.5468 8.5486 8.5486 8.9408 8.9408 8.9515 8.9515 10.2793 10.2793 10.2871 10.2871 10.5428 10.5428 10.5644 10.5644 10.6191 10.6191 10.6232 10.6232 10.7320 10.7320 10.7693 10.7693 11.0297 11.0297 11.0349 11.0349 11.1143 11.1143 11.1242 11.1242 12.6600 12.6600 12.6664 12.6664 13.0729 13.0729 13.0738 13.0738 13.4880 13.4880 13.5065 13.5065 13.7698 13.7698 13.7727 13.7727 k = 0.1548 0.5000 0.1548 ( 5644 PWs) bands (ev): -4.6052 -4.6052 -4.6051 -4.6051 -3.4878 -3.4878 -3.4872 -3.4872 -1.0424 -1.0424 -1.0393 -1.0393 -0.7117 -0.7117 -0.7076 -0.7076 4.0024 4.0024 4.0068 4.0068 4.7433 4.7433 4.7504 4.7504 5.0637 5.0637 5.0659 5.0659 6.2712 6.2712 6.2728 6.2728 6.9702 6.9702 6.9725 6.9725 7.3093 7.3093 7.3125 7.3125 7.7329 7.7329 7.7478 7.7478 8.1382 8.1382 8.1464 8.1464 8.5507 8.5507 8.5532 8.5532 8.9062 8.9062 8.9171 8.9171 10.2743 10.2743 10.2816 10.2816 10.5558 10.5558 10.5775 10.5775 10.6328 10.6328 10.6335 10.6335 10.7406 10.7406 10.7724 10.7724 11.0350 11.0350 11.0395 11.0395 11.1183 11.1183 11.1281 11.1281 12.6567 12.6567 12.6634 12.6634 13.0608 13.0608 13.0617 13.0617 13.5048 13.5048 13.5220 13.5220 13.7844 13.7844 13.7873 13.7873 k = 0.1429 0.5000 0.1429 ( 5644 PWs) bands (ev): -4.6266 -4.6266 -4.6265 -4.6265 -3.4707 -3.4707 -3.4702 -3.4702 -1.0274 -1.0274 -1.0243 -1.0243 -0.7003 -0.7003 -0.6962 -0.6962 4.0079 4.0079 4.0127 4.0127 4.7078 4.7078 4.7150 4.7150 5.0814 5.0814 5.0835 5.0835 6.2605 6.2605 6.2612 6.2612 6.9444 6.9444 6.9464 6.9464 7.3289 7.3289 7.3317 7.3317 7.7313 7.7313 7.7462 7.7462 8.1169 8.1169 8.1248 8.1248 8.5530 8.5530 8.5563 8.5563 8.8694 8.8694 8.8804 8.8804 10.2692 10.2692 10.2759 10.2759 10.5661 10.5661 10.5863 10.5863 10.6450 10.6450 10.6486 10.6486 10.7502 10.7502 10.7764 10.7764 11.0388 11.0388 11.0423 11.0423 11.1234 11.1234 11.1327 11.1327 12.6555 12.6555 12.6625 12.6625 13.0481 13.0481 13.0489 13.0489 13.5185 13.5185 13.5344 13.5344 13.8010 13.8010 13.8040 13.8040 k = 0.1310 0.5000 0.1310 ( 5646 PWs) bands (ev): -4.6464 -4.6464 -4.6463 -4.6463 -3.4544 -3.4544 -3.4539 -3.4539 -1.0135 -1.0135 -1.0104 -1.0104 -0.6904 -0.6904 -0.6863 -0.6863 4.0152 4.0152 4.0203 4.0203 4.6726 4.6726 4.6800 4.6800 5.1002 5.1002 5.1021 5.1021 6.2537 6.2537 6.2538 6.2538 6.9150 6.9150 6.9166 6.9166 7.3465 7.3465 7.3487 7.3487 7.7340 7.7340 7.7485 7.7485 8.0976 8.0976 8.1053 8.1053 8.5530 8.5530 8.5573 8.5573 8.8313 8.8313 8.8426 8.8426 10.2642 10.2642 10.2703 10.2703 10.5740 10.5740 10.5914 10.5914 10.6597 10.6597 10.6644 10.6644 10.7602 10.7602 10.7812 10.7812 11.0414 11.0414 11.0436 11.0436 11.1293 11.1293 11.1380 11.1380 12.6564 12.6564 12.6636 12.6636 13.0344 13.0344 13.0353 13.0353 13.5294 13.5294 13.5440 13.5440 13.8189 13.8189 13.8222 13.8222 k = 0.1190 0.5000 0.1190 ( 5642 PWs) bands (ev): -4.6646 -4.6646 -4.6645 -4.6645 -3.4389 -3.4389 -3.4385 -3.4385 -1.0009 -1.0009 -0.9977 -0.9977 -0.6817 -0.6817 -0.6777 -0.6777 4.0240 4.0240 4.0293 4.0293 4.6380 4.6380 4.6456 4.6456 5.1195 5.1195 5.1211 5.1211 6.2506 6.2506 6.2515 6.2515 6.8829 6.8829 6.8839 6.8839 7.3611 7.3611 7.3627 7.3627 7.7412 7.7412 7.7551 7.7551 8.0804 8.0804 8.0878 8.0878 8.5496 8.5496 8.5549 8.5549 8.7936 8.7936 8.8053 8.8053 10.2594 10.2594 10.2648 10.2648 10.5798 10.5798 10.5941 10.5941 10.6756 10.6756 10.6805 10.6805 10.7701 10.7701 10.7865 10.7865 11.0429 11.0429 11.0438 11.0438 11.1358 11.1358 11.1436 11.1436 12.6596 12.6596 12.6668 12.6668 13.0199 13.0199 13.0208 13.0208 13.5381 13.5381 13.5514 13.5514 13.8375 13.8375 13.8412 13.8412 k = 0.1071 0.5000 0.1071 ( 5646 PWs) bands (ev): -4.6812 -4.6812 -4.6811 -4.6811 -3.4245 -3.4245 -3.4240 -3.4240 -0.9895 -0.9895 -0.9864 -0.9864 -0.6741 -0.6741 -0.6702 -0.6702 4.0341 4.0341 4.0395 4.0395 4.6044 4.6044 4.6120 4.6120 5.1388 5.1388 5.1401 5.1401 6.2521 6.2521 6.2539 6.2539 6.8484 6.8484 6.8487 6.8487 7.3721 7.3721 7.3730 7.3730 7.7532 7.7532 7.7663 7.7663 8.0652 8.0652 8.0724 8.0724 8.5414 8.5414 8.5476 8.5476 8.7586 8.7586 8.7704 8.7704 10.2548 10.2548 10.2597 10.2597 10.5841 10.5841 10.5955 10.5955 10.6917 10.6917 10.6965 10.6965 10.7797 10.7797 10.7921 10.7921 11.0435 11.0435 11.0437 11.0437 11.1424 11.1424 11.1493 11.1493 12.6648 12.6648 12.6719 12.6719 13.0046 13.0046 13.0055 13.0055 13.5451 13.5451 13.5570 13.5570 13.8558 13.8558 13.8602 13.8602 k = 0.0952 0.5000 0.0952 ( 5630 PWs) bands (ev): -4.6961 -4.6961 -4.6961 -4.6961 -3.4112 -3.4112 -3.4108 -3.4108 -0.9794 -0.9794 -0.9764 -0.9764 -0.6675 -0.6675 -0.6638 -0.6638 4.0451 4.0451 4.0506 4.0506 4.5721 4.5721 4.5797 4.5797 5.1578 5.1578 5.1587 5.1587 6.2584 6.2584 6.2611 6.2611 6.8113 6.8113 6.8117 6.8117 7.3796 7.3796 7.3798 7.3798 7.7696 7.7696 7.7818 7.7818 8.0521 8.0521 8.0593 8.0593 8.5268 8.5268 8.5335 8.5335 8.7289 8.7289 8.7404 8.7404 10.2506 10.2506 10.2548 10.2548 10.5874 10.5874 10.5963 10.5963 10.7073 10.7073 10.7119 10.7119 10.7887 10.7887 10.7977 10.7977 11.0430 11.0430 11.0441 11.0441 11.1489 11.1489 11.1550 11.1550 12.6719 12.6719 12.6788 12.6788 12.9885 12.9885 12.9895 12.9895 13.5507 13.5507 13.5613 13.5613 13.8734 13.8734 13.8786 13.8786 k = 0.0833 0.5000 0.0833 ( 5626 PWs) bands (ev): -4.7094 -4.7094 -4.7094 -4.7094 -3.3991 -3.3991 -3.3987 -3.3987 -0.9706 -0.9706 -0.9678 -0.9678 -0.6618 -0.6618 -0.6584 -0.6584 4.0567 4.0567 4.0623 4.0623 4.5415 4.5415 4.5489 4.5489 5.1759 5.1759 5.1765 5.1765 6.2697 6.2697 6.2732 6.2732 6.7721 6.7721 6.7732 6.7732 7.3832 7.3832 7.3836 7.3836 7.7898 7.7898 7.8012 7.8012 8.0412 8.0412 8.0483 8.0483 8.5048 8.5048 8.5113 8.5113 8.7065 8.7065 8.7170 8.7170 10.2467 10.2467 10.2504 10.2504 10.5898 10.5898 10.5968 10.5968 10.7219 10.7219 10.7262 10.7262 10.7967 10.7967 10.8030 10.8030 11.0425 11.0425 11.0442 11.0442 11.1550 11.1550 11.1603 11.1603 12.6807 12.6807 12.6874 12.6874 12.9719 12.9719 12.9729 12.9729 13.5552 13.5552 13.5646 13.5646 13.8894 13.8894 13.8957 13.8957 k = 0.0714 0.5000 0.0714 ( 5630 PWs) bands (ev): -4.7210 -4.7210 -4.7209 -4.7209 -3.3883 -3.3883 -3.3880 -3.3880 -0.9631 -0.9631 -0.9606 -0.9606 -0.6569 -0.6569 -0.6538 -0.6538 4.0687 4.0687 4.0741 4.0741 4.5130 4.5130 4.5200 4.5200 5.1926 5.1926 5.1929 5.1929 6.2859 6.2859 6.2902 6.2902 6.7312 6.7312 6.7332 6.7332 7.3841 7.3841 7.3849 7.3849 7.8128 7.8128 7.8234 7.8234 8.0326 8.0326 8.0395 8.0395 8.4761 8.4761 8.4819 8.4819 8.6915 8.6915 8.7004 8.7004 10.2433 10.2433 10.2464 10.2464 10.5917 10.5917 10.5972 10.5972 10.7353 10.7353 10.7392 10.7392 10.8036 10.8036 10.8078 10.8078 11.0421 11.0421 11.0442 11.0442 11.1605 11.1605 11.1651 11.1651 12.6909 12.6909 12.6972 12.6972 12.9549 12.9549 12.9561 12.9561 13.5589 13.5589 13.5670 13.5670 13.9034 13.9034 13.9111 13.9111 k = 0.0595 0.5000 0.0595 ( 5642 PWs) bands (ev): -4.7308 -4.7308 -4.7307 -4.7307 -3.3791 -3.3791 -3.3788 -3.3788 -0.9568 -0.9568 -0.9546 -0.9546 -0.6527 -0.6527 -0.6500 -0.6500 4.0807 4.0807 4.0858 4.0858 4.4870 4.4870 4.4936 4.4936 5.2076 5.2076 5.2077 5.2077 6.3070 6.3070 6.3119 6.3119 6.6890 6.6890 6.6918 6.6918 7.3833 7.3833 7.3843 7.3843 7.8372 7.8372 7.8470 7.8470 8.0264 8.0264 8.0332 8.0332 8.4431 8.4431 8.4478 8.4478 8.6824 8.6824 8.6895 8.6895 10.2403 10.2403 10.2428 10.2428 10.5932 10.5932 10.5974 10.5974 10.7471 10.7471 10.7508 10.7508 10.8093 10.8093 10.8118 10.8118 11.0419 11.0419 11.0441 11.0441 11.1654 11.1654 11.1692 11.1692 12.7022 12.7022 12.7079 12.7079 12.9380 12.9380 12.9393 12.9393 13.5620 13.5620 13.5688 13.5688 13.9149 13.9149 13.9241 13.9241 k = 0.0476 0.5000 0.0476 ( 5646 PWs) bands (ev): -4.7388 -4.7388 -4.7388 -4.7388 -3.3714 -3.3714 -3.3711 -3.3711 -0.9518 -0.9518 -0.9500 -0.9500 -0.6492 -0.6492 -0.6470 -0.6470 4.0921 4.0921 4.0967 4.0967 4.4643 4.4643 4.4701 4.4701 5.2202 5.2202 5.2203 5.2203 6.3327 6.3327 6.3380 6.3380 6.6459 6.6459 6.6495 6.6495 7.3815 7.3815 7.3826 7.3826 7.8614 7.8614 7.8703 7.8703 8.0229 8.0229 8.0295 8.0295 8.4087 8.4087 8.4124 8.4124 8.6772 8.6772 8.6826 8.6826 10.2378 10.2378 10.2398 10.2398 10.5945 10.5945 10.5976 10.5976 10.7574 10.7574 10.7606 10.7606 10.8138 10.8138 10.8151 10.8151 11.0420 11.0420 11.0440 11.0440 11.1695 11.1695 11.1726 11.1726 12.7140 12.7140 12.7191 12.7191 12.9217 12.9217 12.9230 12.9230 13.5645 13.5645 13.5700 13.5700 13.9237 13.9237 13.9339 13.9339 k = 0.0357 0.5000 0.0357 ( 5654 PWs) bands (ev): -4.7451 -4.7451 -4.7451 -4.7451 -3.3653 -3.3653 -3.3651 -3.3651 -0.9479 -0.9479 -0.9465 -0.9465 -0.6464 -0.6464 -0.6447 -0.6447 4.1024 4.1024 4.1062 4.1062 4.4455 4.4455 4.4503 4.4503 5.2304 5.2304 5.2305 5.2305 6.3625 6.3625 6.3682 6.3682 6.6025 6.6025 6.6068 6.6068 7.3795 7.3795 7.3804 7.3804 7.8832 7.8832 7.8909 7.8909 8.0225 8.0225 8.0283 8.0283 8.3763 8.3763 8.3790 8.3790 8.6744 8.6744 8.6783 8.6783 10.2359 10.2359 10.2374 10.2374 10.5955 10.5955 10.5977 10.5977 10.7658 10.7658 10.7684 10.7684 10.8171 10.8171 10.8175 10.8175 11.0422 11.0422 11.0439 11.0439 11.1729 11.1729 11.1751 11.1751 12.7257 12.7257 12.7299 12.7299 12.9067 12.9067 12.9081 12.9081 13.5666 13.5666 13.5707 13.5707 13.9300 13.9300 13.9394 13.9394 k = 0.0238 0.5000 0.0238 ( 5658 PWs) bands (ev): -4.7496 -4.7496 -4.7496 -4.7496 -3.3609 -3.3609 -3.3608 -3.3608 -0.9450 -0.9450 -0.9441 -0.9441 -0.6443 -0.6443 -0.6432 -0.6432 4.1108 4.1108 4.1136 4.1136 4.4315 4.4315 4.4349 4.4349 5.2378 5.2378 5.2380 5.2380 6.3960 6.3960 6.4018 6.4018 6.5593 6.5593 6.5641 6.5641 7.3777 7.3777 7.3784 7.3784 7.9008 7.9008 7.9064 7.9064 8.0249 8.0249 8.0294 8.0294 8.3491 8.3491 8.3509 8.3509 8.6730 8.6730 8.6756 8.6756 10.2346 10.2346 10.2356 10.2356 10.5963 10.5963 10.5977 10.5977 10.7722 10.7722 10.7741 10.7741 10.8191 10.8191 10.8192 10.8192 11.0425 11.0425 11.0437 11.0437 11.1754 11.1754 11.1769 11.1769 12.7361 12.7361 12.7392 12.7392 12.8943 12.8943 12.8955 12.8955 13.5682 13.5682 13.5710 13.5710 13.9342 13.9342 13.9410 13.9410 k = 0.0119 0.5000 0.0119 ( 5654 PWs) bands (ev): -4.7523 -4.7523 -4.7523 -4.7523 -3.3582 -3.3582 -3.3581 -3.3581 -0.9433 -0.9433 -0.9428 -0.9428 -0.6430 -0.6430 -0.6424 -0.6424 4.1166 4.1166 4.1181 4.1181 4.4231 4.4231 4.4249 4.4249 5.2424 5.2424 5.2425 5.2425 6.4322 6.4322 6.4378 6.4378 6.5174 6.5174 6.5226 6.5226 7.3766 7.3766 7.3770 7.3770 7.9124 7.9124 7.9154 7.9154 8.0286 8.0286 8.0311 8.0311 8.3308 8.3308 8.3316 8.3316 8.6727 8.6727 8.6739 8.6739 10.2339 10.2339 10.2344 10.2344 10.5969 10.5969 10.5976 10.5976 10.7764 10.7764 10.7774 10.7774 10.8202 10.8202 10.8202 10.8202 11.0429 11.0429 11.0435 11.0435 11.1771 11.1771 11.1779 11.1779 12.7438 12.7438 12.7454 12.7454 12.8860 12.8860 12.8867 12.8867 13.5695 13.5695 13.5709 13.5709 13.9371 13.9371 13.9405 13.9405 k = 0.0000 0.5000-0.0000 ( 5622 PWs) bands (ev): -4.7532 -4.7532 -4.7532 -4.7532 -3.3573 -3.3573 -3.3573 -3.3573 -0.9425 -0.9425 -0.9425 -0.9425 -0.6423 -0.6423 -0.6423 -0.6423 4.1191 4.1191 4.1191 4.1191 4.4209 4.4209 4.4209 4.4209 5.2440 5.2440 5.2440 5.2440 6.4635 6.4635 6.4635 6.4635 6.4897 6.4897 6.4897 6.4897 7.3764 7.3764 7.3764 7.3764 7.9173 7.9173 7.9173 7.9173 8.0313 8.0313 8.0313 8.0313 8.3245 8.3245 8.3245 8.3245 8.6730 8.6730 8.6730 8.6730 10.2338 10.2338 10.2338 10.2338 10.5974 10.5974 10.5974 10.5974 10.7782 10.7782 10.7782 10.7782 10.8207 10.8207 10.8207 10.8207 11.0433 11.0433 11.0433 11.0433 11.1780 11.1780 11.1780 11.1780 12.7472 12.7472 12.7472 12.7472 12.8833 12.8833 12.8833 12.8833 13.5704 13.5704 13.5704 13.5704 13.9391 13.9391 13.9391 13.9391 k = 0.5000 0.5000-0.0000 ( 5656 PWs) bands (ev): -4.0677 -4.0677 -4.0677 -4.0677 -4.0673 -4.0673 -4.0673 -4.0673 -0.9179 -0.9179 -0.9179 -0.9179 -0.9164 -0.9164 -0.9164 -0.9164 4.0764 4.0764 4.0764 4.0764 4.0802 4.0802 4.0802 4.0802 5.9737 5.9737 5.9737 5.9737 5.9790 5.9790 5.9790 5.9790 7.3632 7.3632 7.3632 7.3632 7.3691 7.3691 7.3691 7.3691 7.8737 7.8737 7.8737 7.8737 7.8753 7.8753 7.8753 7.8753 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 8.9048 10.3238 10.3238 10.3238 10.3238 10.3496 10.3496 10.3496 10.3496 10.7837 10.7837 10.7837 10.7837 10.7943 10.7943 10.7943 10.7943 11.0431 11.0431 11.0431 11.0431 11.0676 11.0676 11.0676 11.0676 13.0232 13.0232 13.0232 13.0232 13.0242 13.0242 13.0242 13.0242 13.1015 13.1015 13.1015 13.1015 13.1114 13.1114 13.1114 13.1114 k = 0.5000 0.5000 0.0172 ( 5656 PWs) bands (ev): -4.0672 -4.0672 -4.0672 -4.0672 -4.0668 -4.0668 -4.0668 -4.0668 -0.9194 -0.9194 -0.9194 -0.9194 -0.9179 -0.9179 -0.9179 -0.9179 4.0782 4.0782 4.0784 4.0784 4.0819 4.0819 4.0822 4.0822 5.9734 5.9734 5.9738 5.9738 5.9785 5.9785 5.9792 5.9792 7.3617 7.3617 7.3623 7.3623 7.3676 7.3676 7.3679 7.3679 7.8757 7.8757 7.8758 7.8758 7.8771 7.8771 7.8772 7.8772 8.9041 8.9041 8.9043 8.9043 8.9048 8.9048 8.9051 8.9051 10.3233 10.3233 10.3242 10.3242 10.3494 10.3494 10.3498 10.3498 10.7807 10.7807 10.7837 10.7837 10.7908 10.7908 10.7948 10.7948 11.0405 11.0405 11.0448 11.0448 11.0660 11.0660 11.0682 11.0682 13.0143 13.0143 13.0168 13.0168 13.0233 13.0233 13.0273 13.0273 13.1013 13.1013 13.1118 13.1118 13.1121 13.1121 13.1208 13.1208 k = 0.5000 0.5000 0.0345 ( 5676 PWs) bands (ev): -4.0657 -4.0657 -4.0656 -4.0656 -4.0652 -4.0652 -4.0652 -4.0652 -0.9241 -0.9241 -0.9241 -0.9241 -0.9226 -0.9226 -0.9225 -0.9225 4.0838 4.0838 4.0842 4.0842 4.0874 4.0874 4.0880 4.0880 5.9728 5.9728 5.9737 5.9737 5.9778 5.9778 5.9792 5.9792 7.3577 7.3577 7.3590 7.3590 7.3635 7.3635 7.3642 7.3642 7.8817 7.8817 7.8819 7.8819 7.8827 7.8827 7.8830 7.8830 8.9030 8.9030 8.9033 8.9033 8.9045 8.9045 8.9049 8.9049 10.3227 10.3227 10.3245 10.3245 10.3491 10.3491 10.3498 10.3498 10.7749 10.7749 10.7807 10.7807 10.7844 10.7844 10.7924 10.7924 11.0369 11.0369 11.0453 11.0453 11.0635 11.0635 11.0677 11.0677 13.0016 13.0016 13.0068 13.0068 13.0170 13.0170 13.0225 13.0225 13.1126 13.1126 13.1222 13.1222 13.1292 13.1292 13.1372 13.1372 k = 0.5000 0.5000 0.0517 ( 5656 PWs) bands (ev): -4.0631 -4.0631 -4.0629 -4.0629 -4.0626 -4.0626 -4.0626 -4.0626 -0.9317 -0.9317 -0.9317 -0.9317 -0.9303 -0.9303 -0.9301 -0.9301 4.0930 4.0930 4.0937 4.0937 4.0967 4.0967 4.0976 4.0976 5.9720 5.9720 5.9734 5.9734 5.9770 5.9770 5.9790 5.9790 7.3513 7.3513 7.3533 7.3533 7.3569 7.3569 7.3577 7.3577 7.8917 7.8917 7.8921 7.8921 7.8923 7.8923 7.8927 7.8927 8.9017 8.9017 8.9021 8.9021 8.9038 8.9038 8.9045 8.9045 10.3222 10.3222 10.3247 10.3247 10.3488 10.3488 10.3498 10.3498 10.7664 10.7664 10.7749 10.7749 10.7753 10.7753 10.7870 10.7870 11.0325 11.0325 11.0449 11.0449 11.0602 11.0602 11.0664 11.0664 12.9882 12.9882 12.9956 12.9956 13.0068 13.0068 13.0132 13.0132 13.1319 13.1319 13.1400 13.1400 13.1505 13.1505 13.1582 13.1582 k = 0.5000 0.5000 0.0690 ( 5656 PWs) bands (ev): -4.0595 -4.0595 -4.0592 -4.0592 -4.0590 -4.0590 -4.0590 -4.0590 -0.9423 -0.9423 -0.9423 -0.9423 -0.9410 -0.9410 -0.9407 -0.9407 4.1059 4.1059 4.1068 4.1068 4.1095 4.1095 4.1107 4.1107 5.9709 5.9709 5.9728 5.9728 5.9758 5.9758 5.9785 5.9785 7.3423 7.3423 7.3450 7.3450 7.3475 7.3475 7.3485 7.3485 7.9057 7.9057 7.9057 7.9057 7.9062 7.9062 7.9063 7.9063 8.9002 8.9002 8.9008 8.9008 8.9029 8.9029 8.9039 8.9039 10.3213 10.3213 10.3246 10.3246 10.3484 10.3484 10.3495 10.3495 10.7553 10.7553 10.7637 10.7637 10.7661 10.7661 10.7787 10.7787 11.0273 11.0273 11.0434 11.0434 11.0561 11.0561 11.0639 11.0639 12.9750 12.9750 12.9840 12.9840 12.9949 12.9949 13.0022 13.0022 13.1561 13.1561 13.1626 13.1626 13.1750 13.1750 13.1826 13.1826 k = 0.5000 0.5000 0.0862 ( 5664 PWs) bands (ev): -4.0549 -4.0549 -4.0546 -4.0546 -4.0544 -4.0544 -4.0543 -4.0543 -0.9557 -0.9557 -0.9557 -0.9557 -0.9544 -0.9544 -0.9541 -0.9541 4.1223 4.1223 4.1234 4.1234 4.1259 4.1259 4.1273 4.1273 5.9696 5.9696 5.9720 5.9720 5.9745 5.9745 5.9777 5.9777 7.3307 7.3307 7.3341 7.3341 7.3355 7.3355 7.3365 7.3365 7.9231 7.9231 7.9237 7.9237 7.9237 7.9237 7.9248 7.9248 8.8987 8.8987 8.8994 8.8994 8.9021 8.9021 8.9033 8.9033 10.3202 10.3202 10.3241 10.3241 10.3476 10.3476 10.3487 10.3487 10.7418 10.7418 10.7496 10.7496 10.7545 10.7545 10.7674 10.7674 11.0211 11.0211 11.0405 11.0405 11.0510 11.0510 11.0602 11.0602 12.9621 12.9621 12.9724 12.9724 12.9822 12.9822 12.9907 12.9907 13.1836 13.1836 13.1888 13.1888 13.2020 13.2020 13.2097 13.2097 k = 0.5000 0.5000 0.1034 ( 5664 PWs) bands (ev): -4.0493 -4.0493 -4.0490 -4.0490 -4.0488 -4.0488 -4.0488 -4.0488 -0.9717 -0.9717 -0.9717 -0.9717 -0.9705 -0.9705 -0.9701 -0.9701 4.1419 4.1419 4.1433 4.1433 4.1455 4.1455 4.1472 4.1472 5.9681 5.9681 5.9710 5.9710 5.9730 5.9730 5.9768 5.9768 7.3164 7.3164 7.3205 7.3205 7.3207 7.3207 7.3218 7.3218 7.9446 7.9446 7.9452 7.9452 7.9458 7.9458 7.9474 7.9474 8.8976 8.8976 8.8984 8.8984 8.9015 8.9015 8.9029 8.9029 10.3186 10.3186 10.3231 10.3231 10.3464 10.3464 10.3473 10.3473 10.7262 10.7262 10.7333 10.7333 10.7403 10.7403 10.7535 10.7535 11.0140 11.0140 11.0366 11.0366 11.0452 11.0452 11.0554 11.0554 12.9494 12.9494 12.9606 12.9606 12.9691 12.9691 12.9789 12.9789 13.2137 13.2137 13.2179 13.2179 13.2313 13.2313 13.2392 13.2392 k = 0.5000 0.5000 0.1207 ( 5656 PWs) bands (ev): -4.0429 -4.0429 -4.0425 -4.0425 -4.0423 -4.0423 -4.0423 -4.0423 -0.9901 -0.9901 -0.9901 -0.9901 -0.9890 -0.9890 -0.9885 -0.9885 4.1647 4.1647 4.1663 4.1663 4.1683 4.1683 4.1702 4.1702 5.9663 5.9663 5.9697 5.9697 5.9712 5.9712 5.9755 5.9755 7.2995 7.2995 7.3033 7.3033 7.3042 7.3042 7.3043 7.3043 7.9700 7.9700 7.9706 7.9706 7.9719 7.9719 7.9741 7.9741 8.8969 8.8969 8.8979 8.8979 8.9013 8.9013 8.9030 8.9030 10.3163 10.3163 10.3213 10.3213 10.3446 10.3446 10.3450 10.3450 10.7085 10.7085 10.7151 10.7151 10.7237 10.7237 10.7371 10.7371 11.0062 11.0062 11.0314 11.0314 11.0384 11.0384 11.0494 11.0494 12.9367 12.9367 12.9487 12.9487 12.9557 12.9557 12.9671 12.9671 13.2458 13.2458 13.2494 13.2494 13.2626 13.2626 13.2706 13.2706 k = 0.5000 0.5000 0.1379 ( 5652 PWs) bands (ev): -4.0356 -4.0356 -4.0351 -4.0351 -4.0350 -4.0350 -4.0350 -4.0350 -1.0107 -1.0107 -1.0107 -1.0107 -1.0096 -1.0096 -1.0091 -1.0091 4.1902 4.1902 4.1922 4.1922 4.1940 4.1940 4.1961 4.1961 5.9643 5.9643 5.9682 5.9682 5.9693 5.9693 5.9740 5.9740 7.2798 7.2798 7.2832 7.2832 7.2841 7.2841 7.2852 7.2852 7.9994 7.9994 8.0000 8.0000 8.0019 8.0019 8.0049 8.0049 8.8970 8.8970 8.8981 8.8981 8.9019 8.9019 8.9038 8.9038 10.3132 10.3132 10.3186 10.3186 10.3417 10.3417 10.3420 10.3420 10.6891 10.6891 10.6949 10.6949 10.7049 10.7049 10.7184 10.7184 10.9974 10.9974 11.0250 11.0250 11.0308 11.0308 11.0424 11.0424 12.9239 12.9239 12.9363 12.9363 12.9418 12.9418 12.9548 12.9548 13.2795 13.2795 13.2826 13.2826 13.2955 13.2955 13.3034 13.3034 k = 0.5000 0.5000 0.1552 ( 5660 PWs) bands (ev): -4.0275 -4.0275 -4.0270 -4.0270 -4.0269 -4.0269 -4.0268 -4.0268 -1.0333 -1.0333 -1.0333 -1.0333 -1.0323 -1.0323 -1.0317 -1.0317 4.2184 4.2184 4.2207 4.2207 4.2222 4.2222 4.2245 4.2245 5.9620 5.9620 5.9665 5.9665 5.9671 5.9671 5.9723 5.9723 7.2576 7.2576 7.2606 7.2606 7.2612 7.2612 7.2636 7.2636 8.0327 8.0327 8.0333 8.0333 8.0358 8.0358 8.0397 8.0397 8.8980 8.8980 8.8993 8.8993 8.9034 8.9034 8.9055 8.9055 10.3091 10.3091 10.3146 10.3146 10.3369 10.3369 10.3383 10.3383 10.6681 10.6681 10.6731 10.6731 10.6841 10.6841 10.6974 10.6974 10.9877 10.9877 11.0175 11.0175 11.0223 11.0223 11.0341 11.0341 12.9106 12.9106 12.9232 12.9232 12.9274 12.9274 12.9422 12.9422 13.3141 13.3141 13.3172 13.3172 13.3295 13.3295 13.3373 13.3373 k = 0.5000 0.5000 0.1724 ( 5660 PWs) bands (ev): -4.0187 -4.0187 -4.0181 -4.0181 -4.0180 -4.0180 -4.0180 -4.0180 -1.0575 -1.0575 -1.0574 -1.0574 -1.0565 -1.0565 -1.0559 -1.0559 4.2489 4.2489 4.2515 4.2515 4.2528 4.2528 4.2553 4.2553 5.9594 5.9594 5.9645 5.9645 5.9648 5.9648 5.9703 5.9703 7.2329 7.2329 7.2355 7.2355 7.2360 7.2360 7.2396 7.2396 8.0698 8.0698 8.0704 8.0704 8.0734 8.0734 8.0783 8.0783 8.9002 8.9002 8.9017 8.9017 8.9060 8.9060 8.9082 8.9082 10.3038 10.3038 10.3094 10.3094 10.3307 10.3307 10.3334 10.3334 10.6457 10.6457 10.6499 10.6499 10.6615 10.6615 10.6746 10.6746 10.9771 10.9771 11.0088 11.0088 11.0130 11.0130 11.0249 11.0249 12.8968 12.8968 12.9094 12.9094 12.9123 12.9123 12.9289 12.9289 13.3492 13.3492 13.3525 13.3525 13.3641 13.3641 13.3718 13.3718 k = 0.5000 0.5000 0.1897 ( 5660 PWs) bands (ev): -4.0093 -4.0093 -4.0087 -4.0087 -4.0086 -4.0086 -4.0085 -4.0085 -1.0830 -1.0830 -1.0830 -1.0830 -1.0822 -1.0822 -1.0815 -1.0815 4.2814 4.2814 4.2844 4.2844 4.2855 4.2855 4.2881 4.2881 5.9566 5.9566 5.9622 5.9622 5.9623 5.9623 5.9680 5.9680 7.2060 7.2060 7.2083 7.2083 7.2085 7.2085 7.2132 7.2132 8.1106 8.1106 8.1110 8.1110 8.1145 8.1145 8.1207 8.1207 8.9038 8.9038 8.9054 8.9054 8.9100 8.9100 8.9122 8.9122 10.2970 10.2970 10.3025 10.3025 10.3226 10.3226 10.3270 10.3270 10.6221 10.6221 10.6254 10.6254 10.6373 10.6373 10.6500 10.6500 10.9657 10.9657 10.9992 10.9992 11.0028 11.0028 11.0146 11.0146 12.8824 12.8824 12.8947 12.8947 12.8965 12.8965 12.9149 12.9149 13.3842 13.3842 13.3881 13.3881 13.3989 13.3989 13.4062 13.4062 k = 0.5000 0.5000 0.2069 ( 5660 PWs) bands (ev): -3.9993 -3.9993 -3.9986 -3.9986 -3.9985 -3.9985 -3.9985 -3.9985 -1.1097 -1.1097 -1.1097 -1.1097 -1.1089 -1.1089 -1.1082 -1.1082 4.3156 4.3156 4.3190 4.3190 4.3199 4.3199 4.3225 4.3225 5.9535 5.9535 5.9595 5.9595 5.9599 5.9599 5.9654 5.9654 7.1770 7.1770 7.1790 7.1790 7.1790 7.1790 7.1847 7.1847 8.1547 8.1547 8.1550 8.1550 8.1589 8.1589 8.1665 8.1665 8.9089 8.9089 8.9107 8.9107 8.9155 8.9155 8.9176 8.9176 10.2887 10.2887 10.2940 10.2940 10.3127 10.3127 10.3190 10.3190 10.5975 10.5975 10.5997 10.5997 10.6118 10.6118 10.6238 10.6238 10.9536 10.9536 10.9887 10.9887 10.9919 10.9919 11.0035 11.0035 12.8671 12.8671 12.8790 12.8790 12.8798 12.8798 12.9001 12.9001 13.4185 13.4185 13.4232 13.4232 13.4332 13.4332 13.4400 13.4400 k = 0.5000 0.5000 0.2241 ( 5668 PWs) bands (ev): -3.9889 -3.9889 -3.9882 -3.9882 -3.9881 -3.9881 -3.9881 -3.9881 -1.1371 -1.1371 -1.1371 -1.1371 -1.1364 -1.1364 -1.1356 -1.1356 4.3511 4.3511 4.3549 4.3549 4.3556 4.3556 4.3584 4.3584 5.9502 5.9502 5.9566 5.9566 5.9573 5.9573 5.9626 5.9626 7.1463 7.1463 7.1478 7.1478 7.1481 7.1481 7.1545 7.1545 8.2019 8.2019 8.2021 8.2021 8.2064 8.2064 8.2155 8.2155 8.9156 8.9156 8.9176 8.9176 8.9226 8.9226 8.9243 8.9243 10.2787 10.2787 10.2836 10.2836 10.3006 10.3006 10.3092 10.3092 10.5720 10.5720 10.5729 10.5729 10.5850 10.5850 10.5962 10.5962 10.9408 10.9408 10.9774 10.9774 10.9803 10.9803 10.9915 10.9915 12.8509 12.8509 12.8623 12.8623 12.8623 12.8623 12.8844 12.8844 13.4513 13.4513 13.4572 13.4572 13.4663 13.4663 13.4726 13.4726 k = 0.5000 0.5000 0.2414 ( 5668 PWs) bands (ev): -3.9781 -3.9781 -3.9774 -3.9774 -3.9773 -3.9773 -3.9773 -3.9773 -1.1649 -1.1649 -1.1649 -1.1649 -1.1643 -1.1643 -1.1635 -1.1635 4.3876 4.3876 4.3919 4.3919 4.3925 4.3925 4.3952 4.3952 5.9467 5.9467 5.9535 5.9535 5.9544 5.9544 5.9595 5.9595 7.1142 7.1142 7.1152 7.1152 7.1157 7.1157 7.1228 7.1228 8.2519 8.2519 8.2519 8.2519 8.2566 8.2566 8.2674 8.2674 8.9240 8.9240 8.9262 8.9262 8.9313 8.9313 8.9326 8.9326 10.2669 10.2669 10.2713 10.2713 10.2865 10.2865 10.2975 10.2975 10.5453 10.5453 10.5455 10.5455 10.5572 10.5572 10.5673 10.5673 10.9276 10.9276 10.9655 10.9655 10.9683 10.9683 10.9790 10.9790 12.8339 12.8339 12.8440 12.8440 12.8446 12.8446 12.8678 12.8678 13.4821 13.4821 13.4895 13.4895 13.4977 13.4977 13.5033 13.5033 k = 0.5000 0.5000 0.2586 ( 5676 PWs) bands (ev): -3.9672 -3.9672 -3.9663 -3.9663 -3.9663 -3.9663 -3.9663 -3.9663 -1.1929 -1.1929 -1.1929 -1.1929 -1.1923 -1.1923 -1.1915 -1.1915 4.4248 4.4248 4.4296 4.4296 4.4300 4.4300 4.4327 4.4327 5.9428 5.9428 5.9502 5.9502 5.9514 5.9514 5.9562 5.9562 7.0810 7.0810 7.0817 7.0817 7.0824 7.0824 7.0900 7.0900 8.3041 8.3041 8.3042 8.3042 8.3090 8.3090 8.3218 8.3218 8.9341 8.9341 8.9366 8.9366 8.9417 8.9417 8.9424 8.9424 10.2533 10.2533 10.2570 10.2570 10.2702 10.2702 10.2838 10.2838 10.5168 10.5168 10.5182 10.5182 10.5284 10.5284 10.5371 10.5371 10.9140 10.9140 10.9532 10.9532 10.9559 10.9559 10.9659 10.9659 12.8161 12.8161 12.8249 12.8249 12.8259 12.8259 12.8505 12.8505 13.5103 13.5103 13.5194 13.5194 13.5267 13.5267 13.5315 13.5315 k = 0.5000 0.5000 0.2759 ( 5676 PWs) bands (ev): -3.9561 -3.9561 -3.9552 -3.9552 -3.9552 -3.9552 -3.9552 -3.9552 -1.2207 -1.2207 -1.2207 -1.2207 -1.2202 -1.2202 -1.2193 -1.2193 4.4622 4.4622 4.4676 4.4676 4.4679 4.4679 4.4705 4.4705 5.9388 5.9388 5.9469 5.9469 5.9481 5.9481 5.9527 5.9527 7.0472 7.0472 7.0476 7.0476 7.0485 7.0485 7.0565 7.0565 8.3581 8.3581 8.3584 8.3584 8.3633 8.3633 8.3784 8.3784 8.9461 8.9461 8.9488 8.9488 8.9536 8.9536 8.9539 8.9539 10.2379 10.2379 10.2409 10.2409 10.2520 10.2520 10.2683 10.2683 10.4874 10.4874 10.4899 10.4899 10.4986 10.4986 10.5059 10.5059 10.9003 10.9003 10.9408 10.9408 10.9433 10.9433 10.9526 10.9526 12.7977 12.7977 12.8053 12.8053 12.8066 12.8066 12.8325 12.8325 13.5355 13.5355 13.5466 13.5466 13.5529 13.5529 13.5569 13.5569 k = 0.5000 0.5000 0.2931 ( 5684 PWs) bands (ev): -3.9450 -3.9450 -3.9441 -3.9441 -3.9441 -3.9441 -3.9441 -3.9441 -1.2480 -1.2480 -1.2480 -1.2480 -1.2475 -1.2475 -1.2466 -1.2466 4.4995 4.4995 4.5055 4.5055 4.5057 4.5057 4.5082 4.5082 5.9346 5.9346 5.9434 5.9434 5.9447 5.9447 5.9489 5.9489 7.0132 7.0132 7.0134 7.0134 7.0144 7.0144 7.0228 7.0228 8.4134 8.4134 8.4138 8.4138 8.4188 8.4188 8.4365 8.4365 8.9599 8.9599 8.9629 8.9629 8.9664 8.9664 8.9680 8.9680 10.2208 10.2208 10.2230 10.2230 10.2320 10.2320 10.2509 10.2509 10.4571 10.4571 10.4607 10.4607 10.4678 10.4678 10.4735 10.4735 10.8867 10.8867 10.9284 10.9284 10.9308 10.9308 10.9392 10.9392 12.7789 12.7789 12.7854 12.7854 12.7868 12.7868 12.8140 12.8140 13.5574 13.5574 13.5705 13.5705 13.5760 13.5760 13.5791 13.5791 k = 0.5000 0.5000 0.3103 ( 5684 PWs) bands (ev): -3.9342 -3.9342 -3.9332 -3.9332 -3.9332 -3.9332 -3.9332 -3.9332 -1.2745 -1.2745 -1.2745 -1.2745 -1.2741 -1.2741 -1.2731 -1.2731 4.5363 4.5363 4.5429 4.5429 4.5430 4.5430 4.5453 4.5453 5.9301 5.9301 5.9397 5.9397 5.9411 5.9411 5.9449 5.9449 6.9794 6.9794 6.9795 6.9795 6.9805 6.9805 6.9893 6.9893 8.4693 8.4693 8.4698 8.4698 8.4748 8.4748 8.4955 8.4955 8.9757 8.9757 8.9789 8.9789 8.9807 8.9807 8.9839 8.9839 10.2020 10.2020 10.2034 10.2034 10.2103 10.2103 10.2318 10.2318 10.4262 10.4262 10.4305 10.4305 10.4363 10.4363 10.4404 10.4404 10.8735 10.8735 10.9163 10.9163 10.9185 10.9185 10.9261 10.9261 12.7600 12.7600 12.7654 12.7654 12.7668 12.7668 12.7953 12.7953 13.5759 13.5759 13.5911 13.5911 13.5957 13.5957 13.5981 13.5981 k = 0.5000 0.5000 0.3276 ( 5676 PWs) bands (ev): -3.9236 -3.9236 -3.9226 -3.9226 -3.9226 -3.9226 -3.9226 -3.9226 -1.2998 -1.2998 -1.2998 -1.2998 -1.2995 -1.2995 -1.2985 -1.2985 4.5721 4.5721 4.5794 4.5794 4.5794 4.5794 4.5816 4.5816 5.9255 5.9255 5.9361 5.9361 5.9374 5.9374 5.9408 5.9408 6.9464 6.9464 6.9464 6.9464 6.9474 6.9474 6.9564 6.9564 8.5249 8.5249 8.5256 8.5256 8.5304 8.5304 8.5546 8.5546 8.9936 8.9936 8.9965 8.9965 8.9969 8.9969 9.0017 9.0017 10.1816 10.1816 10.1823 10.1823 10.1873 10.1873 10.2111 10.2111 10.3947 10.3947 10.3996 10.3996 10.4041 10.4041 10.4066 10.4066 10.8610 10.8610 10.9047 10.9047 10.9068 10.9068 10.9133 10.9133 12.7411 12.7411 12.7456 12.7456 12.7469 12.7469 12.7767 12.7767 13.5911 13.5911 13.6083 13.6083 13.6121 13.6121 13.6139 13.6139 k = 0.5000 0.5000 0.3448 ( 5684 PWs) bands (ev): -3.9135 -3.9135 -3.9125 -3.9125 -3.9125 -3.9125 -3.9124 -3.9124 -1.3238 -1.3238 -1.3238 -1.3238 -1.3235 -1.3235 -1.3225 -1.3225 4.6066 4.6066 4.6144 4.6144 4.6145 4.6145 4.6164 4.6164 5.9209 5.9209 5.9324 5.9324 5.9336 5.9336 5.9366 5.9366 6.9145 6.9145 6.9146 6.9146 6.9154 6.9154 6.9247 6.9247 8.5792 8.5792 8.5800 8.5800 8.5845 8.5845 8.6129 8.6129 9.0137 9.0137 9.0139 9.0139 9.0170 9.0170 9.0216 9.0216 10.1598 10.1598 10.1598 10.1598 10.1631 10.1631 10.1889 10.1889 10.3629 10.3629 10.3680 10.3680 10.3716 10.3716 10.3725 10.3725 10.8492 10.8492 10.8938 10.8938 10.8956 10.8956 10.9012 10.9012 12.7227 12.7227 12.7263 12.7263 12.7275 12.7275 12.7585 12.7585 13.6032 13.6032 13.6223 13.6223 13.6254 13.6254 13.6266 13.6266 k = 0.5000 0.5000 0.3621 ( 5684 PWs) bands (ev): -3.9040 -3.9040 -3.9029 -3.9029 -3.9029 -3.9029 -3.9029 -3.9029 -1.3461 -1.3461 -1.3461 -1.3461 -1.3459 -1.3459 -1.3448 -1.3448 4.6391 4.6391 4.6477 4.6477 4.6478 4.6478 4.6494 4.6494 5.9162 5.9162 5.9287 5.9287 5.9298 5.9298 5.9324 5.9324 6.8844 6.8844 6.8845 6.8845 6.8852 6.8852 6.8947 6.8947 8.6311 8.6311 8.6319 8.6319 8.6361 8.6361 8.6691 8.6691 9.0330 9.0330 9.0361 9.0361 9.0393 9.0393 9.0435 9.0435 10.1361 10.1361 10.1367 10.1367 10.1379 10.1379 10.1655 10.1655 10.3313 10.3313 10.3364 10.3364 10.3387 10.3387 10.3394 10.3394 10.8384 10.8384 10.8838 10.8838 10.8854 10.8854 10.8900 10.8900 12.7051 12.7051 12.7080 12.7080 12.7090 12.7090 12.7410 12.7410 13.6127 13.6127 13.6335 13.6335 13.6359 13.6359 13.6366 13.6366 k = 0.5000 0.5000 0.3793 ( 5676 PWs) bands (ev): -3.8952 -3.8952 -3.8941 -3.8941 -3.8941 -3.8941 -3.8941 -3.8941 -1.3664 -1.3664 -1.3664 -1.3664 -1.3663 -1.3663 -1.3652 -1.3652 4.6694 4.6694 4.6787 4.6787 4.6788 4.6788 4.6801 4.6801 5.9116 5.9116 5.9251 5.9251 5.9261 5.9261 5.9282 5.9282 6.8564 6.8564 6.8566 6.8566 6.8572 6.8572 6.8668 6.8668 8.6793 8.6793 8.6801 8.6801 8.6838 8.6838 8.7219 8.7219 9.0539 9.0539 9.0608 9.0608 9.0638 9.0638 9.0676 9.0676 10.1113 10.1113 10.1121 10.1121 10.1124 10.1124 10.1410 10.1410 10.3007 10.3007 10.3054 10.3054 10.3061 10.3061 10.3082 10.3082 10.8287 10.8287 10.8748 10.8748 10.8761 10.8761 10.8797 10.8797 12.6887 12.6887 12.6909 12.6909 12.6917 12.6917 12.7247 12.7247 13.6198 13.6198 13.6421 13.6421 13.6439 13.6439 13.6443 13.6443 k = 0.5000 0.5000 0.3966 ( 5684 PWs) bands (ev): -3.8872 -3.8872 -3.8861 -3.8861 -3.8861 -3.8861 -3.8861 -3.8861 -1.3846 -1.3846 -1.3846 -1.3846 -1.3845 -1.3845 -1.3834 -1.3834 4.6969 4.6969 4.7068 4.7068 4.7069 4.7069 4.7079 4.7079 5.9071 5.9071 5.9217 5.9217 5.9225 5.9225 5.9241 5.9241 6.8311 6.8311 6.8313 6.8313 6.8317 6.8317 6.8415 6.8415 8.7226 8.7226 8.7234 8.7234 8.7265 8.7265 8.7698 8.7698 9.0768 9.0768 9.0877 9.0877 9.0903 9.0903 9.0936 9.0936 10.0858 10.0858 10.0858 10.0858 10.0870 10.0870 10.1155 10.1155 10.2719 10.2719 10.2756 10.2756 10.2760 10.2760 10.2789 10.2789 10.8202 10.8202 10.8669 10.8669 10.8679 10.8679 10.8706 10.8706 12.6737 12.6737 12.6753 12.6753 12.6760 12.6760 12.7098 12.7098 13.6251 13.6251 13.6486 13.6486 13.6499 13.6499 13.6501 13.6501 k = 0.5000 0.5000 0.4138 ( 5668 PWs) bands (ev): -3.8803 -3.8803 -3.8791 -3.8791 -3.8791 -3.8791 -3.8791 -3.8791 -1.4004 -1.4004 -1.4003 -1.4003 -1.4003 -1.4003 -1.3991 -1.3991 4.7212 4.7212 4.7318 4.7318 4.7318 4.7318 4.7326 4.7326 5.9030 5.9030 5.9186 5.9186 5.9192 5.9192 5.9204 5.9204 6.8089 6.8089 6.8091 6.8091 6.8094 6.8094 6.8192 6.8192 8.7601 8.7601 8.7607 8.7607 8.7631 8.7631 8.8113 8.8113 9.1013 9.1013 9.1160 9.1160 9.1181 9.1181 9.1207 9.1207 10.0596 10.0596 10.0600 10.0600 10.0612 10.0612 10.0897 10.0897 10.2460 10.2460 10.2484 10.2484 10.2493 10.2493 10.2529 10.2529 10.8131 10.8131 10.8602 10.8602 10.8610 10.8610 10.8629 10.8629 12.6606 12.6606 12.6617 12.6617 12.6621 12.6621 12.6967 12.6967 13.6289 13.6289 13.6534 13.6534 13.6543 13.6543 13.6544 13.6544 k = 0.5000 0.5000 0.4310 ( 5684 PWs) bands (ev): -3.8744 -3.8744 -3.8733 -3.8733 -3.8733 -3.8733 -3.8732 -3.8732 -1.4135 -1.4135 -1.4135 -1.4135 -1.4135 -1.4135 -1.4123 -1.4123 4.7418 4.7418 4.7529 4.7529 4.7530 4.7530 4.7535 4.7535 5.8993 5.8993 5.9158 5.9158 5.9162 5.9162 5.9170 5.9170 6.7901 6.7901 6.7902 6.7902 6.7905 6.7905 6.8003 6.8003 8.7908 8.7908 8.7913 8.7913 8.7929 8.7929 8.8453 8.8453 9.1264 9.1264 9.1444 9.1444 9.1459 9.1459 9.1478 9.1478 10.0344 10.0344 10.0348 10.0348 10.0358 10.0358 10.0644 10.0644 10.2238 10.2238 10.2252 10.2252 10.2261 10.2261 10.2307 10.2307 10.8072 10.8072 10.8547 10.8547 10.8551 10.8551 10.8564 10.8564 12.6494 12.6494 12.6501 12.6501 12.6504 12.6504 12.6855 12.6855 13.6315 13.6315 13.6568 13.6568 13.6574 13.6574 13.6574 13.6574 k = 0.5000 0.5000 0.4483 ( 5652 PWs) bands (ev): -3.8698 -3.8698 -3.8686 -3.8686 -3.8686 -3.8686 -3.8686 -3.8686 -1.4239 -1.4239 -1.4239 -1.4239 -1.4239 -1.4239 -1.4227 -1.4227 4.7583 4.7583 4.7699 4.7699 4.7700 4.7700 4.7702 4.7702 5.8963 5.8963 5.9135 5.9135 5.9138 5.9138 5.9142 5.9142 6.7752 6.7752 6.7753 6.7753 6.7754 6.7754 6.7853 6.7853 8.8146 8.8146 8.8149 8.8149 8.8159 8.8159 8.8714 8.8714 9.1503 9.1503 9.1707 9.1707 9.1716 9.1716 9.1728 9.1728 10.0116 10.0116 10.0120 10.0120 10.0126 10.0126 10.0413 10.0413 10.2062 10.2062 10.2069 10.2069 10.2076 10.2076 10.2132 10.2132 10.8027 10.8027 10.8505 10.8505 10.8508 10.8508 10.8515 10.8515 12.6405 12.6405 12.6409 12.6409 12.6410 12.6410 12.6766 12.6766 13.6333 13.6333 13.6592 13.6592 13.6596 13.6596 13.6596 13.6596 k = 0.5000 0.5000 0.4655 ( 5644 PWs) bands (ev): -3.8664 -3.8664 -3.8652 -3.8652 -3.8652 -3.8652 -3.8652 -3.8652 -1.4315 -1.4315 -1.4315 -1.4315 -1.4315 -1.4315 -1.4303 -1.4303 4.7704 4.7704 4.7823 4.7823 4.7824 4.7824 4.7825 4.7825 5.8940 5.8940 5.9118 5.9118 5.9119 5.9119 5.9121 5.9121 6.7643 6.7643 6.7644 6.7644 6.7644 6.7644 6.7744 6.7744 8.8315 8.8315 8.8316 8.8316 8.8320 8.8320 8.8897 8.8897 9.1704 9.1704 9.1923 9.1923 9.1927 9.1927 9.1933 9.1933 9.9931 9.9931 9.9933 9.9933 9.9936 9.9936 10.0225 10.0225 10.1934 10.1934 10.1936 10.1936 10.1940 10.1940 10.2006 10.2006 10.7995 10.7995 10.8475 10.8475 10.8476 10.8476 10.8479 10.8479 12.6340 12.6340 12.6342 12.6342 12.6342 12.6342 12.6701 12.6701 13.6344 13.6344 13.6608 13.6608 13.6609 13.6609 13.6609 13.6609 k = 0.5000 0.5000 0.4828 ( 5616 PWs) bands (ev): -3.8643 -3.8643 -3.8631 -3.8631 -3.8631 -3.8631 -3.8631 -3.8631 -1.4360 -1.4360 -1.4360 -1.4360 -1.4360 -1.4360 -1.4348 -1.4348 4.7777 4.7777 4.7899 4.7899 4.7899 4.7899 4.7900 4.7900 5.8925 5.8925 5.9107 5.9107 5.9107 5.9107 5.9108 5.9108 6.7578 6.7578 6.7578 6.7578 6.7578 6.7578 6.7677 6.7677 8.8415 8.8415 8.8415 8.8415 8.8416 8.8416 8.9004 8.9004 9.1840 9.1840 9.2066 9.2066 9.2067 9.2067 9.2069 9.2069 9.9809 9.9809 9.9810 9.9810 9.9810 9.9810 10.0100 10.0100 10.1857 10.1857 10.1857 10.1857 10.1858 10.1858 10.1931 10.1931 10.7976 10.7976 10.8457 10.8457 10.8457 10.8457 10.8458 10.8458 12.6301 12.6301 12.6301 12.6301 12.6302 12.6302 12.6662 12.6662 13.6351 13.6351 13.6617 13.6617 13.6617 13.6617 13.6617 13.6617 k = 0.5000 0.5000 0.5000 ( 5616 PWs) bands (ev): -3.8636 -3.8636 -3.8624 -3.8624 -3.8624 -3.8624 -3.8624 -3.8624 -1.4376 -1.4376 -1.4376 -1.4376 -1.4376 -1.4376 -1.4364 -1.4364 4.7802 4.7802 4.7925 4.7925 4.7925 4.7925 4.7925 4.7925 5.8921 5.8921 5.9103 5.9103 5.9103 5.9103 5.9103 5.9103 6.7555 6.7555 6.7555 6.7555 6.7555 6.7555 6.7655 6.7655 8.8448 8.8448 8.8448 8.8448 8.8448 8.8448 8.9039 8.9039 9.1887 9.1887 9.2116 9.2116 9.2116 9.2116 9.2116 9.2116 9.9766 9.9766 9.9766 9.9766 9.9766 9.9766 10.0057 10.0057 10.1831 10.1831 10.1831 10.1831 10.1831 10.1831 10.1905 10.1905 10.7970 10.7970 10.8451 10.8451 10.8451 10.8451 10.8451 10.8451 12.6288 12.6288 12.6288 12.6288 12.6288 12.6288 12.6649 12.6649 13.6353 13.6353 13.6620 13.6620 13.6620 13.6620 13.6620 13.6620 Writing output data file FeS2.save init_run : 3.74s CPU 14.09s WALL ( 1 calls) electrons : 1892.69s CPU 1906.54s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.52s CPU 1.48s WALL ( 1 calls) Called by electrons: c_bands : 1892.65s CPU 1906.31s WALL ( 1 calls) v_of_rho : 0.29s CPU 0.97s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.28s CPU 0.60s WALL ( 1 calls) newd : 0.96s CPU 1.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.19s WALL ( 228 calls) cegterg : 1809.45s CPU 1820.86s WALL ( 549 calls) Called by sum_band: Called by *egterg: h_psi : 581.82s CPU 590.46s WALL ( 9529 calls) s_psi : 154.84s CPU 155.19s WALL ( 9529 calls) g_psi : 1.34s CPU 1.35s WALL ( 8752 calls) cdiaghg : 836.84s CPU 836.16s WALL ( 8980 calls) cegterg:over : 146.13s CPU 144.74s WALL ( 8752 calls) cegterg:upda : 48.39s CPU 49.83s WALL ( 8752 calls) cegterg:last : 35.39s CPU 35.73s WALL ( 1519 calls) Called by h_psi: h_psi:vloc : 309.77s CPU 314.83s WALL ( 9529 calls) h_psi:vnl : 271.43s CPU 274.37s WALL ( 9529 calls) add_vuspsi : 116.29s CPU 120.12s WALL ( 9529 calls) General routines calbec : 155.08s CPU 154.15s WALL ( 9529 calls) fft : 0.49s CPU 1.48s WALL ( 19 calls) ffts : 0.08s CPU 0.09s WALL ( 4 calls) fftw : 294.91s CPU 297.54s WALL ( 1793764 calls) interpolate : 0.11s CPU 0.13s WALL ( 4 calls) davcio : 0.02s CPU 1.56s WALL ( 456 calls) Parallel routines fft_scatter : 198.02s CPU 195.42s WALL ( 1793787 calls) PWSCF : 32m47.16s CPU 34m45.02s WALL This run was terminated on: 13:39:12 19Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=