Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21: 4:39 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./P2Pt.save/ file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 110 41 12 5272 1210 192 Max 111 42 13 5277 1236 195 Sum 3993 1505 437 189935 44059 6979 bravais-lattice index = 14 lattice parameter (alat) = 10.7631 a.u. unit-cell volume = 1246.8521 (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 = 41.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.763123 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 Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 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 P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Pt 10.00 195.08400 Pt( 1.00) P 5.00 30.97380 P( 1.00) 24 Sym. Ops., with inversion, found (18 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.5000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 120 deg rotation - cart. axis [-1,-1,-1] cryst. s( 5) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 6 120 deg rotation - cart. axis [-1,1,1] cryst. s( 6) = ( 0 0 -1 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) isym = 9 120 deg rotation - cart. axis [1,1,1] cryst. s( 9) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 10 120 deg rotation - cart. axis [-1,1,-1] cryst. s(10) = ( 0 -1 0 ) f =( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) f =( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) f =( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.5000000 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 17 inv. 120 deg rotation - cart. axis [-1,-1,-1] cryst. s(17) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(17) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 18 inv. 120 deg rotation - cart. axis [-1,1,1] cryst. s(18) = ( 0 0 1 ) f =( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) cart. s(18) = ( 0.0000000 1.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) isym = 19 inv. 120 deg rotation - cart. axis [1,1,-1] cryst. s(19) = ( 0 0 1 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) cart. s(19) = ( 0.0000000 -1.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) isym = 20 inv. 120 deg rotation - cart. axis [1,-1,1] cryst. s(20) = ( 0 0 -1 ) f =( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) cart. s(20) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) isym = 21 inv. 120 deg rotation - cart. axis [1,1,1] cryst. s(21) = ( 0 -1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(21) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 22 inv. 120 deg rotation - cart. axis [-1,1,-1] cryst. s(22) = ( 0 1 0 ) f =( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) cart. s(22) = ( 0.0000000 0.0000000 -1.0000000 ) f =( 0.5000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) isym = 23 inv. 120 deg rotation - cart. axis [1,-1,-1] cryst. s(23) = ( 0 1 0 ) f =( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) cart. s(23) = ( 0.0000000 -0.0000000 1.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) isym = 24 inv. 120 deg rotation - cart. axis [-1,-1,1] cryst. s(24) = ( 0 -1 0 ) f =( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) cart. s(24) = ( -0.0000000 0.0000000 1.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) double point group T_h (m-3) there are 14 classes and 6 irreducible representations the character table: E -E 3C2 4C3 -4C3 4C3' -4C3' i -i 3s_h 4S6' -4S6' -3C2 -3s_h G_5+ 2.00 -2.00 0.00 1.00 -1.00 1.00 -1.00 2.00 -2.00 0.00 1.00 -1.00 G_6+ 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 2.00 -2.00 0.00 -0.50 0.50 G_7+ 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 2.00 -2.00 0.00 -0.50 0.50 G_5- 2.00 -2.00 0.00 1.00 -1.00 1.00 -1.00 -2.00 2.00 0.00 -1.00 1.00 G_6- 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 -2.00 2.00 0.00 0.50 -0.50 G_7- 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 -2.00 2.00 0.00 0.50 -0.50 4S6 -4S6 G_5+ 1.00 -1.00 G_6+ -0.50 0.50 G_7+ -0.50 0.50 G_5- -1.00 1.00 G_6- 0.50 -0.50 G_7- 0.50 -0.50 imaginary part E -E 3C2 4C3 -4C3 4C3' -4C3' i -i 3s_h 4S6' -4S6' -3C2 -3s_h G_5+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_6+ 0.00 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 0.00 0.87 -0.87 G_7+ 0.00 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 0.00 -0.87 0.87 G_5- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_6- 0.00 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 0.00 -0.87 0.87 G_7- 0.00 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 0.00 0.87 -0.87 4S6 -4S6 G_5+ 0.00 0.00 G_6+ -0.87 0.87 G_7+ 0.87 -0.87 G_5- 0.00 0.00 G_6- 0.87 -0.87 G_7- -0.87 0.87 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 3C2 -3C2 2 -2 3 -3 4 -4 180 deg rotation - cart. axis [0,0,1] 4C3 9 12 10 11 120 deg rotation - cart. axis [1,1,1] -4C3 -9 -12 -10 -11 120 deg rotation - cart. axis [1,1,1] E 4C3' 5 7 8 6 120 deg rotation - cart. axis [-1,-1,-1] -4C3' -5 -7 -8 -6 120 deg rotation - cart. axis [-1,-1,-1] E i 13 inversion -i -13 inversion E 3s_h-3s_h 14 -14 15 -15 16 -16 inv. 180 deg rotation - cart. axis [0,0,1] 4S6' 21 24 22 23 inv. 120 deg rotation - cart. axis [1,1,1] -4S6' -21 -24 -22 -23 inv. 120 deg rotation - cart. axis [1,1,1] E 4S6 17 19 20 18 inv. 120 deg rotation - cart. axis [-1,-1,-1] -4S6 -17 -19 -20 -18 inv. 120 deg rotation - cart. axis [-1,-1,-1] E Cartesian axes number of k points= 218 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045872 k( 2) = ( 0.0000000 0.0178571 -0.0000000), wk = 0.0045872 k( 3) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0045872 k( 4) = ( 0.0000000 0.0535714 -0.0000000), wk = 0.0045872 k( 5) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0045872 k( 6) = ( 0.0000000 0.0892857 -0.0000000), wk = 0.0045872 k( 7) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0045872 k( 8) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0045872 k( 9) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0045872 k( 10) = ( 0.0000000 0.1607143 -0.0000000), wk = 0.0045872 k( 11) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0045872 k( 12) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0045872 k( 13) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0045872 k( 14) = ( 0.0000000 0.2321429 -0.0000000), wk = 0.0045872 k( 15) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0045872 k( 16) = ( 0.0000000 0.2678571 -0.0000000), wk = 0.0045872 k( 17) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0045872 k( 18) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0045872 k( 19) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0045872 k( 20) = ( 0.0000000 0.3392857 -0.0000000), wk = 0.0045872 k( 21) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0045872 k( 22) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0045872 k( 23) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0045872 k( 24) = ( 0.0000000 0.4107143 -0.0000000), wk = 0.0045872 k( 25) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0045872 k( 26) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0045872 k( 27) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0045872 k( 28) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0045872 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0045872 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0045872 k( 31) = ( 0.0178571 0.5000000 -0.0000000), wk = 0.0045872 k( 32) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0045872 k( 33) = ( 0.0535714 0.5000000 -0.0000000), wk = 0.0045872 k( 34) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0045872 k( 35) = ( 0.0892857 0.5000000 -0.0000000), wk = 0.0045872 k( 36) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0045872 k( 37) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0045872 k( 38) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0045872 k( 39) = ( 0.1607143 0.5000000 -0.0000000), wk = 0.0045872 k( 40) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0045872 k( 41) = ( 0.1964286 0.5000000 -0.0000000), wk = 0.0045872 k( 42) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0045872 k( 43) = ( 0.2321429 0.5000000 -0.0000000), wk = 0.0045872 k( 44) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0045872 k( 45) = ( 0.2678571 0.5000000 -0.0000000), wk = 0.0045872 k( 46) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0045872 k( 47) = ( 0.3035714 0.5000000 -0.0000000), wk = 0.0045872 k( 48) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0045872 k( 49) = ( 0.3392857 0.5000000 -0.0000000), wk = 0.0045872 k( 50) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0045872 k( 51) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0045872 k( 52) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0045872 k( 53) = ( 0.4107143 0.5000000 -0.0000000), wk = 0.0045872 k( 54) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0045872 k( 55) = ( 0.4464286 0.5000000 -0.0000000), wk = 0.0045872 k( 56) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0045872 k( 57) = ( 0.4821429 0.5000000 -0.0000000), wk = 0.0045872 k( 58) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045872 k( 59) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045872 k( 60) = ( 0.4875000 0.4875000 -0.0000000), wk = 0.0045872 k( 61) = ( 0.4750000 0.4750000 -0.0000000), wk = 0.0045872 k( 62) = ( 0.4625000 0.4625000 -0.0000000), wk = 0.0045872 k( 63) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0045872 k( 64) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0045872 k( 65) = ( 0.4250000 0.4250000 -0.0000000), wk = 0.0045872 k( 66) = ( 0.4125000 0.4125000 -0.0000000), wk = 0.0045872 k( 67) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0045872 k( 68) = ( 0.3875000 0.3875000 -0.0000000), wk = 0.0045872 k( 69) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0045872 k( 70) = ( 0.3625000 0.3625000 -0.0000000), wk = 0.0045872 k( 71) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0045872 k( 72) = ( 0.3375000 0.3375000 -0.0000000), wk = 0.0045872 k( 73) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0045872 k( 74) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0045872 k( 75) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0045872 k( 76) = ( 0.2875000 0.2875000 -0.0000000), wk = 0.0045872 k( 77) = ( 0.2750000 0.2750000 -0.0000000), wk = 0.0045872 k( 78) = ( 0.2625000 0.2625000 -0.0000000), wk = 0.0045872 k( 79) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0045872 k( 80) = ( 0.2375000 0.2375000 -0.0000000), wk = 0.0045872 k( 81) = ( 0.2250000 0.2250000 -0.0000000), wk = 0.0045872 k( 82) = ( 0.2125000 0.2125000 -0.0000000), wk = 0.0045872 k( 83) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0045872 k( 84) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0045872 k( 85) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0045872 k( 86) = ( 0.1625000 0.1625000 -0.0000000), wk = 0.0045872 k( 87) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0045872 k( 88) = ( 0.1375000 0.1375000 -0.0000000), wk = 0.0045872 k( 89) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0045872 k( 90) = ( 0.1125000 0.1125000 -0.0000000), wk = 0.0045872 k( 91) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0045872 k( 92) = ( 0.0875000 0.0875000 -0.0000000), wk = 0.0045872 k( 93) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0045872 k( 94) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0045872 k( 95) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0045872 k( 96) = ( 0.0375000 0.0375000 -0.0000000), wk = 0.0045872 k( 97) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0045872 k( 98) = ( 0.0125000 0.0125000 -0.0000000), wk = 0.0045872 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045872 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045872 k( 101) = ( 0.0104167 0.0104167 0.0104167), wk = 0.0045872 k( 102) = ( 0.0208333 0.0208333 0.0208333), wk = 0.0045872 k( 103) = ( 0.0312500 0.0312500 0.0312500), wk = 0.0045872 k( 104) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0045872 k( 105) = ( 0.0520833 0.0520833 0.0520833), wk = 0.0045872 k( 106) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0045872 k( 107) = ( 0.0729167 0.0729167 0.0729167), wk = 0.0045872 k( 108) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0045872 k( 109) = ( 0.0937500 0.0937500 0.0937500), wk = 0.0045872 k( 110) = ( 0.1041667 0.1041667 0.1041667), wk = 0.0045872 k( 111) = ( 0.1145833 0.1145833 0.1145833), wk = 0.0045872 k( 112) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0045872 k( 113) = ( 0.1354167 0.1354167 0.1354167), wk = 0.0045872 k( 114) = ( 0.1458333 0.1458333 0.1458333), wk = 0.0045872 k( 115) = ( 0.1562500 0.1562500 0.1562500), wk = 0.0045872 k( 116) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0045872 k( 117) = ( 0.1770833 0.1770833 0.1770833), wk = 0.0045872 k( 118) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0045872 k( 119) = ( 0.1979167 0.1979167 0.1979167), wk = 0.0045872 k( 120) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0045872 k( 121) = ( 0.2187500 0.2187500 0.2187500), wk = 0.0045872 k( 122) = ( 0.2291667 0.2291667 0.2291667), wk = 0.0045872 k( 123) = ( 0.2395833 0.2395833 0.2395833), wk = 0.0045872 k( 124) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0045872 k( 125) = ( 0.2604167 0.2604167 0.2604167), wk = 0.0045872 k( 126) = ( 0.2708333 0.2708333 0.2708333), wk = 0.0045872 k( 127) = ( 0.2812500 0.2812500 0.2812500), wk = 0.0045872 k( 128) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0045872 k( 129) = ( 0.3020833 0.3020833 0.3020833), wk = 0.0045872 k( 130) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0045872 k( 131) = ( 0.3229167 0.3229167 0.3229167), wk = 0.0045872 k( 132) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0045872 k( 133) = ( 0.3437500 0.3437500 0.3437500), wk = 0.0045872 k( 134) = ( 0.3541667 0.3541667 0.3541667), wk = 0.0045872 k( 135) = ( 0.3645833 0.3645833 0.3645833), wk = 0.0045872 k( 136) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0045872 k( 137) = ( 0.3854167 0.3854167 0.3854167), wk = 0.0045872 k( 138) = ( 0.3958333 0.3958333 0.3958333), wk = 0.0045872 k( 139) = ( 0.4062500 0.4062500 0.4062500), wk = 0.0045872 k( 140) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0045872 k( 141) = ( 0.4270833 0.4270833 0.4270833), wk = 0.0045872 k( 142) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0045872 k( 143) = ( 0.4479167 0.4479167 0.4479167), wk = 0.0045872 k( 144) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0045872 k( 145) = ( 0.4687500 0.4687500 0.4687500), wk = 0.0045872 k( 146) = ( 0.4791667 0.4791667 0.4791667), wk = 0.0045872 k( 147) = ( 0.4895833 0.4895833 0.4895833), wk = 0.0045872 k( 148) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045872 k( 149) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045872 k( 150) = ( 0.4875000 0.5000000 0.4875000), wk = 0.0045872 k( 151) = ( 0.4750000 0.5000000 0.4750000), wk = 0.0045872 k( 152) = ( 0.4625000 0.5000000 0.4625000), wk = 0.0045872 k( 153) = ( 0.4500000 0.5000000 0.4500000), wk = 0.0045872 k( 154) = ( 0.4375000 0.5000000 0.4375000), wk = 0.0045872 k( 155) = ( 0.4250000 0.5000000 0.4250000), wk = 0.0045872 k( 156) = ( 0.4125000 0.5000000 0.4125000), wk = 0.0045872 k( 157) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0045872 k( 158) = ( 0.3875000 0.5000000 0.3875000), wk = 0.0045872 k( 159) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0045872 k( 160) = ( 0.3625000 0.5000000 0.3625000), wk = 0.0045872 k( 161) = ( 0.3500000 0.5000000 0.3500000), wk = 0.0045872 k( 162) = ( 0.3375000 0.5000000 0.3375000), wk = 0.0045872 k( 163) = ( 0.3250000 0.5000000 0.3250000), wk = 0.0045872 k( 164) = ( 0.3125000 0.5000000 0.3125000), wk = 0.0045872 k( 165) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0045872 k( 166) = ( 0.2875000 0.5000000 0.2875000), wk = 0.0045872 k( 167) = ( 0.2750000 0.5000000 0.2750000), wk = 0.0045872 k( 168) = ( 0.2625000 0.5000000 0.2625000), wk = 0.0045872 k( 169) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0045872 k( 170) = ( 0.2375000 0.5000000 0.2375000), wk = 0.0045872 k( 171) = ( 0.2250000 0.5000000 0.2250000), wk = 0.0045872 k( 172) = ( 0.2125000 0.5000000 0.2125000), wk = 0.0045872 k( 173) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0045872 k( 174) = ( 0.1875000 0.5000000 0.1875000), wk = 0.0045872 k( 175) = ( 0.1750000 0.5000000 0.1750000), wk = 0.0045872 k( 176) = ( 0.1625000 0.5000000 0.1625000), wk = 0.0045872 k( 177) = ( 0.1500000 0.5000000 0.1500000), wk = 0.0045872 k( 178) = ( 0.1375000 0.5000000 0.1375000), wk = 0.0045872 k( 179) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0045872 k( 180) = ( 0.1125000 0.5000000 0.1125000), wk = 0.0045872 k( 181) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0045872 k( 182) = ( 0.0875000 0.5000000 0.0875000), wk = 0.0045872 k( 183) = ( 0.0750000 0.5000000 0.0750000), wk = 0.0045872 k( 184) = ( 0.0625000 0.5000000 0.0625000), wk = 0.0045872 k( 185) = ( 0.0500000 0.5000000 0.0500000), wk = 0.0045872 k( 186) = ( 0.0375000 0.5000000 0.0375000), wk = 0.0045872 k( 187) = ( 0.0250000 0.5000000 0.0250000), wk = 0.0045872 k( 188) = ( 0.0125000 0.5000000 0.0125000), wk = 0.0045872 k( 189) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0045872 k( 190) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045872 k( 191) = ( 0.5000000 0.5000000 0.0178571), wk = 0.0045872 k( 192) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0045872 k( 193) = ( 0.5000000 0.5000000 0.0535714), wk = 0.0045872 k( 194) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0045872 k( 195) = ( 0.5000000 0.5000000 0.0892857), wk = 0.0045872 k( 196) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0045872 k( 197) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0045872 k( 198) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0045872 k( 199) = ( 0.5000000 0.5000000 0.1607143), wk = 0.0045872 k( 200) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0045872 k( 201) = ( 0.5000000 0.5000000 0.1964286), wk = 0.0045872 k( 202) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0045872 k( 203) = ( 0.5000000 0.5000000 0.2321429), wk = 0.0045872 k( 204) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0045872 k( 205) = ( 0.5000000 0.5000000 0.2678571), wk = 0.0045872 k( 206) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0045872 k( 207) = ( 0.5000000 0.5000000 0.3035714), wk = 0.0045872 k( 208) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0045872 k( 209) = ( 0.5000000 0.5000000 0.3392857), wk = 0.0045872 k( 210) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0045872 k( 211) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0045872 k( 212) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0045872 k( 213) = ( 0.5000000 0.5000000 0.4107143), wk = 0.0045872 k( 214) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0045872 k( 215) = ( 0.5000000 0.5000000 0.4464286), wk = 0.0045872 k( 216) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0045872 k( 217) = ( 0.5000000 0.5000000 0.4821429), wk = 0.0045872 k( 218) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045872 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045872 k( 2) = ( 0.0000000 0.0178571 0.0000000), wk = 0.0045872 k( 3) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0045872 k( 4) = ( 0.0000000 0.0535714 0.0000000), wk = 0.0045872 k( 5) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0045872 k( 6) = ( 0.0000000 0.0892857 0.0000000), wk = 0.0045872 k( 7) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0045872 k( 8) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0045872 k( 9) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0045872 k( 10) = ( 0.0000000 0.1607143 0.0000000), wk = 0.0045872 k( 11) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0045872 k( 12) = ( 0.0000000 0.1964286 0.0000000), wk = 0.0045872 k( 13) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0045872 k( 14) = ( 0.0000000 0.2321429 0.0000000), wk = 0.0045872 k( 15) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0045872 k( 16) = ( 0.0000000 0.2678571 0.0000000), wk = 0.0045872 k( 17) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0045872 k( 18) = ( 0.0000000 0.3035714 0.0000000), wk = 0.0045872 k( 19) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0045872 k( 20) = ( 0.0000000 0.3392857 0.0000000), wk = 0.0045872 k( 21) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0045872 k( 22) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0045872 k( 23) = ( 0.0000000 0.3928571 0.0000000), wk = 0.0045872 k( 24) = ( 0.0000000 0.4107143 0.0000000), wk = 0.0045872 k( 25) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0045872 k( 26) = ( 0.0000000 0.4464286 0.0000000), wk = 0.0045872 k( 27) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0045872 k( 28) = ( 0.0000000 0.4821429 0.0000000), wk = 0.0045872 k( 29) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0045872 k( 30) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0045872 k( 31) = ( 0.0178571 0.5000000 0.0000000), wk = 0.0045872 k( 32) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0045872 k( 33) = ( 0.0535714 0.5000000 0.0000000), wk = 0.0045872 k( 34) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0045872 k( 35) = ( 0.0892857 0.5000000 0.0000000), wk = 0.0045872 k( 36) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0045872 k( 37) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0045872 k( 38) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0045872 k( 39) = ( 0.1607143 0.5000000 0.0000000), wk = 0.0045872 k( 40) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0045872 k( 41) = ( 0.1964286 0.5000000 0.0000000), wk = 0.0045872 k( 42) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0045872 k( 43) = ( 0.2321429 0.5000000 0.0000000), wk = 0.0045872 k( 44) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0045872 k( 45) = ( 0.2678571 0.5000000 0.0000000), wk = 0.0045872 k( 46) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0045872 k( 47) = ( 0.3035714 0.5000000 0.0000000), wk = 0.0045872 k( 48) = ( 0.3214286 0.5000000 0.0000000), wk = 0.0045872 k( 49) = ( 0.3392857 0.5000000 0.0000000), wk = 0.0045872 k( 50) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0045872 k( 51) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0045872 k( 52) = ( 0.3928571 0.5000000 0.0000000), wk = 0.0045872 k( 53) = ( 0.4107143 0.5000000 0.0000000), wk = 0.0045872 k( 54) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0045872 k( 55) = ( 0.4464286 0.5000000 -0.0000000), wk = 0.0045872 k( 56) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0045872 k( 57) = ( 0.4821429 0.5000000 0.0000000), wk = 0.0045872 k( 58) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045872 k( 59) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045872 k( 60) = ( 0.4875000 0.4875000 0.0000000), wk = 0.0045872 k( 61) = ( 0.4750000 0.4750000 0.0000000), wk = 0.0045872 k( 62) = ( 0.4625000 0.4625000 0.0000000), wk = 0.0045872 k( 63) = ( 0.4500000 0.4500000 0.0000000), wk = 0.0045872 k( 64) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0045872 k( 65) = ( 0.4250000 0.4250000 0.0000000), wk = 0.0045872 k( 66) = ( 0.4125000 0.4125000 -0.0000000), wk = 0.0045872 k( 67) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0045872 k( 68) = ( 0.3875000 0.3875000 0.0000000), wk = 0.0045872 k( 69) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0045872 k( 70) = ( 0.3625000 0.3625000 0.0000000), wk = 0.0045872 k( 71) = ( 0.3500000 0.3500000 0.0000000), wk = 0.0045872 k( 72) = ( 0.3375000 0.3375000 0.0000000), wk = 0.0045872 k( 73) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0045872 k( 74) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0045872 k( 75) = ( 0.3000000 0.3000000 0.0000000), wk = 0.0045872 k( 76) = ( 0.2875000 0.2875000 0.0000000), wk = 0.0045872 k( 77) = ( 0.2750000 0.2750000 0.0000000), wk = 0.0045872 k( 78) = ( 0.2625000 0.2625000 0.0000000), wk = 0.0045872 k( 79) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0045872 k( 80) = ( 0.2375000 0.2375000 0.0000000), wk = 0.0045872 k( 81) = ( 0.2250000 0.2250000 0.0000000), wk = 0.0045872 k( 82) = ( 0.2125000 0.2125000 0.0000000), wk = 0.0045872 k( 83) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0045872 k( 84) = ( 0.1875000 0.1875000 0.0000000), wk = 0.0045872 k( 85) = ( 0.1750000 0.1750000 0.0000000), wk = 0.0045872 k( 86) = ( 0.1625000 0.1625000 -0.0000000), wk = 0.0045872 k( 87) = ( 0.1500000 0.1500000 0.0000000), wk = 0.0045872 k( 88) = ( 0.1375000 0.1375000 0.0000000), wk = 0.0045872 k( 89) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0045872 k( 90) = ( 0.1125000 0.1125000 0.0000000), wk = 0.0045872 k( 91) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0045872 k( 92) = ( 0.0875000 0.0875000 0.0000000), wk = 0.0045872 k( 93) = ( 0.0750000 0.0750000 0.0000000), wk = 0.0045872 k( 94) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0045872 k( 95) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0045872 k( 96) = ( 0.0375000 0.0375000 0.0000000), wk = 0.0045872 k( 97) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0045872 k( 98) = ( 0.0125000 0.0125000 -0.0000000), wk = 0.0045872 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045872 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045872 k( 101) = ( 0.0104167 0.0104167 0.0104167), wk = 0.0045872 k( 102) = ( 0.0208333 0.0208333 0.0208333), wk = 0.0045872 k( 103) = ( 0.0312500 0.0312500 0.0312500), wk = 0.0045872 k( 104) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0045872 k( 105) = ( 0.0520833 0.0520833 0.0520833), wk = 0.0045872 k( 106) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0045872 k( 107) = ( 0.0729167 0.0729167 0.0729167), wk = 0.0045872 k( 108) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0045872 k( 109) = ( 0.0937500 0.0937500 0.0937500), wk = 0.0045872 k( 110) = ( 0.1041667 0.1041667 0.1041667), wk = 0.0045872 k( 111) = ( 0.1145833 0.1145833 0.1145833), wk = 0.0045872 k( 112) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0045872 k( 113) = ( 0.1354167 0.1354167 0.1354167), wk = 0.0045872 k( 114) = ( 0.1458333 0.1458333 0.1458333), wk = 0.0045872 k( 115) = ( 0.1562500 0.1562500 0.1562500), wk = 0.0045872 k( 116) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0045872 k( 117) = ( 0.1770833 0.1770833 0.1770833), wk = 0.0045872 k( 118) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0045872 k( 119) = ( 0.1979167 0.1979167 0.1979167), wk = 0.0045872 k( 120) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0045872 k( 121) = ( 0.2187500 0.2187500 0.2187500), wk = 0.0045872 k( 122) = ( 0.2291667 0.2291667 0.2291667), wk = 0.0045872 k( 123) = ( 0.2395833 0.2395833 0.2395833), wk = 0.0045872 k( 124) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0045872 k( 125) = ( 0.2604167 0.2604167 0.2604167), wk = 0.0045872 k( 126) = ( 0.2708333 0.2708333 0.2708333), wk = 0.0045872 k( 127) = ( 0.2812500 0.2812500 0.2812500), wk = 0.0045872 k( 128) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0045872 k( 129) = ( 0.3020833 0.3020833 0.3020833), wk = 0.0045872 k( 130) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0045872 k( 131) = ( 0.3229167 0.3229167 0.3229167), wk = 0.0045872 k( 132) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0045872 k( 133) = ( 0.3437500 0.3437500 0.3437500), wk = 0.0045872 k( 134) = ( 0.3541667 0.3541667 0.3541667), wk = 0.0045872 k( 135) = ( 0.3645833 0.3645833 0.3645833), wk = 0.0045872 k( 136) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0045872 k( 137) = ( 0.3854167 0.3854167 0.3854167), wk = 0.0045872 k( 138) = ( 0.3958333 0.3958333 0.3958333), wk = 0.0045872 k( 139) = ( 0.4062500 0.4062500 0.4062500), wk = 0.0045872 k( 140) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0045872 k( 141) = ( 0.4270833 0.4270833 0.4270833), wk = 0.0045872 k( 142) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0045872 k( 143) = ( 0.4479167 0.4479167 0.4479167), wk = 0.0045872 k( 144) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0045872 k( 145) = ( 0.4687500 0.4687500 0.4687500), wk = 0.0045872 k( 146) = ( 0.4791667 0.4791667 0.4791667), wk = 0.0045872 k( 147) = ( 0.4895833 0.4895833 0.4895833), wk = 0.0045872 k( 148) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045872 k( 149) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045872 k( 150) = ( 0.4875000 0.5000000 0.4875000), wk = 0.0045872 k( 151) = ( 0.4750000 0.5000000 0.4750000), wk = 0.0045872 k( 152) = ( 0.4625000 0.5000000 0.4625000), wk = 0.0045872 k( 153) = ( 0.4500000 0.5000000 0.4500000), wk = 0.0045872 k( 154) = ( 0.4375000 0.5000000 0.4375000), wk = 0.0045872 k( 155) = ( 0.4250000 0.5000000 0.4250000), wk = 0.0045872 k( 156) = ( 0.4125000 0.5000000 0.4125000), wk = 0.0045872 k( 157) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0045872 k( 158) = ( 0.3875000 0.5000000 0.3875000), wk = 0.0045872 k( 159) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0045872 k( 160) = ( 0.3625000 0.5000000 0.3625000), wk = 0.0045872 k( 161) = ( 0.3500000 0.5000000 0.3500000), wk = 0.0045872 k( 162) = ( 0.3375000 0.5000000 0.3375000), wk = 0.0045872 k( 163) = ( 0.3250000 0.5000000 0.3250000), wk = 0.0045872 k( 164) = ( 0.3125000 0.5000000 0.3125000), wk = 0.0045872 k( 165) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0045872 k( 166) = ( 0.2875000 0.5000000 0.2875000), wk = 0.0045872 k( 167) = ( 0.2750000 0.5000000 0.2750000), wk = 0.0045872 k( 168) = ( 0.2625000 0.5000000 0.2625000), wk = 0.0045872 k( 169) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0045872 k( 170) = ( 0.2375000 0.5000000 0.2375000), wk = 0.0045872 k( 171) = ( 0.2250000 0.5000000 0.2250000), wk = 0.0045872 k( 172) = ( 0.2125000 0.5000000 0.2125000), wk = 0.0045872 k( 173) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0045872 k( 174) = ( 0.1875000 0.5000000 0.1875000), wk = 0.0045872 k( 175) = ( 0.1750000 0.5000000 0.1750000), wk = 0.0045872 k( 176) = ( 0.1625000 0.5000000 0.1625000), wk = 0.0045872 k( 177) = ( 0.1500000 0.5000000 0.1500000), wk = 0.0045872 k( 178) = ( 0.1375000 0.5000000 0.1375000), wk = 0.0045872 k( 179) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0045872 k( 180) = ( 0.1125000 0.5000000 0.1125000), wk = 0.0045872 k( 181) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0045872 k( 182) = ( 0.0875000 0.5000000 0.0875000), wk = 0.0045872 k( 183) = ( 0.0750000 0.5000000 0.0750000), wk = 0.0045872 k( 184) = ( 0.0625000 0.5000000 0.0625000), wk = 0.0045872 k( 185) = ( 0.0500000 0.5000000 0.0500000), wk = 0.0045872 k( 186) = ( 0.0375000 0.5000000 0.0375000), wk = 0.0045872 k( 187) = ( 0.0250000 0.5000000 0.0250000), wk = 0.0045872 k( 188) = ( 0.0125000 0.5000000 0.0125000), wk = 0.0045872 k( 189) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0045872 k( 190) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045872 k( 191) = ( 0.5000000 0.5000000 0.0178571), wk = 0.0045872 k( 192) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0045872 k( 193) = ( 0.5000000 0.5000000 0.0535714), wk = 0.0045872 k( 194) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0045872 k( 195) = ( 0.5000000 0.5000000 0.0892857), wk = 0.0045872 k( 196) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0045872 k( 197) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0045872 k( 198) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0045872 k( 199) = ( 0.5000000 0.5000000 0.1607143), wk = 0.0045872 k( 200) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0045872 k( 201) = ( 0.5000000 0.5000000 0.1964286), wk = 0.0045872 k( 202) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0045872 k( 203) = ( 0.5000000 0.5000000 0.2321429), wk = 0.0045872 k( 204) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0045872 k( 205) = ( 0.5000000 0.5000000 0.2678571), wk = 0.0045872 k( 206) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0045872 k( 207) = ( 0.5000000 0.5000000 0.3035714), wk = 0.0045872 k( 208) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0045872 k( 209) = ( 0.5000000 0.5000000 0.3392857), wk = 0.0045872 k( 210) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0045872 k( 211) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0045872 k( 212) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0045872 k( 213) = ( 0.5000000 0.5000000 0.4107143), wk = 0.0045872 k( 214) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0045872 k( 215) = ( 0.5000000 0.5000000 0.4464286), wk = 0.0045872 k( 216) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0045872 k( 217) = ( 0.5000000 0.5000000 0.4821429), wk = 0.0045872 k( 218) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045872 Dense grid: 189935 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 44059 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.49 Mb ( 332, 96) NL pseudopotentials 1.03 Mb ( 166, 408) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.04 Mb ( 5275) G-vector shells 0.01 Mb ( 901) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.95 Mb ( 332, 384) Each subspace H/S matrix 0.14 Mb ( 96, 96) Each matrix 1.20 Mb ( 408, 2, 96) The potential is recalculated from file : ./P2Pt.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 8.1 secs Computing kpt #: 2 total cpu time spent up to now is 11.6 secs Computing kpt #: 3 total cpu time spent up to now is 15.0 secs Computing kpt #: 4 total cpu time spent up to now is 18.6 secs Computing kpt #: 5 total cpu time spent up to now is 21.8 secs Computing kpt #: 6 total cpu time spent up to now is 24.0 secs Computing kpt #: 7 total cpu time spent up to now is 26.2 secs Computing kpt #: 8 total cpu time spent up to now is 28.3 secs Computing kpt #: 9 total cpu time spent up to now is 30.3 secs Computing kpt #: 10 total cpu time spent up to now is 32.2 secs Computing kpt #: 11 total cpu time spent up to now is 34.2 secs Computing kpt #: 12 total cpu time spent up to now is 36.3 secs Computing kpt #: 13 total cpu time spent up to now is 38.3 secs Computing kpt #: 14 total cpu time spent up to now is 40.4 secs Computing kpt #: 15 total cpu time spent up to now is 42.5 secs Computing kpt #: 16 total cpu time spent up to now is 44.6 secs Computing kpt #: 17 total cpu time spent up to now is 46.7 secs Computing kpt #: 18 total cpu time spent up to now is 48.8 secs Computing kpt #: 19 total cpu time spent up to now is 50.9 secs Computing kpt #: 20 total cpu time spent up to now is 52.9 secs Computing kpt #: 21 total cpu time spent up to now is 55.1 secs Computing kpt #: 22 total cpu time spent up to now is 57.2 secs Computing kpt #: 23 total cpu time spent up to now is 59.4 secs Computing kpt #: 24 total cpu time spent up to now is 61.5 secs Computing kpt #: 25 total cpu time spent up to now is 63.6 secs Computing kpt #: 26 total cpu time spent up to now is 65.8 secs Computing kpt #: 27 total cpu time spent up to now is 68.0 secs Computing kpt #: 28 total cpu time spent up to now is 70.1 secs Computing kpt #: 29 total cpu time spent up to now is 72.3 secs Computing kpt #: 30 total cpu time spent up to now is 74.5 secs Computing kpt #: 31 total cpu time spent up to now is 76.6 secs Computing kpt #: 32 total cpu time spent up to now is 78.8 secs Computing kpt #: 33 total cpu time spent up to now is 80.9 secs Computing kpt #: 34 total cpu time spent up to now is 83.0 secs Computing kpt #: 35 total cpu time spent up to now is 85.1 secs Computing kpt #: 36 total cpu time spent up to now is 87.1 secs Computing kpt #: 37 total cpu time spent up to now is 89.7 secs Computing kpt #: 38 total cpu time spent up to now is 91.7 secs Computing kpt #: 39 total cpu time spent up to now is 93.7 secs Computing kpt #: 40 total cpu time spent up to now is 95.7 secs Computing kpt #: 41 total cpu time spent up to now is 97.7 secs Computing kpt #: 42 total cpu time spent up to now is 99.7 secs Computing kpt #: 43 total cpu time spent up to now is 101.5 secs Computing kpt #: 44 total cpu time spent up to now is 103.4 secs Computing kpt #: 45 total cpu time spent up to now is 105.2 secs Computing kpt #: 46 total cpu time spent up to now is 107.0 secs Computing kpt #: 47 total cpu time spent up to now is 108.8 secs Computing kpt #: 48 total cpu time spent up to now is 110.7 secs Computing kpt #: 49 total cpu time spent up to now is 112.5 secs Computing kpt #: 50 total cpu time spent up to now is 114.3 secs Computing kpt #: 51 total cpu time spent up to now is 116.1 secs Computing kpt #: 52 total cpu time spent up to now is 117.9 secs Computing kpt #: 53 total cpu time spent up to now is 119.7 secs Computing kpt #: 54 total cpu time spent up to now is 121.4 secs Computing kpt #: 55 total cpu time spent up to now is 123.3 secs Computing kpt #: 56 total cpu time spent up to now is 125.1 secs Computing kpt #: 57 total cpu time spent up to now is 126.8 secs Computing kpt #: 58 total cpu time spent up to now is 128.7 secs Computing kpt #: 59 total cpu time spent up to now is 130.4 secs Computing kpt #: 60 total cpu time spent up to now is 132.2 secs Computing kpt #: 61 total cpu time spent up to now is 134.0 secs Computing kpt #: 62 total cpu time spent up to now is 135.8 secs Computing kpt #: 63 total cpu time spent up to now is 137.6 secs Computing kpt #: 64 total cpu time spent up to now is 139.5 secs Computing kpt #: 65 total cpu time spent up to now is 141.3 secs Computing kpt #: 66 total cpu time spent up to now is 143.1 secs Computing kpt #: 67 total cpu time spent up to now is 144.9 secs Computing kpt #: 68 total cpu time spent up to now is 146.8 secs Computing kpt #: 69 total cpu time spent up to now is 148.6 secs Computing kpt #: 70 total cpu time spent up to now is 150.4 secs Computing kpt #: 71 total cpu time spent up to now is 152.4 secs Computing kpt #: 72 total cpu time spent up to now is 154.4 secs Computing kpt #: 73 total cpu time spent up to now is 156.4 secs Computing kpt #: 74 total cpu time spent up to now is 158.5 secs Computing kpt #: 75 total cpu time spent up to now is 160.5 secs Computing kpt #: 76 total cpu time spent up to now is 162.5 secs Computing kpt #: 77 total cpu time spent up to now is 164.5 secs Computing kpt #: 78 total cpu time spent up to now is 166.6 secs Computing kpt #: 79 total cpu time spent up to now is 168.6 secs Computing kpt #: 80 total cpu time spent up to now is 170.6 secs Computing kpt #: 81 total cpu time spent up to now is 172.7 secs Computing kpt #: 82 total cpu time spent up to now is 175.1 secs Computing kpt #: 83 total cpu time spent up to now is 177.1 secs Computing kpt #: 84 total cpu time spent up to now is 179.2 secs Computing kpt #: 85 total cpu time spent up to now is 181.3 secs Computing kpt #: 86 total cpu time spent up to now is 183.5 secs Computing kpt #: 87 total cpu time spent up to now is 185.7 secs Computing kpt #: 88 total cpu time spent up to now is 187.8 secs Computing kpt #: 89 total cpu time spent up to now is 189.8 secs Computing kpt #: 90 total cpu time spent up to now is 191.9 secs Computing kpt #: 91 total cpu time spent up to now is 194.1 secs Computing kpt #: 92 total cpu time spent up to now is 196.3 secs Computing kpt #: 93 total cpu time spent up to now is 198.9 secs Computing kpt #: 94 total cpu time spent up to now is 201.6 secs Computing kpt #: 95 total cpu time spent up to now is 205.2 secs Computing kpt #: 96 total cpu time spent up to now is 209.1 secs Computing kpt #: 97 total cpu time spent up to now is 212.7 secs Computing kpt #: 98 total cpu time spent up to now is 216.2 secs Computing kpt #: 99 total cpu time spent up to now is 220.1 secs Computing kpt #: 100 total cpu time spent up to now is 223.5 secs Computing kpt #: 101 total cpu time spent up to now is 227.4 secs Computing kpt #: 102 total cpu time spent up to now is 230.8 secs Computing kpt #: 103 total cpu time spent up to now is 234.4 secs Computing kpt #: 104 total cpu time spent up to now is 238.1 secs Computing kpt #: 105 total cpu time spent up to now is 241.5 secs Computing kpt #: 106 total cpu time spent up to now is 245.0 secs Computing kpt #: 107 total cpu time spent up to now is 249.0 secs Computing kpt #: 108 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 253.2 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 257.6 secs Computing kpt #: 110 total cpu time spent up to now is 259.8 secs Computing kpt #: 111 total cpu time spent up to now is 261.9 secs Computing kpt #: 112 total cpu time spent up to now is 264.1 secs Computing kpt #: 113 total cpu time spent up to now is 266.3 secs Computing kpt #: 114 total cpu time spent up to now is 268.4 secs Computing kpt #: 115 total cpu time spent up to now is 270.6 secs Computing kpt #: 116 total cpu time spent up to now is 272.7 secs Computing kpt #: 117 total cpu time spent up to now is 274.9 secs Computing kpt #: 118 total cpu time spent up to now is 277.0 secs Computing kpt #: 119 total cpu time spent up to now is 279.2 secs Computing kpt #: 120 total cpu time spent up to now is 281.4 secs Computing kpt #: 121 total cpu time spent up to now is 283.5 secs Computing kpt #: 122 total cpu time spent up to now is 285.8 secs Computing kpt #: 123 total cpu time spent up to now is 288.0 secs Computing kpt #: 124 total cpu time spent up to now is 290.2 secs Computing kpt #: 125 total cpu time spent up to now is 292.4 secs Computing kpt #: 126 total cpu time spent up to now is 294.4 secs Computing kpt #: 127 total cpu time spent up to now is 296.2 secs Computing kpt #: 128 total cpu time spent up to now is 298.0 secs Computing kpt #: 129 total cpu time spent up to now is 299.8 secs Computing kpt #: 130 total cpu time spent up to now is 301.5 secs Computing kpt #: 131 total cpu time spent up to now is 303.3 secs Computing kpt #: 132 total cpu time spent up to now is 305.0 secs Computing kpt #: 133 total cpu time spent up to now is 306.7 secs Computing kpt #: 134 total cpu time spent up to now is 308.4 secs Computing kpt #: 135 total cpu time spent up to now is 310.0 secs Computing kpt #: 136 total cpu time spent up to now is 311.7 secs Computing kpt #: 137 total cpu time spent up to now is 313.4 secs Computing kpt #: 138 total cpu time spent up to now is 315.1 secs Computing kpt #: 139 total cpu time spent up to now is 316.7 secs Computing kpt #: 140 total cpu time spent up to now is 318.4 secs Computing kpt #: 141 total cpu time spent up to now is 320.0 secs Computing kpt #: 142 total cpu time spent up to now is 321.7 secs Computing kpt #: 143 total cpu time spent up to now is 323.3 secs Computing kpt #: 144 total cpu time spent up to now is 324.9 secs Computing kpt #: 145 total cpu time spent up to now is 326.6 secs Computing kpt #: 146 total cpu time spent up to now is 328.2 secs Computing kpt #: 147 total cpu time spent up to now is 329.9 secs Computing kpt #: 148 total cpu time spent up to now is 331.5 secs Computing kpt #: 149 total cpu time spent up to now is 333.2 secs Computing kpt #: 150 total cpu time spent up to now is 334.8 secs Computing kpt #: 151 total cpu time spent up to now is 336.4 secs Computing kpt #: 152 total cpu time spent up to now is 338.0 secs Computing kpt #: 153 total cpu time spent up to now is 339.7 secs Computing kpt #: 154 total cpu time spent up to now is 341.3 secs Computing kpt #: 155 total cpu time spent up to now is 342.9 secs Computing kpt #: 156 total cpu time spent up to now is 344.6 secs Computing kpt #: 157 total cpu time spent up to now is 346.3 secs Computing kpt #: 158 total cpu time spent up to now is 347.9 secs Computing kpt #: 159 total cpu time spent up to now is 349.6 secs Computing kpt #: 160 total cpu time spent up to now is 351.3 secs Computing kpt #: 161 total cpu time spent up to now is 353.0 secs Computing kpt #: 162 total cpu time spent up to now is 354.8 secs Computing kpt #: 163 total cpu time spent up to now is 356.5 secs Computing kpt #: 164 total cpu time spent up to now is 358.3 secs Computing kpt #: 165 total cpu time spent up to now is 360.0 secs Computing kpt #: 166 total cpu time spent up to now is 361.8 secs Computing kpt #: 167 total cpu time spent up to now is 363.6 secs Computing kpt #: 168 total cpu time spent up to now is 365.4 secs Computing kpt #: 169 total cpu time spent up to now is 367.2 secs Computing kpt #: 170 total cpu time spent up to now is 369.0 secs Computing kpt #: 171 total cpu time spent up to now is 370.8 secs Computing kpt #: 172 total cpu time spent up to now is 372.7 secs Computing kpt #: 173 total cpu time spent up to now is 374.5 secs Computing kpt #: 174 total cpu time spent up to now is 376.3 secs Computing kpt #: 175 total cpu time spent up to now is 378.4 secs Computing kpt #: 176 total cpu time spent up to now is 380.4 secs Computing kpt #: 177 total cpu time spent up to now is 382.4 secs Computing kpt #: 178 total cpu time spent up to now is 384.4 secs Computing kpt #: 179 total cpu time spent up to now is 386.4 secs Computing kpt #: 180 total cpu time spent up to now is 388.7 secs Computing kpt #: 181 total cpu time spent up to now is 390.8 secs Computing kpt #: 182 total cpu time spent up to now is 392.9 secs Computing kpt #: 183 total cpu time spent up to now is 395.5 secs Computing kpt #: 184 total cpu time spent up to now is 397.6 secs Computing kpt #: 185 total cpu time spent up to now is 399.7 secs Computing kpt #: 186 total cpu time spent up to now is 401.9 secs Computing kpt #: 187 total cpu time spent up to now is 404.0 secs Computing kpt #: 188 total cpu time spent up to now is 406.2 secs Computing kpt #: 189 total cpu time spent up to now is 408.4 secs Computing kpt #: 190 total cpu time spent up to now is 410.3 secs Computing kpt #: 191 total cpu time spent up to now is 412.1 secs Computing kpt #: 192 total cpu time spent up to now is 413.9 secs Computing kpt #: 193 total cpu time spent up to now is 415.7 secs Computing kpt #: 194 total cpu time spent up to now is 417.4 secs Computing kpt #: 195 total cpu time spent up to now is 419.2 secs Computing kpt #: 196 total cpu time spent up to now is 421.0 secs Computing kpt #: 197 total cpu time spent up to now is 422.8 secs Computing kpt #: 198 total cpu time spent up to now is 424.5 secs Computing kpt #: 199 total cpu time spent up to now is 426.3 secs Computing kpt #: 200 total cpu time spent up to now is 428.1 secs Computing kpt #: 201 total cpu time spent up to now is 429.9 secs Computing kpt #: 202 total cpu time spent up to now is 431.6 secs Computing kpt #: 203 total cpu time spent up to now is 433.4 secs Computing kpt #: 204 total cpu time spent up to now is 435.1 secs Computing kpt #: 205 total cpu time spent up to now is 436.9 secs Computing kpt #: 206 total cpu time spent up to now is 438.6 secs Computing kpt #: 207 total cpu time spent up to now is 440.4 secs Computing kpt #: 208 total cpu time spent up to now is 442.1 secs Computing kpt #: 209 total cpu time spent up to now is 443.8 secs Computing kpt #: 210 total cpu time spent up to now is 445.5 secs Computing kpt #: 211 total cpu time spent up to now is 447.2 secs Computing kpt #: 212 total cpu time spent up to now is 448.8 secs Computing kpt #: 213 total cpu time spent up to now is 450.4 secs Computing kpt #: 214 total cpu time spent up to now is 452.1 secs Computing kpt #: 215 total cpu time spent up to now is 453.7 secs Computing kpt #: 216 total cpu time spent up to now is 455.4 secs Computing kpt #: 217 total cpu time spent up to now is 457.0 secs Computing kpt #: 218 total cpu time spent up to now is 458.6 secs ethr = 1.25E-08, avg # of iterations = 29.5 total cpu time spent up to now is 458.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5497 PWs) bands (ev): -2.4033 -2.4033 -0.4331 -0.4331 -0.4331 -0.4331 -0.4310 -0.4310 2.8841 2.8841 3.0148 3.0148 3.0148 3.0148 4.6497 4.6497 5.2626 5.2626 5.2626 5.2626 5.4357 5.4357 6.0794 6.0794 6.0794 6.0794 6.5683 6.5683 6.6224 6.6224 6.6224 6.6224 7.0048 7.0048 7.2137 7.2137 7.2137 7.2137 7.5024 7.5024 7.5024 7.5024 7.7161 7.7161 7.9356 7.9356 8.0404 8.0404 8.1579 8.1579 8.1579 8.1579 8.3257 8.3257 8.3257 8.3257 8.3525 8.3525 8.3525 8.3525 8.5270 8.5270 8.9969 8.9969 8.9969 8.9969 9.4617 9.4617 9.5735 9.5735 9.5735 9.5735 9.6831 9.6831 10.3204 10.3204 10.7312 10.7312 10.7312 10.7312 13.8119 13.8119 13.8119 13.8119 13.9501 13.9501 14.5225 14.5225 16.6176 16.6176 16.6176 16.6176 17.1252 17.1252 17.6555 17.6555 k = 0.0000 0.0179-0.0000 ( 5489 PWs) bands (ev): -2.4020 -2.4020 -0.4343 -0.4343 -0.4323 -0.4323 -0.4307 -0.4307 2.8832 2.8832 3.0130 3.0130 3.0144 3.0144 4.6395 4.6395 5.2639 5.2639 5.2681 5.2681 5.4377 5.4377 6.0795 6.0795 6.0814 6.0814 6.5700 6.5700 6.6215 6.6215 6.6226 6.6226 6.9960 6.9960 7.1906 7.1906 7.2103 7.2103 7.5024 7.5024 7.5185 7.5185 7.7254 7.7254 7.9361 7.9361 8.0420 8.0420 8.1433 8.1433 8.1577 8.1577 8.3007 8.3007 8.3209 8.3209 8.3594 8.3594 8.3976 8.3976 8.5278 8.5278 8.9968 8.9968 8.9986 8.9986 9.4619 9.4619 9.5738 9.5738 9.5754 9.5754 9.6827 9.6827 10.3245 10.3245 10.7323 10.7323 10.7369 10.7369 13.8109 13.8109 13.8116 13.8116 13.9494 13.9494 14.5254 14.5254 16.6122 16.6122 16.6173 16.6173 17.1218 17.1218 17.6548 17.6548 k = 0.0000 0.0357-0.0000 ( 5490 PWs) bands (ev): -2.3981 -2.3981 -0.4388 -0.4388 -0.4301 -0.4301 -0.4287 -0.4287 2.8804 2.8804 3.0078 3.0078 3.0133 3.0133 4.6102 4.6102 5.2676 5.2676 5.2833 5.2833 5.4436 5.4436 6.0799 6.0799 6.0875 6.0875 6.5749 6.5749 6.6188 6.6188 6.6234 6.6234 6.9666 6.9666 7.1419 7.1419 7.2007 7.2007 7.5010 7.5010 7.5486 7.5486 7.7521 7.7521 7.9389 7.9389 8.0465 8.0465 8.1102 8.1102 8.1570 8.1570 8.2827 8.2827 8.3135 8.3135 8.3733 8.3733 8.4645 8.4645 8.5320 8.5320 8.9968 8.9968 9.0038 9.0038 9.4624 9.4624 9.5748 9.5748 9.5811 9.5811 9.6818 9.6818 10.3361 10.3361 10.7354 10.7354 10.7542 10.7542 13.8077 13.8077 13.8106 13.8106 13.9474 13.9474 14.5340 14.5340 16.5961 16.5961 16.6164 16.6164 17.1121 17.1121 17.6501 17.6501 k = 0.0000 0.0536-0.0000 ( 5494 PWs) bands (ev): -2.3916 -2.3916 -0.4467 -0.4467 -0.4265 -0.4265 -0.4251 -0.4251 2.8755 2.8755 2.9997 2.9997 3.0115 3.0115 4.5652 4.5652 5.2734 5.2734 5.3054 5.3054 5.4526 5.4526 6.0804 6.0804 6.0973 6.0973 6.5832 6.5832 6.6143 6.6143 6.6247 6.6247 6.9119 6.9119 7.0960 7.0960 7.1861 7.1861 7.4953 7.4953 7.5724 7.5724 7.7843 7.7843 7.9513 7.9513 8.0522 8.0522 8.0773 8.0773 8.1559 8.1559 8.2740 8.2740 8.3081 8.3081 8.3897 8.3897 8.5171 8.5171 8.5596 8.5596 8.9969 8.9969 9.0128 9.0128 9.4635 9.4635 9.5764 9.5764 9.5909 9.5909 9.6815 9.6815 10.3532 10.3532 10.7405 10.7405 10.7834 10.7834 13.8027 13.8027 13.8091 13.8091 13.9441 13.9441 14.5478 14.5478 16.5702 16.5702 16.6147 16.6147 17.0971 17.0971 17.6308 17.6308 k = 0.0000 0.0714-0.0000 ( 5510 PWs) bands (ev): -2.3824 -2.3824 -0.4578 -0.4578 -0.4214 -0.4214 -0.4201 -0.4201 2.8684 2.8684 2.9894 2.9894 3.0090 3.0090 4.5082 4.5082 5.2809 5.2809 5.3312 5.3312 5.4638 5.4638 6.0810 6.0810 6.1107 6.1107 6.5946 6.5946 6.6078 6.6078 6.6264 6.6264 6.8365 6.8365 7.0610 7.0610 7.1679 7.1679 7.4843 7.4843 7.5851 7.5851 7.8012 7.8012 7.9814 7.9814 8.0425 8.0425 8.0711 8.0711 8.1545 8.1545 8.2712 8.2712 8.3055 8.3055 8.4081 8.4081 8.5318 8.5318 8.6314 8.6314 8.9972 8.9972 9.0258 9.0258 9.4658 9.4658 9.5787 9.5787 9.6049 9.6049 9.6831 9.6831 10.3732 10.3732 10.7476 10.7476 10.8248 10.8248 13.7962 13.7962 13.8072 13.8072 13.9400 13.9400 14.5663 14.5663 16.5350 16.5350 16.6118 16.6118 17.0783 17.0783 17.5382 17.5382 k = 0.0000 0.0893-0.0000 ( 5506 PWs) bands (ev): -2.3707 -2.3707 -0.4721 -0.4721 -0.4150 -0.4150 -0.4137 -0.4137 2.8589 2.8589 2.9779 2.9779 3.0058 3.0058 4.4426 4.4426 5.2896 5.2896 5.3582 5.3582 5.4760 5.4760 6.0815 6.0815 6.1269 6.1269 6.5988 6.5988 6.6085 6.6085 6.6286 6.6286 6.7523 6.7523 7.0328 7.0328 7.1474 7.1474 7.4691 7.4691 7.5847 7.5847 7.8029 7.8029 8.0138 8.0138 8.0249 8.0249 8.0931 8.0931 8.1527 8.1527 8.2736 8.2736 8.3059 8.3059 8.4290 8.4290 8.5471 8.5471 8.7092 8.7092 8.9981 8.9981 9.0429 9.0429 9.4696 9.4696 9.5816 9.5816 9.6227 9.6227 9.6891 9.6891 10.3937 10.3937 10.7567 10.7567 10.8780 10.8780 13.7886 13.7886 13.8053 13.8053 13.9351 13.9351 14.5887 14.5887 16.4912 16.4912 16.6072 16.6072 17.0575 17.0575 17.3687 17.3687 k = 0.0000 0.1071-0.0000 ( 5522 PWs) bands (ev): -2.3564 -2.3564 -0.4895 -0.4895 -0.4073 -0.4073 -0.4059 -0.4059 2.8467 2.8467 2.9659 2.9659 3.0018 3.0018 4.3709 4.3709 5.2990 5.2990 5.3849 5.3849 5.4878 5.4878 6.0816 6.0816 6.1452 6.1452 6.5852 6.5852 6.6115 6.6115 6.6350 6.6350 6.6786 6.6786 7.0070 7.0070 7.1260 7.1260 7.4518 7.4518 7.5690 7.5690 7.8027 7.8027 8.0120 8.0120 8.0297 8.0297 8.1267 8.1267 8.1532 8.1532 8.2787 8.2787 8.3108 8.3108 8.4523 8.4523 8.5738 8.5738 8.7843 8.7843 9.0005 9.0005 9.0635 9.0635 9.4756 9.4756 9.5849 9.5849 9.6428 9.6428 9.7037 9.7037 10.4131 10.4131 10.7676 10.7676 10.9420 10.9420 13.7804 13.7804 13.8036 13.8036 13.9300 13.9300 14.6145 14.6145 16.4390 16.4390 16.6001 16.6001 17.0362 17.0362 17.1884 17.1884 k = 0.0000 0.1250-0.0000 ( 5530 PWs) bands (ev): -2.3396 -2.3396 -0.5102 -0.5102 -0.3984 -0.3984 -0.3969 -0.3969 2.8320 2.8320 2.9542 2.9542 2.9972 2.9972 4.2951 4.2951 5.3091 5.3091 5.4099 5.4099 5.4982 5.4982 6.0808 6.0808 6.1642 6.1642 6.5398 6.5398 6.5871 6.5871 6.6418 6.6418 6.6675 6.6675 6.9815 6.9815 7.1053 7.1053 7.4343 7.4343 7.5404 7.5404 7.8044 7.8044 8.0062 8.0062 8.0333 8.0333 8.1360 8.1360 8.1744 8.1744 8.2835 8.2835 8.3211 8.3211 8.4773 8.4773 8.6170 8.6170 8.8524 8.8524 9.0062 9.0062 9.0873 9.0873 9.4841 9.4841 9.5889 9.5889 9.6627 9.6627 9.7312 9.7312 10.4306 10.4306 10.7803 10.7803 11.0150 11.0150 13.7720 13.7720 13.8026 13.8026 13.9248 13.9248 14.6427 14.6427 16.3772 16.3772 16.5895 16.5895 17.0008 17.0008 17.0249 17.0249 k = 0.0000 0.1429-0.0000 ( 5522 PWs) bands (ev): -2.3203 -2.3203 -0.5340 -0.5340 -0.3884 -0.3884 -0.3866 -0.3866 2.8152 2.8152 2.9432 2.9432 2.9919 2.9919 4.2164 4.2164 5.3195 5.3195 5.4323 5.4323 5.5068 5.5068 6.0787 6.0787 6.1822 6.1822 6.4601 6.4601 6.5717 6.5717 6.6442 6.6442 6.6926 6.6926 6.9545 6.9545 7.0877 7.0877 7.4180 7.4180 7.5041 7.5041 7.8044 7.8044 8.0058 8.0058 8.0343 8.0343 8.1296 8.1296 8.1986 8.1986 8.2871 8.2871 8.3349 8.3349 8.5045 8.5045 8.6754 8.6754 8.9074 8.9074 9.0202 9.0202 9.1132 9.1132 9.4956 9.4956 9.5942 9.5942 9.6828 9.6828 9.7731 9.7731 10.4458 10.4458 10.7946 10.7946 11.0949 11.0949 13.7638 13.7638 13.8027 13.8027 13.9200 13.9200 14.6727 14.6727 16.3030 16.3030 16.5740 16.5740 16.8368 16.8368 17.0024 17.0024 k = 0.0000 0.1607-0.0000 ( 5522 PWs) bands (ev): -2.2984 -2.2984 -0.5610 -0.5610 -0.3773 -0.3773 -0.3753 -0.3753 2.7969 2.7969 2.9329 2.9329 2.9860 2.9860 4.1360 4.1360 5.3303 5.3303 5.4509 5.4509 5.5137 5.5137 6.0744 6.0744 6.1968 6.1968 6.3797 6.3797 6.5582 6.5582 6.6475 6.6475 6.7251 6.7251 6.9249 6.9249 7.0755 7.0755 7.4039 7.4039 7.4646 7.4646 7.7992 7.7992 8.0068 8.0068 8.0389 8.0389 8.1201 8.1201 8.2149 8.2149 8.2904 8.2904 8.3493 8.3493 8.5353 8.5353 8.7419 8.7419 8.9421 8.9421 9.0487 9.0487 9.1408 9.1408 9.5107 9.5107 9.6022 9.6022 9.7052 9.7052 9.8279 9.8279 10.4587 10.4587 10.8106 10.8106 11.1793 11.1793 13.7563 13.7563 13.8045 13.8045 13.9160 13.9160 14.7038 14.7038 16.2113 16.2113 16.5488 16.5488 16.6884 16.6884 16.9898 16.9898 k = 0.0000 0.1786-0.0000 ( 5522 PWs) bands (ev): -2.2741 -2.2741 -0.5910 -0.5910 -0.3653 -0.3653 -0.3629 -0.3629 2.7781 2.7781 2.9233 2.9233 2.9794 2.9794 4.0548 4.0548 5.3411 5.3411 5.4650 5.4650 5.5193 5.5193 6.0669 6.0669 6.2013 6.2013 6.3104 6.3104 6.5452 6.5452 6.6507 6.6507 6.7621 6.7621 6.8922 6.8922 7.0702 7.0702 7.3922 7.3922 7.4254 7.4254 7.7883 7.7883 8.0035 8.0035 8.0512 8.0512 8.1095 8.1095 8.2261 8.2261 8.2934 8.2934 8.3631 8.3631 8.5702 8.5702 8.8076 8.8076 8.9606 8.9606 9.0878 9.0878 9.1695 9.1695 9.5298 9.5298 9.6146 9.6146 9.7317 9.7317 9.8938 9.8938 10.4696 10.4696 10.8280 10.8280 11.2660 11.2660 13.7496 13.7496 13.8084 13.8084 13.9134 13.9134 14.7355 14.7355 16.0965 16.0965 16.4935 16.4935 16.5898 16.5898 16.9815 16.9815 k = 0.0000 0.1964-0.0000 ( 5526 PWs) bands (ev): -2.2474 -2.2474 -0.6241 -0.6241 -0.3524 -0.3524 -0.3497 -0.3497 2.7594 2.7594 2.9142 2.9142 2.9721 2.9721 3.9734 3.9734 5.3519 5.3519 5.4737 5.4737 5.5242 5.5242 6.0549 6.0549 6.1767 6.1767 6.2727 6.2727 6.5331 6.5331 6.6533 6.6533 6.8022 6.8022 6.8570 6.8570 7.0722 7.0722 7.3754 7.3754 7.3958 7.3958 7.7730 7.7730 7.9959 7.9959 8.0661 8.0661 8.1011 8.1011 8.2351 8.2351 8.2959 8.2959 8.3764 8.3764 8.6087 8.6087 8.8635 8.8635 8.9763 8.9763 9.1264 9.1264 9.1991 9.1991 9.5534 9.5534 9.6334 9.6334 9.7631 9.7631 9.9689 9.9689 10.4785 10.4785 10.8469 10.8469 11.3526 11.3526 13.7441 13.7441 13.8149 13.8149 13.9126 13.9126 14.7670 14.7670 15.9579 15.9579 16.4051 16.4051 16.5472 16.5472 16.9764 16.9764 k = 0.0000 0.2143-0.0000 ( 5514 PWs) bands (ev): -2.2183 -2.2183 -0.6601 -0.6601 -0.3389 -0.3389 -0.3358 -0.3358 2.7416 2.7416 2.9055 2.9055 2.9643 2.9643 3.8926 3.8926 5.3623 5.3623 5.4774 5.4774 5.5289 5.5289 6.0367 6.0367 6.1241 6.1241 6.2673 6.2673 6.5223 6.5223 6.6546 6.6546 6.8176 6.8176 6.8475 6.8475 7.0807 7.0807 7.3417 7.3417 7.3892 7.3892 7.7551 7.7551 7.9856 7.9856 8.0698 8.0698 8.1054 8.1054 8.2442 8.2442 8.2978 8.2978 8.3898 8.3898 8.6496 8.6496 8.9000 8.9000 9.0012 9.0012 9.1586 9.1586 9.2284 9.2284 9.5822 9.5822 9.6602 9.6602 9.7997 9.7997 10.0515 10.0515 10.4857 10.4857 10.8673 10.8673 11.4372 11.4372 13.7400 13.7400 13.8245 13.8245 13.9146 13.9146 14.7978 14.7978 15.8020 15.8020 16.3203 16.3203 16.5195 16.5195 16.9725 16.9725 k = 0.0000 0.2321-0.0000 ( 5526 PWs) bands (ev): -2.1869 -2.1869 -0.6989 -0.6989 -0.3247 -0.3247 -0.3214 -0.3214 2.7252 2.7252 2.8972 2.8972 2.9559 2.9559 3.8127 3.8127 5.3719 5.3719 5.4769 5.4769 5.5327 5.5327 6.0095 6.0095 6.0709 6.0709 6.2702 6.2702 6.5132 6.5132 6.6538 6.6538 6.7822 6.7822 6.8901 6.8901 7.0942 7.0942 7.3065 7.3065 7.3914 7.3914 7.7361 7.7361 7.9732 7.9732 8.0606 8.0606 8.1224 8.1224 8.2545 8.2545 8.2989 8.2989 8.4035 8.4035 8.6911 8.6911 8.9165 8.9165 9.0376 9.0376 9.1836 9.1836 9.2547 9.2547 9.6161 9.6161 9.6956 9.6956 9.8418 9.8418 10.1395 10.1395 10.4914 10.4914 10.8892 10.8892 11.5174 11.5174 13.7375 13.7375 13.8371 13.8371 13.9203 13.9203 14.8275 14.8275 15.6374 15.6374 16.2442 16.2442 16.4952 16.4952 16.9646 16.9646 k = 0.0000 0.2500-0.0000 ( 5530 PWs) bands (ev): -2.1531 -2.1531 -0.7405 -0.7405 -0.3102 -0.3102 -0.3065 -0.3065 2.7107 2.7107 2.8892 2.8892 2.9469 2.9469 3.7343 3.7343 5.3802 5.3802 5.4737 5.4737 5.5351 5.5351 5.9717 5.9717 6.0278 6.0278 6.2735 6.2735 6.5057 6.5057 6.6495 6.6495 6.7492 6.7492 6.9326 6.9326 7.1109 7.1109 7.2741 7.2741 7.3990 7.3990 7.7171 7.7171 7.9591 7.9591 8.0483 8.0483 8.1410 8.1410 8.2667 8.2667 8.2993 8.2993 8.4179 8.4179 8.7315 8.7315 8.9222 8.9222 9.0784 9.0784 9.2027 9.2027 9.2754 9.2754 9.6547 9.6547 9.7383 9.7383 9.8895 9.8895 10.2311 10.2311 10.4959 10.4959 10.9127 10.9127 11.5911 11.5911 13.7369 13.7369 13.8528 13.8528 13.9308 13.9308 14.8555 14.8555 15.4707 15.4707 16.1735 16.1735 16.4729 16.4729 16.9415 16.9415 k = 0.0000 0.2679-0.0000 ( 5530 PWs) bands (ev): -2.1172 -2.1172 -0.7845 -0.7845 -0.2954 -0.2954 -0.2915 -0.2915 2.6983 2.6983 2.8816 2.8816 2.9374 2.9374 3.6578 3.6578 5.3867 5.3867 5.4689 5.4689 5.5356 5.5356 5.9295 5.9295 5.9915 5.9915 6.2753 6.2753 6.4997 6.4997 6.6390 6.6390 6.7234 6.7234 6.9714 6.9714 7.1292 7.1292 7.2467 7.2467 7.4114 7.4114 7.6991 7.6991 7.9439 7.9439 8.0353 8.0353 8.1581 8.1581 8.2811 8.2811 8.2994 8.2994 8.4330 8.4330 8.7686 8.7686 8.9239 8.9239 9.1199 9.1199 9.2176 9.2176 9.2899 9.2899 9.6968 9.6968 9.7855 9.7855 9.9428 9.9428 10.3243 10.3243 10.4995 10.4995 10.9379 10.9379 11.6562 11.6562 13.7382 13.7382 13.8715 13.8715 13.9475 13.9475 14.8813 14.8813 15.3063 15.3063 16.1052 16.1052 16.4530 16.4530 16.8993 16.8993 k = 0.0000 0.2857-0.0000 ( 5530 PWs) bands (ev): -2.0791 -2.0791 -0.8309 -0.8309 -0.2806 -0.2806 -0.2764 -0.2764 2.6884 2.6884 2.8743 2.8743 2.9275 2.9275 3.5836 3.5836 5.3905 5.3905 5.4635 5.4635 5.5341 5.5341 5.8910 5.8910 5.9566 5.9566 6.2747 6.2747 6.4947 6.4947 6.6208 6.6208 6.7080 6.7080 7.0016 7.0016 7.1487 7.1487 7.2270 7.2270 7.4279 7.4279 7.6831 7.6831 7.9278 7.9278 8.0219 8.0219 8.1731 8.1731 8.2941 8.2941 8.3031 8.3031 8.4487 8.4487 8.8002 8.8002 8.9246 8.9246 9.1621 9.1621 9.2296 9.2296 9.2993 9.2993 9.7413 9.7413 9.8332 9.8332 10.0016 10.0016 10.4172 10.4172 10.5030 10.5030 10.9649 10.9649 11.7106 11.7106 13.7418 13.7418 13.8931 13.8931 13.9715 13.9715 14.9043 14.9043 15.1473 15.1473 16.0373 16.0373 16.4359 16.4359 16.8509 16.8509 k = 0.0000 0.3036-0.0000 ( 5546 PWs) bands (ev): -2.0390 -2.0390 -0.8794 -0.8794 -0.2659 -0.2659 -0.2615 -0.2615 2.6809 2.6809 2.8676 2.8676 2.9174 2.9174 3.5120 3.5120 5.3914 5.3914 5.4576 5.4576 5.5309 5.5309 5.8600 5.8600 5.9209 5.9209 6.2709 6.2709 6.4904 6.4904 6.5983 6.5983 6.7011 6.7011 7.0175 7.0175 7.1703 7.1703 7.2184 7.2184 7.4471 7.4471 7.6700 7.6700 7.9110 7.9110 8.0082 8.0082 8.1857 8.1857 8.2948 8.2948 8.3213 8.3213 8.4649 8.4649 8.8242 8.8242 8.9257 8.9257 9.2045 9.2045 9.2403 9.2403 9.3055 9.3055 9.7873 9.7873 9.8776 9.8776 10.0655 10.0655 10.4965 10.4965 10.5186 10.5186 10.9937 10.9937 11.7523 11.7523 13.7476 13.7476 13.9180 13.9180 14.0032 14.0032 14.9242 14.9242 14.9959 14.9959 15.9684 15.9684 16.4220 16.4220 16.8040 16.8040 k = 0.0000 0.3214-0.0000 ( 5546 PWs) bands (ev): -1.9968 -1.9968 -0.9298 -0.9298 -0.2514 -0.2514 -0.2470 -0.2470 2.6761 2.6761 2.8612 2.8612 2.9075 2.9075 3.4434 3.4434 5.3893 5.3893 5.4511 5.4511 5.5266 5.5266 5.8379 5.8379 5.8848 5.8848 6.2628 6.2628 6.4867 6.4867 6.5763 6.5763 6.6993 6.6993 7.0163 7.0163 7.1941 7.1941 7.2217 7.2217 7.4672 7.4672 7.6611 7.6611 7.8939 7.8939 7.9940 7.9940 8.1962 8.1962 8.2928 8.2928 8.3441 8.3441 8.4814 8.4814 8.8398 8.8398 8.9279 8.9279 9.2366 9.2366 9.2590 9.2590 9.3125 9.3125 9.8337 9.8337 9.9160 9.9160 10.1338 10.1338 10.5065 10.5065 10.6017 10.6017 11.0240 11.0240 11.7795 11.7795 13.7558 13.7558 13.9472 13.9472 14.0425 14.0425 14.8538 14.8538 14.9402 14.9402 15.8974 15.8974 16.4117 16.4117 16.7611 16.7611 k = 0.0000 0.3393-0.0000 ( 5554 PWs) bands (ev): -1.9527 -1.9527 -0.9819 -0.9819 -0.2375 -0.2375 -0.2331 -0.2331 2.6737 2.6737 2.8548 2.8548 2.8984 2.8984 3.3780 3.3780 5.3847 5.3847 5.4430 5.4430 5.5223 5.5223 5.8239 5.8239 5.8500 5.8500 6.2497 6.2497 6.4835 6.4835 6.5580 6.5580 6.7003 6.7003 7.0021 7.0021 7.2145 7.2145 7.2379 7.2379 7.4864 7.4864 7.6576 7.6576 7.8765 7.8765 7.9795 7.9795 8.2049 8.2049 8.2902 8.2902 8.3692 8.3692 8.4982 8.4982 8.8478 8.8478 8.9307 8.9307 9.2470 9.2470 9.2844 9.2844 9.3343 9.3343 9.8788 9.8788 9.9472 9.9472 10.2046 10.2046 10.5126 10.5126 10.6871 10.6871 11.0551 11.0551 11.7906 11.7906 13.7666 13.7666 13.9816 13.9816 14.0888 14.0888 14.7222 14.7222 14.9520 14.9520 15.8235 15.8235 16.4052 16.4052 16.7230 16.7230 k = 0.0000 0.3571-0.0000 ( 5546 PWs) bands (ev): -1.9068 -1.9068 -1.0355 -1.0355 -0.2243 -0.2243 -0.2200 -0.2200 2.6738 2.6738 2.8476 2.8476 2.8912 2.8912 3.3161 3.3161 5.3786 5.3786 5.4326 5.4326 5.5195 5.5195 5.8051 5.8051 5.8292 5.8292 6.2312 6.2312 6.4813 6.4813 6.5442 6.5442 6.7033 6.7033 6.9807 6.9807 7.2286 7.2286 7.2629 7.2629 7.5036 7.5036 7.6604 7.6604 7.8589 7.8589 7.9644 7.9644 8.2123 8.2123 8.2870 8.2870 8.3957 8.3957 8.5150 8.5150 8.8503 8.8503 8.9327 8.9327 9.2524 9.2524 9.2914 9.2914 9.3796 9.3796 9.9187 9.9187 9.9738 9.9738 10.2735 10.2735 10.5245 10.5245 10.7681 10.7681 11.0861 11.0861 11.7848 11.7848 13.7800 13.7800 14.0217 14.0217 14.1410 14.1410 14.6023 14.6023 14.9591 14.9591 15.7461 15.7461 16.4027 16.4027 16.6897 16.6897 k = 0.0000 0.3750-0.0000 ( 5530 PWs) bands (ev): -1.8591 -1.8591 -1.0902 -1.0902 -0.2120 -0.2120 -0.2079 -0.2079 2.6763 2.6763 2.8389 2.8389 2.8872 2.8872 3.2580 3.2580 5.3719 5.3719 5.4202 5.4202 5.5189 5.5189 5.7724 5.7724 5.8311 5.8311 6.2078 6.2078 6.4805 6.4805 6.5343 6.5343 6.7080 6.7080 6.9561 6.9561 7.2409 7.2409 7.2874 7.2874 7.5190 7.5190 7.6689 7.6689 7.8414 7.8414 7.9489 7.9489 8.2187 8.2187 8.2834 8.2834 8.4228 8.4228 8.5314 8.5314 8.8497 8.8497 8.9326 8.9326 9.2565 9.2565 9.2914 9.2914 9.4333 9.4333 9.9440 9.9440 10.0045 10.0045 10.3313 10.3313 10.5508 10.5508 10.8437 10.8437 11.1158 11.1158 11.7616 11.7616 13.7962 13.7962 14.0679 14.0679 14.1978 14.1978 14.4946 14.4946 14.9613 14.9613 15.6649 15.6649 16.4041 16.4041 16.6606 16.6606 k = 0.0000 0.3929-0.0000 ( 5518 PWs) bands (ev): -1.8099 -1.8099 -1.1460 -1.1460 -0.2008 -0.2008 -0.1970 -0.1970 2.6810 2.6810 2.8282 2.8282 2.8870 2.8870 3.2039 3.2039 5.3651 5.3651 5.4067 5.4067 5.5207 5.5207 5.7390 5.7390 5.8416 5.8416 6.1804 6.1804 6.4813 6.4813 6.5274 6.5274 6.7144 6.7144 6.9303 6.9303 7.2527 7.2527 7.3072 7.3072 7.5341 7.5341 7.6814 7.6814 7.8245 7.8245 7.9329 7.9329 8.2244 8.2244 8.2795 8.2795 8.4498 8.4498 8.5469 8.5469 8.8480 8.8480 8.9299 8.9299 9.2597 9.2597 9.2896 9.2896 9.4893 9.4893 9.9504 9.9504 10.0438 10.0438 10.3664 10.3664 10.6023 10.6023 10.9129 10.9129 11.1428 11.1428 11.7214 11.7214 13.8154 13.8154 14.1198 14.1198 14.2554 14.2554 14.4011 14.4011 14.9591 14.9591 15.5798 15.5798 16.4093 16.4093 16.6349 16.6349 k = 0.0000 0.4107-0.0000 ( 5518 PWs) bands (ev): -1.7591 -1.7591 -1.2025 -1.2025 -0.1909 -0.1909 -0.1876 -0.1876 2.6877 2.6877 2.8158 2.8158 2.8909 2.8909 3.1539 3.1539 5.3590 5.3590 5.3932 5.3932 5.5249 5.5249 5.7070 5.7070 5.8578 5.8578 6.1501 6.1501 6.4835 6.4835 6.5222 6.5222 6.7225 6.7225 6.9045 6.9045 7.2642 7.2642 7.3207 7.3207 7.5510 7.5510 7.6947 7.6947 7.8092 7.8092 7.9165 7.9165 8.2296 8.2296 8.2753 8.2753 8.4758 8.4758 8.5607 8.5607 8.8465 8.8465 8.9244 8.9244 9.2625 9.2625 9.2871 9.2871 9.5454 9.5454 9.9435 9.9435 10.0864 10.0864 10.3775 10.3775 10.6790 10.6790 10.9751 10.9751 11.1657 11.1657 11.6653 11.6653 13.8377 13.8377 14.1766 14.1766 14.2835 14.2835 14.3491 14.3491 14.9537 14.9537 15.4914 15.4914 16.4181 16.4181 16.6116 16.6116 k = 0.0000 0.4286-0.0000 ( 5518 PWs) bands (ev): -1.7070 -1.7070 -1.2594 -1.2594 -0.1824 -0.1824 -0.1796 -0.1796 2.6962 2.6962 2.8021 2.8021 2.8987 2.8987 3.1083 3.1083 5.3539 5.3539 5.3807 5.3807 5.5315 5.5315 5.6771 5.6771 5.8782 5.8782 6.1181 6.1181 6.4868 6.4868 6.5181 6.5181 6.7324 6.7324 6.8793 6.8793 7.2754 7.2754 7.3278 7.3278 7.5703 7.5703 7.7048 7.7048 7.7980 7.7980 7.8997 7.8997 8.2345 8.2345 8.2709 8.2709 8.5002 8.5002 8.5716 8.5716 8.8465 8.8465 8.9165 8.9165 9.2649 9.2649 9.2843 9.2843 9.6007 9.6007 9.9272 9.9272 10.1291 10.1291 10.3728 10.3728 10.7718 10.7718 11.0297 11.0297 11.1834 11.1834 11.5950 11.5950 13.8633 13.8633 14.2246 14.2246 14.2371 14.2371 14.3903 14.3903 14.9484 14.9484 15.4004 15.4004 16.4303 16.4303 16.5898 16.5898 k = 0.0000 0.4464-0.0000 ( 5506 PWs) bands (ev): -1.6536 -1.6536 -1.3166 -1.3166 -0.1756 -0.1756 -0.1734 -0.1734 2.7063 2.7063 2.7878 2.7878 2.9104 2.9104 3.0670 3.0670 5.3502 5.3502 5.3699 5.3699 5.5405 5.5405 5.6495 5.6495 5.9020 5.9020 6.0852 6.0852 6.4907 6.4907 6.5144 6.5144 6.7442 6.7442 6.8551 6.8551 7.2862 7.2862 7.3295 7.3295 7.5919 7.5919 7.7064 7.7064 7.7950 7.7950 7.8826 7.8826 8.2391 8.2391 8.2664 8.2664 8.5225 8.5225 8.5787 8.5787 8.8488 8.8488 8.9066 8.9066 9.2671 9.2671 9.2815 9.2815 9.6541 9.6541 9.9034 9.9034 10.1705 10.1705 10.3584 10.3584 10.8729 10.8729 11.0761 11.0761 11.1951 11.1951 11.5128 11.5128 13.8924 13.8924 14.1605 14.1605 14.2978 14.2978 14.4367 14.4367 14.9491 14.9491 15.3087 15.3087 16.4454 16.4454 16.5684 16.5684 k = 0.0000 0.4643-0.0000 ( 5510 PWs) bands (ev): -1.5992 -1.5992 -1.3739 -1.3739 -0.1705 -0.1705 -0.1690 -0.1690 2.7179 2.7179 2.7731 2.7731 2.9261 2.9261 3.0301 3.0301 5.3482 5.3482 5.3611 5.3611 5.5520 5.5520 5.6246 5.6246 5.9286 5.9286 6.0522 6.0522 6.4949 6.4949 6.5109 6.5109 6.7580 6.7580 6.8323 6.8323 7.2964 7.2964 7.3272 7.3272 7.6148 7.6148 7.6974 7.6974 7.8018 7.8018 7.8653 7.8653 8.2437 8.2437 8.2619 8.2619 8.5421 8.5421 8.5811 8.5811 8.8539 8.8539 8.8954 8.8954 9.2693 9.2693 9.2788 9.2788 9.7051 9.7051 9.8733 9.8733 10.2100 10.2100 10.3374 10.3374 10.9769 10.9769 11.1133 11.1133 11.2010 11.2010 11.4217 11.4217 13.9253 13.9253 14.1021 14.1021 14.3569 14.3569 14.4662 14.4662 14.9641 14.9641 15.2185 15.2185 16.4631 16.4631 16.5469 16.5469 k = 0.0000 0.4821-0.0000 ( 5510 PWs) bands (ev): -1.5438 -1.5438 -1.4310 -1.4310 -0.1673 -0.1673 -0.1665 -0.1665 2.7306 2.7306 2.7585 2.7585 2.9458 2.9458 2.9977 2.9977 5.3481 5.3481 5.3545 5.3545 5.5661 5.5661 5.6024 5.6024 5.9573 5.9573 6.0195 6.0195 6.4992 6.4992 6.5072 6.5072 6.7738 6.7738 6.8110 6.8110 7.3060 7.3060 7.3219 7.3219 7.6380 7.6380 7.6810 7.6810 7.8149 7.8149 7.8479 7.8479 8.2483 8.2483 8.2573 8.2573 8.5583 8.5583 8.5784 8.5784 8.8618 8.8618 8.8835 8.8835 9.2715 9.2715 9.2762 9.2762 9.7531 9.7531 9.8377 9.8377 10.2469 10.2469 10.3112 10.3112 11.0759 11.0759 11.1389 11.1389 11.2059 11.2059 11.3262 11.3262 13.9622 13.9622 14.0501 14.0501 14.4095 14.4095 14.4706 14.4706 15.0005 15.0005 15.1335 15.1335 16.4826 16.4826 16.5251 16.5251 k = 0.0000 0.5000-0.0000 ( 5542 PWs) bands (ev): -1.4877 -1.4877 -1.4877 -1.4877 -0.1659 -0.1659 -0.1659 -0.1659 2.7443 2.7443 2.7443 2.7443 2.9696 2.9696 2.9696 2.9696 5.3502 5.3502 5.3502 5.3502 5.5829 5.5829 5.5829 5.5829 5.9878 5.9878 5.9878 5.9878 6.5033 6.5033 6.5033 6.5033 6.7914 6.7914 6.7914 6.7914 7.3146 7.3146 7.3146 7.3146 7.6605 7.6605 7.6605 7.6605 7.8308 7.8308 7.8308 7.8308 8.2528 8.2528 8.2528 8.2528 8.5706 8.5706 8.5706 8.5706 8.8720 8.8720 8.8720 8.8720 9.2738 9.2738 9.2738 9.2738 9.7974 9.7974 9.7974 9.7974 10.2809 10.2809 10.2809 10.2809 11.1387 11.1387 11.1387 11.1387 11.2405 11.2405 11.2405 11.2405 14.0036 14.0036 14.0036 14.0036 14.4497 14.4497 14.4497 14.4497 15.0587 15.0587 15.0587 15.0587 16.5035 16.5035 16.5035 16.5035 k = 0.0000 0.5000-0.0000 ( 5542 PWs) bands (ev): -1.4877 -1.4877 -1.4877 -1.4877 -0.1659 -0.1659 -0.1659 -0.1659 2.7443 2.7443 2.7443 2.7443 2.9696 2.9696 2.9696 2.9696 5.3502 5.3502 5.3502 5.3502 5.5829 5.5829 5.5829 5.5829 5.9878 5.9878 5.9878 5.9878 6.5033 6.5033 6.5033 6.5033 6.7914 6.7914 6.7914 6.7914 7.3146 7.3146 7.3146 7.3146 7.6605 7.6605 7.6605 7.6605 7.8308 7.8308 7.8308 7.8308 8.2528 8.2528 8.2528 8.2528 8.5706 8.5706 8.5706 8.5706 8.8720 8.8720 8.8720 8.8720 9.2738 9.2738 9.2738 9.2738 9.7974 9.7974 9.7974 9.7974 10.2809 10.2809 10.2809 10.2809 11.1387 11.1387 11.1387 11.1387 11.2405 11.2405 11.2405 11.2405 14.0036 14.0036 14.0036 14.0036 14.4497 14.4497 14.4497 14.4497 15.0587 15.0587 15.0587 15.0587 16.5035 16.5035 16.5035 16.5035 k = 0.0179 0.5000-0.0000 ( 5518 PWs) bands (ev): -1.4865 -1.4865 -1.4865 -1.4865 -0.1662 -0.1662 -0.1662 -0.1662 2.7436 2.7436 2.7436 2.7436 2.9660 2.9660 2.9660 2.9660 5.3531 5.3531 5.3531 5.3531 5.5830 5.5830 5.5830 5.5830 5.9844 5.9844 5.9844 5.9844 6.5025 6.5025 6.5025 6.5025 6.7931 6.7931 6.7931 6.7931 7.3131 7.3131 7.3131 7.3131 7.6605 7.6605 7.6605 7.6605 7.8313 7.8313 7.8313 7.8313 8.2532 8.2532 8.2532 8.2532 8.5725 8.5725 8.5725 8.5725 8.8738 8.8738 8.8738 8.8738 9.2745 9.2745 9.2745 9.2745 9.7998 9.7998 9.7998 9.7998 10.2835 10.2835 10.2835 10.2835 11.1383 11.1383 11.1383 11.1383 11.2404 11.2404 11.2404 11.2404 14.0032 14.0032 14.0032 14.0032 14.4480 14.4480 14.4480 14.4480 15.0598 15.0598 15.0598 15.0598 16.4964 16.4964 16.4964 16.4964 k = 0.0357 0.5000-0.0000 ( 5514 PWs) bands (ev): -1.4828 -1.4828 -1.4828 -1.4828 -0.1670 -0.1670 -0.1670 -0.1670 2.7415 2.7415 2.7415 2.7415 2.9555 2.9555 2.9555 2.9555 5.3617 5.3617 5.3617 5.3617 5.5833 5.5833 5.5833 5.5833 5.9744 5.9744 5.9744 5.9744 6.4996 6.4996 6.4996 6.4996 6.7984 6.7984 6.7984 6.7984 7.3088 7.3088 7.3088 7.3088 7.6603 7.6603 7.6603 7.6603 7.8326 7.8326 7.8326 7.8326 8.2544 8.2544 8.2544 8.2544 8.5777 8.5777 8.5777 8.5777 8.8792 8.8792 8.8792 8.8792 9.2764 9.2764 9.2764 9.2764 9.8066 9.8066 9.8066 9.8066 10.2911 10.2911 10.2911 10.2911 11.1373 11.1373 11.1373 11.1373 11.2404 11.2404 11.2404 11.2404 14.0019 14.0019 14.0019 14.0019 14.4429 14.4429 14.4429 14.4429 15.0631 15.0631 15.0631 15.0631 16.4753 16.4753 16.4753 16.4753 k = 0.0536 0.5000-0.0000 ( 5524 PWs) bands (ev): -1.4768 -1.4768 -1.4768 -1.4768 -0.1684 -0.1684 -0.1684 -0.1684 2.7380 2.7380 2.7380 2.7380 2.9384 2.9384 2.9384 2.9384 5.3753 5.3753 5.3753 5.3753 5.5841 5.5841 5.5841 5.5841 5.9585 5.9585 5.9585 5.9585 6.4934 6.4934 6.4934 6.4934 6.8080 6.8080 6.8080 6.8080 7.3019 7.3019 7.3019 7.3019 7.6598 7.6598 7.6598 7.6598 7.8352 7.8352 7.8352 7.8352 8.2568 8.2568 8.2568 8.2568 8.5854 8.5854 8.5854 8.5854 8.8881 8.8881 8.8881 8.8881 9.2798 9.2798 9.2798 9.2798 9.8176 9.8176 9.8176 9.8176 10.3033 10.3033 10.3033 10.3033 11.1355 11.1355 11.1355 11.1355 11.2414 11.2414 11.2414 11.2414 13.9998 13.9998 13.9998 13.9998 14.4347 14.4347 14.4347 14.4347 15.0681 15.0681 15.0681 15.0681 16.4413 16.4413 16.4413 16.4413 k = 0.0714 0.5000-0.0000 ( 5522 PWs) bands (ev): -1.4684 -1.4684 -1.4684 -1.4684 -0.1704 -0.1704 -0.1704 -0.1704 2.7330 2.7330 2.7330 2.7330 2.9155 2.9155 2.9155 2.9155 5.3929 5.3929 5.3929 5.3929 5.5855 5.5855 5.5855 5.5855 5.9378 5.9378 5.9378 5.9378 6.4825 6.4825 6.4825 6.4825 6.8228 6.8228 6.8228 6.8228 7.2934 7.2934 7.2934 7.2934 7.6588 7.6588 7.6588 7.6588 7.8395 7.8395 7.8395 7.8395 8.2605 8.2605 8.2605 8.2605 8.5946 8.5946 8.5946 8.5946 8.9004 8.9004 8.9004 8.9004 9.2845 9.2845 9.2845 9.2845 9.8322 9.8322 9.8322 9.8322 10.3194 10.3194 10.3194 10.3194 11.1325 11.1325 11.1325 11.1325 11.2445 11.2445 11.2445 11.2445 13.9967 13.9967 13.9967 13.9967 14.4238 14.4238 14.4238 14.4238 15.0746 15.0746 15.0746 15.0746 16.3959 16.3959 16.3959 16.3959 k = 0.0893 0.5000-0.0000 ( 5518 PWs) bands (ev): -1.4576 -1.4576 -1.4576 -1.4576 -0.1731 -0.1731 -0.1731 -0.1731 2.7264 2.7264 2.7264 2.7264 2.8877 2.8877 2.8877 2.8877 5.4129 5.4129 5.4129 5.4129 5.5881 5.5881 5.5881 5.5881 5.9133 5.9133 5.9133 5.9133 6.4658 6.4658 6.4658 6.4658 6.8432 6.8432 6.8432 6.8432 7.2838 7.2838 7.2838 7.2838 7.6572 7.6572 7.6572 7.6572 7.8459 7.8459 7.8459 7.8459 8.2658 8.2658 8.2658 8.2658 8.6041 8.6041 8.6041 8.6041 8.9160 8.9160 8.9160 8.9160 9.2908 9.2908 9.2908 9.2908 9.8498 9.8498 9.8498 9.8498 10.3382 10.3382 10.3382 10.3382 11.1281 11.1281 11.1281 11.1281 11.2517 11.2517 11.2517 11.2517 13.9926 13.9926 13.9926 13.9926 14.4109 14.4109 14.4109 14.4109 15.0821 15.0821 15.0821 15.0821 16.3409 16.3409 16.3409 16.3409 k = 0.1071 0.5000-0.0000 ( 5510 PWs) bands (ev): -1.4445 -1.4445 -1.4445 -1.4445 -0.1767 -0.1767 -0.1767 -0.1767 2.7179 2.7179 2.7179 2.7179 2.8560 2.8560 2.8560 2.8560 5.4335 5.4335 5.4335 5.4335 5.5927 5.5927 5.5927 5.5927 5.8862 5.8862 5.8862 5.8862 6.4432 6.4432 6.4432 6.4432 6.8691 6.8691 6.8691 6.8691 7.2739 7.2739 7.2739 7.2739 7.6549 7.6549 7.6549 7.6549 7.8546 7.8546 7.8546 7.8546 8.2729 8.2729 8.2729 8.2729 8.6131 8.6131 8.6131 8.6131 8.9344 8.9344 8.9344 8.9344 9.2985 9.2985 9.2985 9.2985 9.8696 9.8696 9.8696 9.8696 10.3582 10.3582 10.3582 10.3582 11.1220 11.1220 11.1220 11.1220 11.2648 11.2648 11.2648 11.2648 13.9875 13.9875 13.9875 13.9875 14.3965 14.3965 14.3965 14.3965 15.0899 15.0899 15.0899 15.0899 16.2782 16.2782 16.2782 16.2782 k = 0.1250 0.5000-0.0000 ( 5514 PWs) bands (ev): -1.4290 -1.4290 -1.4290 -1.4290 -0.1813 -0.1813 -0.1813 -0.1813 2.7070 2.7070 2.7070 2.7070 2.8220 2.8220 2.8220 2.8220 5.4522 5.4522 5.4522 5.4522 5.6004 5.6004 5.6004 5.6004 5.8574 5.8574 5.8574 5.8574 6.4152 6.4152 6.4152 6.4152 6.8999 6.8999 6.8999 6.8999 7.2645 7.2645 7.2645 7.2645 7.6521 7.6521 7.6521 7.6521 7.8657 7.8657 7.8657 7.8657 8.2819 8.2819 8.2819 8.2819 8.6209 8.6209 8.6209 8.6209 8.9552 8.9552 8.9552 8.9552 9.3078 9.3078 9.3078 9.3078 9.8908 9.8908 9.8908 9.8908 10.3775 10.3775 10.3775 10.3775 11.1147 11.1147 11.1147 11.1147 11.2856 11.2856 11.2856 11.2856 13.9811 13.9811 13.9811 13.9811 14.3813 14.3813 14.3813 14.3813 15.0977 15.0977 15.0977 15.0977 16.2093 16.2093 16.2093 16.2093 k = 0.1429 0.5000-0.0000 ( 5520 PWs) bands (ev): -1.4112 -1.4112 -1.4112 -1.4112 -0.1869 -0.1869 -0.1869 -0.1869 2.6929 2.6929 2.6929 2.6929 2.7874 2.7874 2.7874 2.7874 5.4668 5.4668 5.4668 5.4668 5.6118 5.6118 5.6118 5.6118 5.8279 5.8279 5.8279 5.8279 6.3828 6.3828 6.3828 6.3828 6.9346 6.9346 6.9346 6.9346 7.2563 7.2563 7.2563 7.2563 7.6490 7.6490 7.6490 7.6490 7.8791 7.8791 7.8791 7.8791 8.2927 8.2927 8.2927 8.2927 8.6273 8.6273 8.6273 8.6273 8.9779 8.9779 8.9779 8.9779 9.3185 9.3185 9.3185 9.3185 9.9125 9.9125 9.9125 9.9125 10.3944 10.3944 10.3944 10.3944 11.1067 11.1067 11.1067 11.1067 11.3155 11.3155 11.3155 11.3155 13.9736 13.9736 13.9736 13.9736 14.3659 14.3659 14.3659 14.3659 15.1048 15.1048 15.1048 15.1048 16.1358 16.1358 16.1358 16.1358 k = 0.1607 0.5000-0.0000 ( 5516 PWs) bands (ev): -1.3913 -1.3913 -1.3913 -1.3913 -0.1938 -0.1938 -0.1938 -0.1938 2.6741 2.6741 2.6741 2.6741 2.7547 2.7547 2.7547 2.7547 5.4758 5.4758 5.4758 5.4758 5.6268 5.6268 5.6268 5.6268 5.7992 5.7992 5.7992 5.7992 6.3472 6.3472 6.3472 6.3472 6.9720 6.9720 6.9720 6.9720 7.2499 7.2499 7.2499 7.2499 7.6458 7.6458 7.6458 7.6458 7.8946 7.8946 7.8946 7.8946 8.3051 8.3051 8.3051 8.3051 8.6322 8.6322 8.6322 8.6322 9.0019 9.0019 9.0019 9.0019 9.3306 9.3306 9.3306 9.3306 9.9338 9.9338 9.9338 9.9338 10.4072 10.4072 10.4072 10.4072 11.0990 11.0990 11.0990 11.0990 11.3554 11.3554 11.3554 11.3554 13.9649 13.9649 13.9649 13.9649 14.3508 14.3508 14.3508 14.3508 15.1108 15.1108 15.1108 15.1108 16.0589 16.0589 16.0589 16.0589 k = 0.1786 0.5000-0.0000 ( 5516 PWs) bands (ev): -1.3691 -1.3691 -1.3691 -1.3691 -0.2021 -0.2021 -0.2021 -0.2021 2.6491 2.6491 2.6491 2.6491 2.7263 2.7263 2.7263 2.7263 5.4792 5.4792 5.4792 5.4792 5.6427 5.6427 5.6427 5.6427 5.7732 5.7732 5.7732 5.7732 6.3097 6.3097 6.3097 6.3097 7.0108 7.0108 7.0108 7.0108 7.2461 7.2461 7.2461 7.2461 7.6431 7.6431 7.6431 7.6431 7.9120 7.9120 7.9120 7.9120 8.3190 8.3190 8.3190 8.3190 8.6358 8.6358 8.6358 8.6358 9.0269 9.0269 9.0269 9.0269 9.3439 9.3439 9.3439 9.3439 9.9541 9.9541 9.9541 9.9541 10.4144 10.4144 10.4144 10.4144 11.0929 11.0929 11.0929 11.0929 11.4053 11.4053 11.4053 11.4053 13.9548 13.9548 13.9548 13.9548 14.3367 14.3367 14.3367 14.3367 15.1152 15.1152 15.1152 15.1152 15.9798 15.9798 15.9798 15.9798 k = 0.1964 0.5000-0.0000 ( 5520 PWs) bands (ev): -1.3447 -1.3447 -1.3447 -1.3447 -0.2119 -0.2119 -0.2119 -0.2119 2.6181 2.6181 2.6181 2.6181 2.7028 2.7028 2.7028 2.7028 5.4778 5.4778 5.4778 5.4778 5.6539 5.6539 5.6539 5.6539 5.7542 5.7542 5.7542 5.7542 6.2716 6.2716 6.2716 6.2716 7.0492 7.0492 7.0492 7.0492 7.2459 7.2459 7.2459 7.2459 7.6412 7.6412 7.6412 7.6412 7.9310 7.9310 7.9310 7.9310 8.3341 8.3341 8.3341 8.3341 8.6380 8.6380 8.6380 8.6380 9.0526 9.0526 9.0526 9.0526 9.3581 9.3581 9.3581 9.3581 9.9723 9.9723 9.9723 9.9723 10.4155 10.4155 10.4155 10.4155 11.0895 11.0895 11.0895 11.0895 11.4648 11.4648 11.4648 11.4648 13.9437 13.9437 13.9437 13.9437 14.3239 14.3239 14.3239 14.3239 15.1177 15.1177 15.1177 15.1177 15.8994 15.8994 15.8994 15.8994 k = 0.2143 0.5000-0.0000 ( 5516 PWs) bands (ev): -1.3183 -1.3183 -1.3183 -1.3183 -0.2236 -0.2236 -0.2236 -0.2236 2.5836 2.5836 2.5836 2.5836 2.6825 2.6825 2.6825 2.6825 5.4726 5.4726 5.4726 5.4726 5.6523 5.6523 5.6523 5.6523 5.7490 5.7490 5.7490 5.7490 6.2340 6.2340 6.2340 6.2340 7.0843 7.0843 7.0843 7.0843 7.2510 7.2510 7.2510 7.2510 7.6410 7.6410 7.6410 7.6410 7.9512 7.9512 7.9512 7.9512 8.3501 8.3501 8.3501 8.3501 8.6391 8.6391 8.6391 8.6391 9.0786 9.0786 9.0786 9.0786 9.3731 9.3731 9.3731 9.3731 9.9878 9.9878 9.9878 9.9878 10.4102 10.4102 10.4102 10.4102 11.0902 11.0902 11.0902 11.0902 11.5324 11.5324 11.5324 11.5324 13.9317 13.9317 13.9317 13.9317 14.3130 14.3130 14.3130 14.3130 15.1179 15.1179 15.1179 15.1179 15.8186 15.8186 15.8186 15.8186 k = 0.2321 0.5000-0.0000 ( 5524 PWs) bands (ev): -1.2899 -1.2899 -1.2899 -1.2899 -0.2372 -0.2372 -0.2372 -0.2372 2.5482 2.5482 2.5482 2.5482 2.6637 2.6637 2.6637 2.6637 5.4644 5.4644 5.4644 5.4644 5.6367 5.6367 5.6367 5.6367 5.7575 5.7575 5.7575 5.7575 6.1982 6.1982 6.1982 6.1982 7.1132 7.1132 7.1132 7.1132 7.2632 7.2632 7.2632 7.2632 7.6433 7.6433 7.6433 7.6433 7.9724 7.9724 7.9724 7.9724 8.3665 8.3665 8.3665 8.3665 8.6393 8.6393 8.6393 8.6393 9.1048 9.1048 9.1048 9.1048 9.3886 9.3886 9.3886 9.3886 9.9999 9.9999 9.9999 9.9999 10.3989 10.3989 10.3989 10.3989 11.0962 11.0962 11.0962 11.0962 11.6062 11.6062 11.6062 11.6062 13.9191 13.9191 13.9191 13.9191 14.3044 14.3044 14.3044 14.3044 15.1154 15.1154 15.1154 15.1154 15.7382 15.7382 15.7382 15.7382 k = 0.2500 0.5000-0.0000 ( 5492 PWs) bands (ev): -1.2596 -1.2596 -1.2596 -1.2596 -0.2528 -0.2528 -0.2528 -0.2528 2.5136 2.5136 2.5136 2.5136 2.6452 2.6452 2.6452 2.6452 5.4537 5.4537 5.4537 5.4537 5.6143 5.6143 5.6143 5.6143 5.7719 5.7719 5.7719 5.7719 6.1650 6.1650 6.1650 6.1650 7.1337 7.1337 7.1337 7.1337 7.2830 7.2830 7.2830 7.2830 7.6493 7.6493 7.6493 7.6493 7.9944 7.9944 7.9944 7.9944 8.3830 8.3830 8.3830 8.3830 8.6387 8.6387 8.6387 8.6387 9.1311 9.1311 9.1311 9.1311 9.4041 9.4041 9.4041 9.4041 10.0082 10.0082 10.0082 10.0082 10.3822 10.3822 10.3822 10.3822 11.1083 11.1083 11.1083 11.1083 11.6839 11.6839 11.6839 11.6839 13.9068 13.9068 13.9068 13.9068 14.2983 14.2983 14.2983 14.2983 15.1099 15.1099 15.1099 15.1099 15.6589 15.6589 15.6589 15.6589 k = 0.2679 0.5000-0.0000 ( 5516 PWs) bands (ev): -1.2274 -1.2274 -1.2274 -1.2274 -0.2707 -0.2707 -0.2707 -0.2707 2.4809 2.4809 2.4809 2.4809 2.6264 2.6264 2.6264 2.6264 5.4409 5.4409 5.4409 5.4409 5.5897 5.5897 5.5897 5.5897 5.7870 5.7870 5.7870 5.7870 6.1351 6.1351 6.1351 6.1351 7.1465 7.1465 7.1465 7.1465 7.3079 7.3079 7.3079 7.3079 7.6605 7.6605 7.6605 7.6605 8.0167 8.0167 8.0167 8.0167 8.3992 8.3992 8.3992 8.3992 8.6375 8.6375 8.6375 8.6375 9.1574 9.1574 9.1574 9.1574 9.4195 9.4195 9.4195 9.4195 10.0124 10.0124 10.0124 10.0124 10.3608 10.3608 10.3608 10.3608 11.1275 11.1275 11.1275 11.1275 11.7627 11.7627 11.7627 11.7627 13.8955 13.8955 13.8955 13.8955 14.2950 14.2950 14.2950 14.2950 15.1010 15.1010 15.1010 15.1010 15.5812 15.5812 15.5812 15.5812 k = 0.2857 0.5000-0.0000 ( 5508 PWs) bands (ev): -1.1935 -1.1935 -1.1935 -1.1935 -0.2909 -0.2909 -0.2909 -0.2909 2.4509 2.4509 2.4509 2.4509 2.6071 2.6071 2.6071 2.6071 5.4267 5.4267 5.4267 5.4267 5.5648 5.5648 5.5648 5.5648 5.8006 5.8006 5.8006 5.8006 6.1090 6.1090 6.1090 6.1090 7.1542 7.1542 7.1542 7.1542 7.3333 7.3333 7.3333 7.3333 7.6781 7.6781 7.6781 7.6781 8.0392 8.0392 8.0392 8.0392 8.4148 8.4148 8.4148 8.4148 8.6358 8.6358 8.6358 8.6358 9.1836 9.1836 9.1836 9.1836 9.4342 9.4342 9.4342 9.4342 10.0125 10.0125 10.0125 10.0125 10.3355 10.3355 10.3355 10.3355 11.1541 11.1541 11.1541 11.1541 11.8399 11.8399 11.8399 11.8399 13.8866 13.8866 13.8866 13.8866 14.2947 14.2947 14.2947 14.2947 15.0884 15.0884 15.0884 15.0884 15.5056 15.5056 15.5056 15.5056 k = 0.3036 0.5000-0.0000 ( 5504 PWs) bands (ev): -1.1579 -1.1579 -1.1579 -1.1579 -0.3134 -0.3134 -0.3134 -0.3134 2.4242 2.4242 2.4242 2.4242 2.5873 2.5873 2.5873 2.5873 5.4115 5.4115 5.4115 5.4115 5.5405 5.5405 5.5405 5.5405 5.8119 5.8119 5.8119 5.8119 6.0871 6.0871 6.0871 6.0871 7.1591 7.1591 7.1591 7.1591 7.3554 7.3554 7.3554 7.3554 7.7031 7.7031 7.7031 7.7031 8.0615 8.0615 8.0615 8.0615 8.4294 8.4294 8.4294 8.4294 8.6337 8.6337 8.6337 8.6337 9.2096 9.2096 9.2096 9.2096 9.4481 9.4481 9.4481 9.4481 10.0090 10.0090 10.0090 10.0090 10.3072 10.3072 10.3072 10.3072 11.1884 11.1884 11.1884 11.1884 11.9123 11.9123 11.9123 11.9123 13.8816 13.8816 13.8816 13.8816 14.2973 14.2973 14.2973 14.2973 15.0720 15.0720 15.0720 15.0720 15.4324 15.4324 15.4324 15.4324 k = 0.3214 0.5000-0.0000 ( 5506 PWs) bands (ev): -1.1208 -1.1208 -1.1208 -1.1208 -0.3384 -0.3384 -0.3384 -0.3384 2.4010 2.4010 2.4010 2.4010 2.5671 2.5671 2.5671 2.5671 5.3957 5.3957 5.3957 5.3957 5.5171 5.5171 5.5171 5.5171 5.8206 5.8206 5.8206 5.8206 6.0694 6.0694 6.0694 6.0694 7.1625 7.1625 7.1625 7.1625 7.3723 7.3723 7.3723 7.3723 7.7353 7.7353 7.7353 7.7353 8.0833 8.0833 8.0833 8.0833 8.4427 8.4427 8.4427 8.4427 8.6311 8.6311 8.6311 8.6311 9.2353 9.2353 9.2353 9.2353 9.4607 9.4607 9.4607 9.4607 10.0026 10.0026 10.0026 10.0026 10.2766 10.2766 10.2766 10.2766 11.2299 11.2299 11.2299 11.2299 11.9770 11.9770 11.9770 11.9770 13.8822 13.8822 13.8822 13.8822 14.3029 14.3029 14.3029 14.3029 15.0514 15.0514 15.0514 15.0514 15.3619 15.3619 15.3619 15.3619 k = 0.3393 0.5000-0.0000 ( 5514 PWs) bands (ev): -1.0823 -1.0823 -1.0823 -1.0823 -0.3658 -0.3658 -0.3658 -0.3658 2.3817 2.3817 2.3817 2.3817 2.5464 2.5464 2.5464 2.5464 5.3799 5.3799 5.3799 5.3799 5.4950 5.4950 5.4950 5.4950 5.8268 5.8268 5.8268 5.8268 6.0555 6.0555 6.0555 6.0555 7.1652 7.1652 7.1652 7.1652 7.3839 7.3839 7.3839 7.3839 7.7734 7.7734 7.7734 7.7734 8.1043 8.1043 8.1043 8.1043 8.4548 8.4548 8.4548 8.4548 8.6281 8.6281 8.6281 8.6281 9.2606 9.2606 9.2606 9.2606 9.4717 9.4717 9.4717 9.4717 9.9940 9.9940 9.9940 9.9940 10.2445 10.2445 10.2445 10.2445 11.2783 11.2783 11.2783 11.2783 12.0309 12.0309 12.0309 12.0309 13.8903 13.8903 13.8903 13.8903 14.3111 14.3111 14.3111 14.3111 15.0268 15.0268 15.0268 15.0268 15.2943 15.2943 15.2943 15.2943 k = 0.3571 0.5000-0.0000 ( 5506 PWs) bands (ev): -1.0425 -1.0425 -1.0425 -1.0425 -0.3956 -0.3956 -0.3956 -0.3956 2.3662 2.3662 2.3662 2.3662 2.5254 2.5254 2.5254 2.5254 5.3646 5.3646 5.3646 5.3646 5.4743 5.4743 5.4743 5.4743 5.8308 5.8308 5.8308 5.8308 6.0451 6.0451 6.0451 6.0451 7.1675 7.1675 7.1675 7.1675 7.3909 7.3909 7.3909 7.3909 7.8155 7.8155 7.8155 7.8155 8.1240 8.1240 8.1240 8.1240 8.4656 8.4656 8.4656 8.4656 8.6245 8.6245 8.6245 8.6245 9.2852 9.2852 9.2852 9.2852 9.4807 9.4807 9.4807 9.4807 9.9845 9.9845 9.9845 9.9845 10.2115 10.2115 10.2115 10.2115 11.3330 11.3330 11.3330 11.3330 12.0716 12.0716 12.0716 12.0716 13.9074 13.9074 13.9074 13.9074 14.3217 14.3217 14.3217 14.3217 14.9985 14.9985 14.9985 14.9985 15.2295 15.2295 15.2295 15.2295 k = 0.3750 0.5000-0.0000 ( 5514 PWs) bands (ev): -1.0017 -1.0017 -1.0017 -1.0017 -0.4276 -0.4276 -0.4276 -0.4276 2.3548 2.3548 2.3548 2.3548 2.5044 2.5044 2.5044 2.5044 5.3501 5.3501 5.3501 5.3501 5.4553 5.4553 5.4553 5.4553 5.8332 5.8332 5.8332 5.8332 6.0375 6.0375 6.0375 6.0375 7.1696 7.1696 7.1696 7.1696 7.3946 7.3946 7.3946 7.3946 7.8593 7.8593 7.8593 7.8593 8.1421 8.1421 8.1421 8.1421 8.4753 8.4753 8.4753 8.4753 8.6202 8.6202 8.6202 8.6202 9.3092 9.3092 9.3092 9.3092 9.4874 9.4874 9.4874 9.4874 9.9751 9.9751 9.9751 9.9751 10.1785 10.1785 10.1785 10.1785 11.3929 11.3929 11.3929 11.3929 12.0973 12.0973 12.0973 12.0973 13.9345 13.9345 13.9345 13.9345 14.3338 14.3338 14.3338 14.3338 14.9670 14.9670 14.9670 14.9670 15.1674 15.1674 15.1674 15.1674 k = 0.3929 0.5000-0.0000 ( 5506 PWs) bands (ev): -0.9599 -0.9599 -0.9599 -0.9599 -0.4617 -0.4617 -0.4617 -0.4617 2.3473 2.3473 2.3473 2.3473 2.4835 2.4835 2.4835 2.4835 5.3368 5.3368 5.3368 5.3368 5.4383 5.4383 5.4383 5.4383 5.8344 5.8344 5.8344 5.8344 6.0321 6.0321 6.0321 6.0321 7.1717 7.1717 7.1717 7.1717 7.3959 7.3959 7.3959 7.3959 7.9028 7.9028 7.9028 7.9028 8.1582 8.1582 8.1582 8.1582 8.4842 8.4842 8.4842 8.4842 8.6149 8.6149 8.6149 8.6149 9.3322 9.3322 9.3322 9.3322 9.4915 9.4915 9.4915 9.4915 9.9670 9.9670 9.9670 9.9670 10.1459 10.1459 10.1459 10.1459 11.4573 11.4573 11.4573 11.4573 12.1069 12.1069 12.1069 12.1069 13.9717 13.9717 13.9717 13.9717 14.3465 14.3465 14.3465 14.3465 14.9337 14.9337 14.9337 14.9337 15.1081 15.1081 15.1081 15.1081 k = 0.4107 0.5000-0.0000 ( 5512 PWs) bands (ev): -0.9174 -0.9174 -0.9174 -0.9174 -0.4978 -0.4978 -0.4978 -0.4978 2.3436 2.3436 2.3436 2.3436 2.4630 2.4630 2.4630 2.4630 5.3251 5.3251 5.3251 5.3251 5.4235 5.4235 5.4235 5.4235 5.8347 5.8347 5.8347 5.8347 6.0283 6.0283 6.0283 6.0283 7.1735 7.1735 7.1735 7.1735 7.3957 7.3957 7.3957 7.3957 7.9442 7.9442 7.9442 7.9442 8.1717 8.1717 8.1717 8.1717 8.4929 8.4929 8.4929 8.4929 8.6084 8.6084 8.6084 8.6084 9.3542 9.3542 9.3542 9.3542 9.4927 9.4927 9.4927 9.4927 9.9612 9.9612 9.9612 9.9612 10.1144 10.1144 10.1144 10.1144 11.5249 11.5249 11.5249 11.5249 12.1008 12.1008 12.1008 12.1008 14.0180 14.0180 14.0180 14.0180 14.3580 14.3580 14.3580 14.3580 14.9003 14.9003 14.9003 14.9003 15.0515 15.0515 15.0515 15.0515 k = 0.4286 0.5000-0.0000 ( 5512 PWs) bands (ev): -0.8743 -0.8743 -0.8743 -0.8743 -0.5357 -0.5357 -0.5357 -0.5357 2.3435 2.3435 2.3435 2.3435 2.4431 2.4431 2.4431 2.4431 5.3152 5.3152 5.3152 5.3152 5.4111 5.4111 5.4111 5.4111 5.8347 5.8347 5.8347 5.8347 6.0258 6.0258 6.0258 6.0258 7.1752 7.1752 7.1752 7.1752 7.3948 7.3948 7.3948 7.3948 7.9816 7.9816 7.9816 7.9816 8.1823 8.1823 8.1823 8.1823 8.5016 8.5016 8.5016 8.5016 8.6007 8.6007 8.6007 8.6007 9.3749 9.3749 9.3749 9.3749 9.4910 9.4910 9.4910 9.4910 9.9586 9.9586 9.9586 9.9586 10.0846 10.0846 10.0846 10.0846 11.5946 11.5946 11.5946 11.5946 12.0800 12.0800 12.0800 12.0800 14.0715 14.0715 14.0715 14.0715 14.3658 14.3658 14.3658 14.3658 14.8695 14.8695 14.8695 14.8695 14.9981 14.9981 14.9981 14.9981 k = 0.4464 0.5000-0.0000 ( 5496 PWs) bands (ev): -0.8308 -0.8308 -0.8308 -0.8308 -0.5751 -0.5751 -0.5751 -0.5751 2.3468 2.3468 2.3468 2.3468 2.4243 2.4243 2.4243 2.4243 5.3073 5.3073 5.3073 5.3073 5.4013 5.4013 5.4013 5.4013 5.8345 5.8345 5.8345 5.8345 6.0241 6.0241 6.0241 6.0241 7.1766 7.1766 7.1766 7.1766 7.3937 7.3937 7.3937 7.3937 8.0134 8.0134 8.0134 8.0134 8.1898 8.1898 8.1898 8.1898 8.5108 8.5108 8.5108 8.5108 8.5918 8.5918 8.5918 8.5918 9.3942 9.3942 9.3942 9.3942 9.4865 9.4865 9.4865 9.4865 9.9599 9.9599 9.9599 9.9599 10.0570 10.0570 10.0570 10.0570 11.6650 11.6650 11.6650 11.6650 12.0465 12.0465 12.0465 12.0465 14.1294 14.1294 14.1294 14.1294 14.3665 14.3665 14.3665 14.3665 14.8450 14.8450 14.8450 14.8450 14.9489 14.9489 14.9489 14.9489 k = 0.4643 0.5000-0.0000 ( 5500 PWs) bands (ev): -0.7872 -0.7872 -0.7872 -0.7872 -0.6159 -0.6159 -0.6159 -0.6159 2.3531 2.3531 2.3531 2.3531 2.4069 2.4069 2.4069 2.4069 5.3015 5.3015 5.3015 5.3015 5.3942 5.3942 5.3942 5.3942 5.8342 5.8342 5.8342 5.8342 6.0230 6.0230 6.0230 6.0230 7.1777 7.1777 7.1777 7.1777 7.3926 7.3926 7.3926 7.3926 8.0380 8.0380 8.0380 8.0380 8.1945 8.1945 8.1945 8.1945 8.5200 8.5200 8.5200 8.5200 8.5825 8.5825 8.5825 8.5825 9.4114 9.4114 9.4114 9.4114 9.4798 9.4798 9.4798 9.4798 9.9654 9.9654 9.9654 9.9654 10.0323 10.0323 10.0323 10.0323 11.7340 11.7340 11.7340 11.7340 12.0030 12.0030 12.0030 12.0030 14.1881 14.1881 14.1881 14.1881 14.3564 14.3564 14.3564 14.3564 14.8307 14.8307 14.8307 14.8307 14.9051 14.9051 14.9051 14.9051 k = 0.4821 0.5000-0.0000 ( 5492 PWs) bands (ev): -0.7437 -0.7437 -0.7437 -0.7437 -0.6576 -0.6576 -0.6576 -0.6576 2.3617 2.3617 2.3617 2.3617 2.3916 2.3916 2.3916 2.3916 5.2980 5.2980 5.2980 5.2980 5.3899 5.3899 5.3899 5.3899 5.8340 5.8340 5.8340 5.8340 6.0224 6.0224 6.0224 6.0224 7.1783 7.1783 7.1783 7.1783 7.3919 7.3919 7.3919 7.3919 8.0537 8.0537 8.0537 8.0537 8.1967 8.1967 8.1967 8.1967 8.5281 8.5281 8.5281 8.5281 8.5742 8.5742 8.5742 8.5742 9.4252 9.4252 9.4252 9.4252 9.4722 9.4722 9.4722 9.4722 9.9745 9.9745 9.9745 9.9745 10.0113 10.0113 10.0113 10.0113 11.7973 11.7973 11.7973 11.7973 11.9548 11.9548 11.9548 11.9548 14.2434 14.2434 14.2434 14.2434 14.3331 14.3331 14.3331 14.3331 14.8297 14.8297 14.8297 14.8297 14.8690 14.8690 14.8690 14.8690 k = 0.5000 0.5000-0.0000 ( 5472 PWs) bands (ev): -0.7036 -0.7036 -0.7036 -0.7036 -0.6971 -0.6971 -0.6971 -0.6971 2.3684 2.3684 2.3684 2.3684 2.3827 2.3827 2.3827 2.3827 5.2968 5.2968 5.2968 5.2968 5.3884 5.3884 5.3884 5.3884 5.8340 5.8340 5.8340 5.8340 6.0222 6.0222 6.0222 6.0222 7.1786 7.1786 7.1786 7.1786 7.3916 7.3916 7.3916 7.3916 8.0592 8.0592 8.0592 8.0592 8.1973 8.1973 8.1973 8.1973 8.5318 8.5318 8.5318 8.5318 8.5705 8.5705 8.5705 8.5705 9.4312 9.4312 9.4312 9.4312 9.4682 9.4682 9.4682 9.4682 9.9825 9.9825 9.9825 9.9825 9.9994 9.9994 9.9994 9.9994 11.8329 11.8329 11.8329 11.8329 11.9241 11.9241 11.9241 11.9241 14.2820 14.2820 14.2820 14.2820 14.3056 14.3056 14.3056 14.3056 14.8417 14.8417 14.8417 14.8417 14.8444 14.8444 14.8444 14.8444 k = 0.5000 0.5000-0.0000 ( 5472 PWs) bands (ev): -0.7036 -0.7036 -0.7036 -0.7036 -0.6971 -0.6971 -0.6971 -0.6971 2.3684 2.3684 2.3684 2.3684 2.3827 2.3827 2.3827 2.3827 5.2968 5.2968 5.2968 5.2968 5.3884 5.3884 5.3884 5.3884 5.8340 5.8340 5.8340 5.8340 6.0222 6.0222 6.0222 6.0222 7.1786 7.1786 7.1786 7.1786 7.3916 7.3916 7.3916 7.3916 8.0592 8.0592 8.0592 8.0592 8.1973 8.1973 8.1973 8.1973 8.5318 8.5318 8.5318 8.5318 8.5705 8.5705 8.5705 8.5705 9.4312 9.4312 9.4312 9.4312 9.4682 9.4682 9.4682 9.4682 9.9825 9.9825 9.9825 9.9825 9.9994 9.9994 9.9994 9.9994 11.8329 11.8329 11.8329 11.8329 11.9241 11.9241 11.9241 11.9241 14.2820 14.2820 14.2820 14.2820 14.3056 14.3056 14.3056 14.3056 14.8417 14.8417 14.8417 14.8417 14.8444 14.8444 14.8444 14.8444 k = 0.4875 0.4875-0.0000 ( 5492 PWs) bands (ev): -0.7618 -0.7618 -0.7000 -0.7000 -0.7000 -0.7000 -0.6409 -0.6409 2.3472 2.3472 2.3686 2.3686 2.3831 2.3831 2.4079 2.4079 5.2807 5.2807 5.3148 5.3148 5.3715 5.3715 5.4072 5.4072 5.8240 5.8240 5.8451 5.8451 6.0107 6.0107 6.0346 6.0346 7.1640 7.1640 7.1930 7.1930 7.3773 7.3773 7.4061 7.4061 8.0424 8.0424 8.0689 8.0689 8.1773 8.1773 8.2137 8.2137 8.5119 8.5119 8.5446 8.5446 8.5653 8.5653 8.5815 8.5815 9.4169 9.4169 9.4356 9.4356 9.4496 9.4496 9.4935 9.4935 9.9629 9.9629 9.9840 9.9840 9.9984 9.9984 10.0260 10.0260 11.7623 11.7623 11.8606 11.8606 11.8857 11.8857 11.9940 11.9940 14.2190 14.2190 14.2806 14.2806 14.3009 14.3009 14.3608 14.3608 14.8173 14.8173 14.8382 14.8382 14.8540 14.8540 14.8824 14.8824 k = 0.4750 0.4750-0.0000 ( 5510 PWs) bands (ev): -0.8244 -0.8244 -0.6990 -0.6990 -0.6985 -0.6985 -0.5840 -0.5840 2.3247 2.3247 2.3610 2.3610 2.3972 2.3972 2.4381 2.4381 5.2665 5.2665 5.3342 5.3342 5.3569 5.3569 5.4276 5.4276 5.8152 5.8152 5.8571 5.8571 6.0005 6.0005 6.0477 6.0477 7.1493 7.1493 7.2070 7.2070 7.3630 7.3630 7.4207 7.4207 8.0194 8.0194 8.0686 8.0686 8.1579 8.1579 8.2247 8.2247 8.4921 8.4921 8.5385 8.5385 8.5741 8.5741 8.5952 8.5952 9.3941 9.3941 9.4215 9.4215 9.4516 9.4516 9.5179 9.5179 9.9451 9.9451 9.9775 9.9775 10.0108 10.0108 10.0605 10.0605 11.6713 11.6713 11.8527 11.8527 11.8670 11.8670 12.0774 12.0774 14.1443 14.1443 14.2594 14.2594 14.3051 14.3051 14.4112 14.4112 14.8028 14.8028 14.8388 14.8388 14.8760 14.8760 14.9330 14.9330 k = 0.4625 0.4625-0.0000 ( 5502 PWs) bands (ev): -0.8882 -0.8882 -0.6972 -0.6972 -0.6963 -0.6963 -0.5297 -0.5297 2.3048 2.3048 2.3564 2.3564 2.4130 2.4130 2.4705 2.4705 5.2545 5.2545 5.3415 5.3415 5.3579 5.3579 5.4495 5.4495 5.8078 5.8078 5.8698 5.8698 5.9917 5.9917 6.0615 6.0615 7.1347 7.1347 7.2207 7.2207 7.3489 7.3489 7.4353 7.4353 7.9889 7.9889 8.0549 8.0549 8.1442 8.1442 8.2304 8.2304 8.4742 8.4742 8.5264 8.5264 8.5823 8.5823 8.6115 8.6115 9.3642 9.3642 9.4085 9.4085 9.4541 9.4541 9.5394 9.5394 9.9335 9.9335 9.9759 9.9759 10.0233 10.0233 10.0994 10.0994 11.5751 11.5751 11.8230 11.8230 11.8530 11.8530 12.1592 12.1592 14.0705 14.0705 14.2330 14.2330 14.3038 14.3038 14.4482 14.4482 14.7948 14.7948 14.8437 14.8437 14.9139 14.9139 14.9937 14.9937 k = 0.4500 0.4500-0.0000 ( 5516 PWs) bands (ev): -0.9529 -0.9529 -0.6945 -0.6945 -0.6933 -0.6933 -0.4786 -0.4786 2.2885 2.2885 2.3540 2.3540 2.4312 2.4312 2.5042 2.5042 5.2447 5.2447 5.3313 5.3313 5.3801 5.3801 5.4727 5.4727 5.8021 5.8021 5.8828 5.8828 5.9847 5.9847 6.0759 6.0759 7.1203 7.1203 7.2338 7.2338 7.3350 7.3350 7.4498 7.4498 7.9494 7.9494 8.0307 8.0307 8.1352 8.1352 8.2320 8.2320 8.4586 8.4586 8.5136 8.5136 8.5866 8.5866 8.6284 8.6284 9.3307 9.3307 9.3966 9.3966 9.4532 9.4532 9.5559 9.5559 9.9288 9.9288 9.9806 9.9806 10.0357 10.0357 10.1414 10.1414 11.4780 11.4780 11.7859 11.7859 11.8290 11.8290 12.2339 12.2339 14.0024 14.0024 14.2015 14.2015 14.2981 14.2981 14.4749 14.4749 14.7892 14.7892 14.8518 14.8518 14.9678 14.9678 15.0628 15.0628 k = 0.4375 0.4375-0.0000 ( 5512 PWs) bands (ev): -1.0181 -1.0181 -0.6911 -0.6911 -0.6896 -0.6896 -0.4310 -0.4310 2.2762 2.2762 2.3538 2.3538 2.4518 2.4518 2.5386 2.5386 5.2372 5.2372 5.3224 5.3224 5.4043 5.4043 5.4968 5.4968 5.7981 5.7981 5.8957 5.8957 5.9802 5.9802 6.0907 6.0907 7.1063 7.1063 7.2461 7.2461 7.3213 7.3213 7.4641 7.4641 7.9006 7.9006 8.0019 8.0019 8.1252 8.1252 8.2312 8.2312 8.4448 8.4448 8.5015 8.5015 8.5877 8.5877 8.6445 8.6445 9.2951 9.2951 9.3838 9.3838 9.4493 9.4493 9.5661 9.5661 9.9299 9.9299 9.9927 9.9927 10.0480 10.0480 10.1858 10.1858 11.3817 11.3817 11.7420 11.7420 11.7948 11.7948 12.2978 12.2978 13.9437 13.9437 14.1658 14.1658 14.2897 14.2897 14.4962 14.4962 14.7843 14.7843 14.8630 14.8630 15.0327 15.0327 15.1394 15.1394 k = 0.4250 0.4250-0.0000 ( 5514 PWs) bands (ev): -1.0835 -1.0835 -0.6868 -0.6868 -0.6850 -0.6850 -0.3874 -0.3874 2.2683 2.2683 2.3556 2.3556 2.4751 2.4751 2.5734 2.5734 5.2321 5.2321 5.3156 5.3156 5.4297 5.4297 5.5217 5.5217 5.7963 5.7963 5.9078 5.9078 5.9789 5.9789 6.1059 6.1059 7.0927 7.0927 7.2571 7.2571 7.3082 7.3082 7.4781 7.4781 7.8442 7.8442 7.9709 7.9709 8.1108 8.1108 8.2299 8.2299 8.4319 8.4319 8.4909 8.4909 8.5859 8.5859 8.6597 8.6597 9.2583 9.2583 9.3687 9.3687 9.4433 9.4433 9.5692 9.5692 9.9350 9.9350 10.0113 10.0113 10.0615 10.0615 10.2321 10.2321 11.2874 11.2874 11.6912 11.6912 11.7508 11.7508 12.3475 12.3475 13.8979 13.8979 14.1269 14.1269 14.2805 14.2805 14.5152 14.5152 14.7805 14.7805 14.8776 14.8776 15.1033 15.1033 15.2219 15.2219 k = 0.4125 0.4125-0.0000 ( 5524 PWs) bands (ev): -1.1488 -1.1488 -0.6819 -0.6819 -0.6798 -0.6798 -0.3479 -0.3479 2.2650 2.2650 2.3595 2.3595 2.5012 2.5012 2.6081 2.6081 5.2294 5.2294 5.3110 5.3110 5.4559 5.4559 5.5468 5.5468 5.7969 5.7969 5.9184 5.9184 5.9814 5.9814 6.1216 6.1216 7.0797 7.0797 7.2649 7.2649 7.2972 7.2972 7.4912 7.4912 7.7830 7.7830 7.9377 7.9377 8.0912 8.0912 8.2286 8.2286 8.4190 8.4190 8.4823 8.4823 8.5817 8.5817 8.6742 8.6742 9.2208 9.2208 9.3505 9.3505 9.4357 9.4357 9.5657 9.5657 9.9426 9.9426 10.0312 10.0312 10.0801 10.0801 10.2797 10.2797 11.1960 11.1960 11.6333 11.6333 11.6979 11.6979 12.3799 12.3799 13.8672 13.8672 14.0861 14.0861 14.2730 14.2730 14.5321 14.5321 14.7794 14.7794 14.8960 14.8960 15.1761 15.1761 15.3090 15.3090 k = 0.4000 0.4000-0.0000 ( 5520 PWs) bands (ev): -1.2138 -1.2138 -0.6762 -0.6762 -0.6739 -0.6739 -0.3130 -0.3130 2.2663 2.2663 2.3653 2.3653 2.5303 2.5303 2.6423 2.6423 5.2293 5.2293 5.3085 5.3085 5.4825 5.4825 5.5717 5.5717 5.8005 5.8005 5.9275 5.9275 5.9882 5.9882 6.1376 6.1376 7.0675 7.0675 7.2638 7.2638 7.2939 7.2939 7.5029 7.5029 7.7195 7.7195 7.9019 7.9019 8.0676 8.0676 8.2270 8.2270 8.4059 8.4059 8.4753 8.4753 8.5756 8.5756 8.6881 8.6881 9.1833 9.1833 9.3292 9.3292 9.4265 9.4265 9.5566 9.5566 9.9513 9.9513 10.0449 10.0449 10.1087 10.1087 10.3279 10.3279 11.1085 11.1085 11.5683 11.5683 11.6369 11.6369 12.3929 12.3929 13.8525 13.8525 14.0445 14.0445 14.2699 14.2699 14.5448 14.5448 14.7833 14.7833 14.9187 14.9187 15.2492 15.2492 15.3987 15.3987 k = 0.3875 0.3875-0.0000 ( 5516 PWs) bands (ev): -1.2783 -1.2783 -0.6699 -0.6699 -0.6673 -0.6673 -0.2827 -0.2827 2.2723 2.2723 2.3730 2.3730 2.5625 2.5625 2.6758 2.6758 5.2316 5.2316 5.3081 5.3081 5.5090 5.5090 5.5959 5.5959 5.8075 5.8075 5.9358 5.9358 5.9986 5.9986 6.1539 6.1539 7.0562 7.0562 7.2523 7.2523 7.2992 7.2992 7.5114 7.5114 7.6572 7.6572 7.8631 7.8631 8.0415 8.0415 8.2245 8.2245 8.3928 8.3928 8.4694 8.4694 8.5679 8.5679 8.7016 8.7016 9.1461 9.1461 9.3054 9.3054 9.4156 9.4156 9.5429 9.5429 9.9595 9.9595 10.0525 10.0525 10.1448 10.1448 10.3759 10.3759 11.0262 11.0262 11.4961 11.4961 11.5693 11.5693 12.3863 12.3863 13.8520 13.8520 14.0031 14.0031 14.2743 14.2743 14.5503 14.5503 14.7949 14.7949 14.9460 14.9460 15.3219 15.3219 15.4894 15.4894 k = 0.3750 0.3750-0.0000 ( 5528 PWs) bands (ev): -1.3420 -1.3420 -0.6629 -0.6629 -0.6601 -0.6601 -0.2572 -0.2572 2.2827 2.2827 2.3825 2.3825 2.5980 2.5980 2.7083 2.7083 5.2365 5.2365 5.3098 5.3098 5.5350 5.5350 5.6191 5.6191 5.8182 5.8182 5.9448 5.9448 6.0114 6.0114 6.1707 6.1707 7.0460 7.0460 7.2362 7.2362 7.3063 7.3063 7.5109 7.5109 7.6034 7.6034 7.8219 7.8219 8.0143 8.0143 8.2204 8.2204 8.3800 8.3800 8.4640 8.4640 8.5589 8.5589 8.7146 8.7146 9.1097 9.1097 9.2798 9.2798 9.4030 9.4030 9.5257 9.5257 9.9650 9.9650 10.0571 10.0571 10.1826 10.1826 10.4224 10.4224 10.9505 10.9505 11.4171 11.4171 11.4966 11.4966 12.3613 12.3613 13.8613 13.8613 13.9628 13.9628 14.2898 14.2898 14.5467 14.5467 14.8153 14.8153 14.9783 14.9783 15.3937 15.3937 15.5798 15.5798 k = 0.3625 0.3625-0.0000 ( 5518 PWs) bands (ev): -1.4049 -1.4049 -0.6553 -0.6553 -0.6524 -0.6524 -0.2365 -0.2365 2.2974 2.2974 2.3940 2.3940 2.6370 2.6370 2.7397 2.7397 5.2438 5.2438 5.3135 5.3135 5.5596 5.5596 5.6413 5.6413 5.8325 5.8325 5.9559 5.9559 6.0256 6.0256 6.1878 6.1878 7.0370 7.0370 7.2172 7.2172 7.3119 7.3119 7.4870 7.4870 7.5741 7.5741 7.7795 7.7795 7.9867 7.9867 8.2143 8.2143 8.3678 8.3678 8.4585 8.4585 8.5491 8.5491 8.7271 8.7271 9.0744 9.0744 9.2533 9.2533 9.3885 9.3885 9.5062 9.5062 9.9658 9.9658 10.0611 10.0611 10.2180 10.2180 10.4651 10.4651 10.8835 10.8835 11.3317 11.3317 11.4206 11.4206 12.3205 12.3205 13.8742 13.8742 13.9246 13.9246 14.3192 14.3192 14.5346 14.5346 14.8433 14.8433 15.0154 15.0154 15.4645 15.4645 15.6690 15.6690 k = 0.3500 0.3500-0.0000 ( 5512 PWs) bands (ev): -1.4666 -1.4666 -0.6471 -0.6471 -0.6441 -0.6441 -0.2204 -0.2204 2.3158 2.3158 2.4072 2.4072 2.6794 2.6794 2.7698 2.7698 5.2534 5.2534 5.3190 5.3190 5.5821 5.5821 5.6632 5.6632 5.8499 5.8499 5.9704 5.9704 6.0404 6.0404 6.2052 6.2052 7.0292 7.0292 7.1949 7.1949 7.3129 7.3129 7.4449 7.4449 7.5670 7.5670 7.7382 7.7382 7.9592 7.9592 8.2062 8.2062 8.3561 8.3561 8.4524 8.4524 8.5386 8.5386 8.7391 8.7391 9.0405 9.0405 9.2265 9.2265 9.3721 9.3721 9.4854 9.4854 9.9604 9.9604 10.0649 10.0649 10.2476 10.2476 10.5007 10.5007 10.8280 10.8280 11.2411 11.2411 11.3439 11.3439 12.2671 12.2671 13.8781 13.8781 13.8964 13.8964 14.3628 14.3628 14.5177 14.5177 14.8762 14.8762 15.0572 15.0572 15.5342 15.5342 15.7563 15.7563 k = 0.3375 0.3375-0.0000 ( 5514 PWs) bands (ev): -1.5272 -1.5272 -0.6385 -0.6385 -0.6353 -0.6353 -0.2089 -0.2089 2.3375 2.3375 2.4222 2.4222 2.7248 2.7248 2.7991 2.7991 5.2652 5.2652 5.3263 5.3263 5.6020 5.6020 5.6854 5.6854 5.8693 5.8693 5.9889 5.9889 6.0555 6.0555 6.2229 6.2229 7.0225 7.0225 7.1686 7.1686 7.3028 7.3028 7.4094 7.4094 7.5624 7.5624 7.7018 7.7018 7.9318 7.9318 8.1960 8.1960 8.3447 8.3447 8.4453 8.4453 8.5280 8.5280 8.7502 8.7502 9.0082 9.0082 9.1999 9.1999 9.3540 9.3540 9.4642 9.4642 9.9483 9.9483 10.0676 10.0676 10.2683 10.2683 10.5252 10.5252 10.7860 10.7860 11.1465 11.1465 11.2701 11.2701 12.2040 12.2040 13.8496 13.8496 13.8988 13.8988 14.4092 14.4092 14.5089 14.5089 14.9113 14.9113 15.1033 15.1033 15.6029 15.6029 15.8412 15.8412 k = 0.3250 0.3250-0.0000 ( 5502 PWs) bands (ev): -1.5864 -1.5864 -0.6294 -0.6294 -0.6261 -0.6261 -0.2016 -0.2016 2.3618 2.3618 2.4390 2.4390 2.7720 2.7720 2.8289 2.8289 5.2786 5.2786 5.3352 5.3352 5.6193 5.6193 5.7085 5.7085 5.8896 5.8896 6.0115 6.0115 6.0707 6.0707 6.2408 6.2408 7.0162 7.0162 7.1385 7.1385 7.2759 7.2759 7.3928 7.3928 7.5509 7.5509 7.6753 7.6753 7.9045 7.9045 8.1840 8.1840 8.3334 8.3334 8.4369 8.4369 8.5176 8.5176 8.7601 8.7601 8.9777 8.9777 9.1741 9.1741 9.3342 9.3342 9.4433 9.4433 9.9304 9.9304 10.0670 10.0670 10.2778 10.2778 10.5361 10.5361 10.7555 10.7555 11.0500 11.0500 11.2050 11.2050 12.1338 12.1338 13.8184 13.8184 13.9016 13.9016 14.4169 14.4169 14.5487 14.5487 14.9461 14.9461 15.1537 15.1537 15.6708 15.6708 15.9236 15.9236 k = 0.3125 0.3125-0.0000 ( 5506 PWs) bands (ev): -1.6441 -1.6441 -0.6199 -0.6199 -0.6166 -0.6166 -0.1982 -0.1982 2.3882 2.3882 2.4576 2.4576 2.8159 2.8159 2.8643 2.8643 5.2933 5.2933 5.3457 5.3457 5.6346 5.6346 5.7324 5.7324 5.9105 5.9105 6.0372 6.0372 6.0862 6.0862 6.2591 6.2591 7.0082 7.0082 7.1070 7.1070 7.2387 7.2387 7.3901 7.3901 7.5305 7.5305 7.6610 7.6610 7.8772 7.8772 8.1705 8.1705 8.3220 8.3220 8.4268 8.4268 8.5077 8.5077 8.7686 8.7686 8.9491 8.9491 9.1495 9.1495 9.3129 9.3129 9.4233 9.4233 9.9074 9.9074 10.0608 10.0608 10.2757 10.2757 10.5341 10.5341 10.7265 10.7265 10.9545 10.9545 11.1564 11.1564 12.0588 12.0588 13.7898 13.7898 13.9005 13.9005 14.3895 14.3895 14.6312 14.6312 14.9785 14.9785 15.2086 15.2086 15.7381 15.7381 16.0034 16.0034 k = 0.3000 0.3000-0.0000 ( 5514 PWs) bands (ev): -1.7003 -1.7003 -0.6101 -0.6101 -0.6067 -0.6067 -0.1984 -0.1984 2.4160 2.4160 2.4781 2.4781 2.8489 2.8489 2.9128 2.9128 5.3082 5.3082 5.3581 5.3581 5.6489 5.6489 5.7567 5.7567 5.9320 5.9320 6.0636 6.0636 6.1027 6.1027 6.2779 6.2779 6.9935 6.9935 7.0810 7.0810 7.1984 7.1984 7.3925 7.3925 7.5060 7.5060 7.6550 7.6550 7.8500 7.8500 8.1561 8.1561 8.3103 8.3103 8.4149 8.4149 8.4989 8.4989 8.7751 8.7751 8.9226 8.9226 9.1264 9.1264 9.2904 9.2904 9.4044 9.4044 9.8799 9.8799 10.0469 10.0469 10.2641 10.2641 10.5194 10.5194 10.6872 10.6872 10.8643 10.8643 11.1308 11.1308 11.9806 11.9806 13.7642 13.7642 13.8961 13.8961 14.3517 14.3517 14.7282 14.7282 15.0076 15.0076 15.2687 15.2687 15.8051 15.8051 16.0806 16.0806 k = 0.2875 0.2875-0.0000 ( 5506 PWs) bands (ev): -1.7547 -1.7547 -0.5999 -0.5999 -0.5966 -0.5966 -0.2017 -0.2017 2.4446 2.4446 2.5004 2.5004 2.8729 2.8729 2.9724 2.9724 5.3224 5.3224 5.3724 5.3724 5.6630 5.6630 5.7811 5.7811 5.9543 5.9543 6.0873 6.0873 6.1219 6.1219 6.2976 6.2976 6.9671 6.9671 7.0684 7.0684 7.1570 7.1570 7.3952 7.3952 7.4839 7.4839 7.6525 7.6525 7.8232 7.8232 8.1411 8.1411 8.2984 8.2984 8.4012 8.4012 8.4910 8.4910 8.7791 8.7791 8.8985 8.8985 9.1051 9.1051 9.2671 9.2671 9.3868 9.3868 9.8487 9.8487 10.0239 10.0239 10.2460 10.2460 10.4863 10.4863 10.6340 10.6340 10.7871 10.7871 11.1274 11.1274 11.9004 11.9004 13.7418 13.7418 13.8895 13.8895 14.3098 14.3098 14.8288 14.8288 15.0349 15.0349 15.3346 15.3346 15.8720 15.8720 16.1551 16.1551 k = 0.2750 0.2750-0.0000 ( 5516 PWs) bands (ev): -1.8074 -1.8074 -0.5896 -0.5896 -0.5863 -0.5863 -0.2078 -0.2078 2.4733 2.4733 2.5247 2.5247 2.8922 2.8922 3.0387 3.0387 5.3349 5.3349 5.3890 5.3890 5.6773 5.6773 5.8052 5.8052 5.9780 5.9780 6.1053 6.1053 6.1445 6.1445 6.3186 6.3186 6.9328 6.9328 7.0673 7.0673 7.1156 7.1156 7.3952 7.3952 7.4689 7.4689 7.6501 7.6501 7.7970 7.7970 8.1261 8.1261 8.2864 8.2864 8.3859 8.3859 8.4840 8.4840 8.7797 8.7797 8.8772 8.8772 9.0856 9.0856 9.2434 9.2434 9.3700 9.3700 9.8144 9.8144 9.9922 9.9922 10.2229 10.2229 10.4299 10.4299 10.5671 10.5671 10.7335 10.7335 11.1388 11.1388 11.8193 11.8193 13.7227 13.7227 13.8814 13.8814 14.2659 14.2659 14.9183 14.9183 15.0711 15.0711 15.4070 15.4070 15.9392 15.9392 16.2266 16.2266 k = 0.2625 0.2625-0.0000 ( 5522 PWs) bands (ev): -1.8582 -1.8582 -0.5791 -0.5791 -0.5759 -0.5759 -0.2162 -0.2162 2.5018 2.5018 2.5508 2.5508 2.9086 2.9086 3.1098 3.1098 5.3451 5.3451 5.4073 5.4073 5.6920 5.6920 5.8288 5.8288 6.0032 6.0032 6.1184 6.1184 6.1680 6.1680 6.3413 6.3413 6.8978 6.8978 7.0579 7.0579 7.0896 7.0896 7.3908 7.3908 7.4627 7.4627 7.6459 7.6459 7.7725 7.7725 8.1117 8.1117 8.2745 8.2745 8.3693 8.3693 8.4778 8.4778 8.7760 8.7760 8.8591 8.8591 9.0680 9.0680 9.2197 9.2197 9.3536 9.3536 9.7775 9.7775 9.9529 9.9529 10.1924 10.1924 10.3567 10.3567 10.4880 10.4880 10.7045 10.7045 11.1567 11.1567 11.7383 11.7383 13.7068 13.7068 13.8725 13.8725 14.2214 14.2214 14.9702 14.9702 15.1403 15.1403 15.4862 15.4862 16.0067 16.0067 16.2950 16.2950 k = 0.2500 0.2500-0.0000 ( 5522 PWs) bands (ev): -1.9071 -1.9071 -0.5686 -0.5686 -0.5654 -0.5654 -0.2265 -0.2265 2.5299 2.5299 2.5787 2.5787 2.9226 2.9226 3.1848 3.1848 5.3530 5.3530 5.4265 5.4265 5.7067 5.7067 5.8518 5.8518 6.0302 6.0302 6.1282 6.1282 6.1902 6.1902 6.3656 6.3656 6.8659 6.8659 7.0186 7.0186 7.0994 7.0994 7.3829 7.3829 7.4633 7.4633 7.6388 7.6388 7.7509 7.7509 8.0985 8.0985 8.2631 8.2631 8.3517 8.3517 8.4719 8.4719 8.7678 8.7678 8.8441 8.8441 9.0520 9.0520 9.1959 9.1959 9.3370 9.3370 9.7390 9.7390 9.9070 9.9070 10.1489 10.1489 10.2812 10.2812 10.4038 10.4038 10.6897 10.6897 11.1751 11.1751 11.6583 11.6583 13.6943 13.6943 13.8634 13.8634 14.1774 14.1774 14.9847 14.9847 15.2410 15.2410 15.5727 15.5727 16.0745 16.0745 16.3599 16.3599 k = 0.2375 0.2375-0.0000 ( 5515 PWs) bands (ev): -1.9539 -1.9539 -0.5580 -0.5580 -0.5549 -0.5549 -0.2384 -0.2384 2.5574 2.5574 2.6079 2.6079 2.9347 2.9347 3.2631 3.2631 5.3588 5.3588 5.4453 5.4453 5.7207 5.7207 5.8743 5.8743 6.0588 6.0588 6.1355 6.1355 6.2107 6.2107 6.3908 6.3908 6.8386 6.8386 6.9757 6.9757 7.1192 7.1192 7.3731 7.3731 7.4670 7.4670 7.6290 7.6290 7.7336 7.7336 8.0870 8.0870 8.2524 8.2524 8.3336 8.3336 8.4660 8.4660 8.7552 8.7552 8.8313 8.8313 9.0375 9.0375 9.1723 9.1723 9.3192 9.3192 9.6998 9.6998 9.8545 9.8545 10.0875 10.0875 10.2133 10.2133 10.3228 10.3228 10.6807 10.6807 11.1899 11.1899 11.5799 11.5799 13.6849 13.6849 13.8546 13.8546 14.1350 14.1350 14.9813 14.9813 15.3525 15.3525 15.6667 15.6667 16.1423 16.1423 16.4215 16.4215 k = 0.2250 0.2250-0.0000 ( 5515 PWs) bands (ev): -1.9987 -1.9987 -0.5475 -0.5475 -0.5445 -0.5445 -0.2514 -0.2514 2.5846 2.5846 2.6381 2.6381 2.9450 2.9450 3.3442 3.3442 5.3627 5.3627 5.4626 5.4626 5.7326 5.7326 5.8961 5.8961 6.0893 6.0893 6.1413 6.1413 6.2307 6.2307 6.4160 6.4160 6.8159 6.8159 6.9354 6.9354 7.1443 7.1443 7.3615 7.3615 7.4712 7.4712 7.6183 7.6183 7.7214 7.7214 8.0777 8.0777 8.2424 8.2424 8.3153 8.3153 8.4599 8.4599 8.7393 8.7393 8.8191 8.8191 9.0240 9.0240 9.1485 9.1485 9.2992 9.2992 9.6611 9.6611 9.7943 9.7943 10.0156 10.0156 10.1472 10.1472 10.2527 10.2527 10.6729 10.6729 11.1982 11.1982 11.5043 11.5043 13.6787 13.6787 13.8465 13.8465 14.0951 14.0951 14.9686 14.9686 15.4655 15.4655 15.7687 15.7687 16.2092 16.2092 16.4802 16.4802 k = 0.2125 0.2125-0.0000 ( 5505 PWs) bands (ev): -2.0413 -2.0413 -0.5371 -0.5371 -0.5342 -0.5342 -0.2653 -0.2653 2.6114 2.6114 2.6687 2.6687 2.9538 2.9538 3.4277 3.4277 5.3647 5.3647 5.4772 5.4772 5.7407 5.7407 5.9172 5.9172 6.1211 6.1211 6.1472 6.1472 6.2519 6.2519 6.4399 6.4399 6.7957 6.7957 6.9008 6.9008 7.1732 7.1732 7.3470 7.3470 7.4748 7.4748 7.6103 7.6103 7.7143 7.7143 8.0705 8.0705 8.2332 8.2332 8.2971 8.2971 8.4534 8.4534 8.7209 8.7209 8.8060 8.8060 9.0111 9.0111 9.1240 9.1240 9.2756 9.2756 9.6238 9.6238 9.7250 9.7250 9.9462 9.9462 10.0752 10.0752 10.1957 10.1957 10.6646 10.6646 11.1978 11.1978 11.4328 11.4328 13.6755 13.6755 13.8393 13.8393 14.0584 14.0584 14.9499 14.9499 15.5760 15.5760 15.8790 15.8790 16.2732 16.2732 16.5378 16.5378 k = 0.2000 0.2000-0.0000 ( 5517 PWs) bands (ev): -2.0818 -2.0818 -0.5268 -0.5268 -0.5242 -0.5242 -0.2798 -0.2798 2.6378 2.6378 2.6993 2.6993 2.9613 2.9613 3.5131 3.5131 5.3652 5.3652 5.4883 5.4883 5.7428 5.7428 5.9380 5.9380 6.1458 6.1458 6.1636 6.1636 6.2757 6.2757 6.4621 6.4621 6.7750 6.7750 6.8749 6.8749 7.2035 7.2035 7.3295 7.3295 7.4779 7.4779 7.6079 7.6079 7.7120 7.7120 8.0654 8.0654 8.2248 8.2248 8.2794 8.2794 8.4461 8.4461 8.7005 8.7005 8.7907 8.7907 8.9983 8.9983 9.0981 9.0981 9.2474 9.2474 9.5873 9.5873 9.6499 9.6499 9.8859 9.8859 10.0000 10.0000 10.1458 10.1458 10.6547 10.6547 11.1863 11.1863 11.3672 11.3672 13.6751 13.6751 13.8332 13.8332 14.0256 14.0256 14.9266 14.9266 15.6823 15.6823 15.9971 15.9971 16.3318 16.3318 16.5964 16.5964 k = 0.1875 0.1875-0.0000 ( 5509 PWs) bands (ev): -2.1200 -2.1200 -0.5168 -0.5168 -0.5143 -0.5143 -0.2946 -0.2946 2.6639 2.6639 2.7298 2.7298 2.9676 2.9676 3.6000 3.6000 5.3641 5.3641 5.4952 5.4952 5.7374 5.7374 5.9588 5.9588 6.1547 6.1547 6.1997 6.1997 6.3036 6.3036 6.4821 6.4821 6.7522 6.7522 6.8582 6.8582 7.2287 7.2287 7.3145 7.3145 7.4818 7.4818 7.6122 7.6122 7.7145 7.7145 8.0621 8.0621 8.2166 8.2166 8.2626 8.2626 8.4378 8.4378 8.6778 8.6778 8.7726 8.7726 8.9849 8.9849 9.0690 9.0690 9.2144 9.2144 9.5383 9.5383 9.5874 9.5874 9.8350 9.8350 9.9274 9.9274 10.0975 10.0975 10.6428 10.6428 11.1618 11.1618 11.3095 11.3095 13.6773 13.6773 13.8283 13.8283 13.9973 13.9973 14.9000 14.9000 15.7838 15.7838 16.1220 16.1220 16.3821 16.3821 16.6577 16.6577 k = 0.1750 0.1750-0.0000 ( 5513 PWs) bands (ev): -2.1559 -2.1559 -0.5071 -0.5071 -0.5048 -0.5048 -0.3094 -0.3094 2.6894 2.6894 2.7599 2.7599 2.9730 2.9730 3.6879 3.6879 5.3615 5.3615 5.4978 5.4978 5.7241 5.7241 5.9796 5.9796 6.1617 6.1617 6.2418 6.2418 6.3366 6.3366 6.5003 6.5003 6.7286 6.7286 6.8480 6.8480 7.2313 7.2313 7.3194 7.3194 7.4876 7.4876 7.6228 7.6228 7.7220 7.7220 8.0601 8.0601 8.2084 8.2084 8.2475 8.2475 8.4283 8.4283 8.6527 8.6527 8.7511 8.7511 8.9701 8.9701 9.0347 9.0347 9.1782 9.1782 9.4644 9.4644 9.5558 9.5558 9.7908 9.7908 9.8615 9.8615 10.0484 10.0484 10.6287 10.6287 11.1246 11.1246 11.2601 11.2601 13.6820 13.6820 13.8243 13.8243 13.9738 13.9738 14.8707 14.8707 15.8805 15.8805 16.2521 16.2521 16.4232 16.4232 16.7197 16.7197 k = 0.1625 0.1625-0.0000 ( 5509 PWs) bands (ev): -2.1895 -2.1895 -0.4978 -0.4978 -0.4957 -0.4957 -0.3240 -0.3240 2.7143 2.7143 2.7892 2.7892 2.9776 2.9776 3.7764 3.7764 5.3576 5.3576 5.4960 5.4960 5.7038 5.7038 5.9998 5.9998 6.1677 6.1677 6.2881 6.2881 6.3754 6.3754 6.5169 6.5169 6.7067 6.7067 6.8397 6.8397 7.2113 7.2113 7.3463 7.3463 7.4955 7.4955 7.6391 7.6391 7.7347 7.7347 8.0587 8.0587 8.1990 8.1990 8.2346 8.2346 8.4174 8.4174 8.6246 8.6246 8.7255 8.7255 8.9515 8.9515 8.9937 8.9937 9.1419 9.1419 9.3877 9.3877 9.5368 9.5368 9.7501 9.7501 9.8053 9.8053 9.9979 9.9979 10.6123 10.6123 11.0785 11.0785 11.2159 11.2159 13.6890 13.6890 13.8212 13.8212 13.9551 13.9551 14.8395 14.8395 15.9724 15.9724 16.3845 16.3845 16.4570 16.4570 16.7748 16.7748 k = 0.1500 0.1500-0.0000 ( 5521 PWs) bands (ev): -2.2208 -2.2208 -0.4890 -0.4890 -0.4870 -0.4870 -0.3383 -0.3383 2.7382 2.7382 2.8177 2.8177 2.9817 2.9817 3.8651 3.8651 5.3524 5.3524 5.4900 5.4900 5.6782 5.6782 6.0185 6.0185 6.1719 6.1719 6.3385 6.3385 6.4193 6.4193 6.5329 6.5329 6.6887 6.6887 6.8295 6.8295 7.1864 7.1864 7.3789 7.3789 7.5052 7.5052 7.6609 7.6609 7.7525 7.7525 8.0575 8.0575 8.1879 8.1879 8.2247 8.2247 8.4048 8.4048 8.5934 8.5934 8.6954 8.6954 8.9195 8.9195 8.9539 8.9539 9.1090 9.1090 9.3169 9.3169 9.5234 9.5234 9.7110 9.7110 9.7612 9.7612 9.9468 9.9468 10.5935 10.5935 11.0291 11.0291 11.1727 11.1727 13.6978 13.6978 13.8185 13.8185 13.9414 13.9414 14.8069 14.8069 16.0597 16.0597 16.4746 16.4746 16.5285 16.5285 16.8203 16.8203 k = 0.1375 0.1375-0.0000 ( 5529 PWs) bands (ev): -2.2497 -2.2497 -0.4806 -0.4806 -0.4788 -0.4788 -0.3520 -0.3520 2.7610 2.7610 2.8452 2.8452 2.9853 2.9853 3.9535 3.9535 5.3458 5.3458 5.4801 5.4801 5.6493 5.6493 6.0348 6.0348 6.1734 6.1734 6.3928 6.3928 6.4663 6.4663 6.5498 6.5498 6.6759 6.6759 6.8150 6.8150 7.1650 7.1650 7.4105 7.4105 7.5167 7.5167 7.6876 7.6876 7.7751 7.7751 8.0557 8.0557 8.1748 8.1748 8.2174 8.2174 8.3902 8.3902 8.5588 8.5588 8.6602 8.6602 8.8661 8.8661 8.9251 8.9251 9.0810 9.0810 9.2541 9.2541 9.5131 9.5131 9.6745 9.6745 9.7278 9.7278 9.8960 9.8960 10.5721 10.5721 10.9803 10.9803 11.1279 11.1279 13.7082 13.7082 13.8162 13.8162 13.9323 13.9323 14.7734 14.7734 16.1421 16.1421 16.4991 16.4991 16.6609 16.6609 16.8628 16.8628 k = 0.1250 0.1250-0.0000 ( 5525 PWs) bands (ev): -2.2761 -2.2761 -0.4727 -0.4727 -0.4711 -0.4711 -0.3649 -0.3649 2.7824 2.7824 2.8713 2.8713 2.9886 2.9886 4.0410 4.0410 5.3381 5.3381 5.4668 5.4668 5.6187 5.6187 6.0481 6.0481 6.1719 6.1719 6.4501 6.4501 6.5101 6.5101 6.5715 6.5715 6.6702 6.6702 6.7960 6.7960 7.1500 7.1500 7.4387 7.4387 7.5300 7.5300 7.7177 7.7177 7.8019 7.8019 8.0529 8.0529 8.1601 8.1601 8.2118 8.2118 8.3734 8.3734 8.5205 8.5205 8.6203 8.6203 8.8063 8.8063 8.8960 8.8960 9.0578 9.0578 9.1998 9.1998 9.5042 9.5042 9.6438 9.6438 9.7020 9.7020 9.8472 9.8472 10.5484 10.5484 10.9346 10.9346 11.0809 11.0809 13.7199 13.7199 13.8142 13.8142 13.9271 13.9271 14.7397 14.7397 16.2192 16.2192 16.5183 16.5183 16.7881 16.7881 16.9125 16.9125 k = 0.1125 0.1125-0.0000 ( 5521 PWs) bands (ev): -2.3001 -2.3001 -0.4655 -0.4655 -0.4639 -0.4639 -0.3770 -0.3770 2.8021 2.8021 2.8960 2.8960 2.9918 2.9918 4.1273 4.1273 5.3293 5.3293 5.4504 5.4504 5.5879 5.5879 6.0584 6.0584 6.1671 6.1671 6.5076 6.5076 6.5413 6.5413 6.6022 6.6022 6.6754 6.6754 6.7761 6.7761 7.1416 7.1416 7.4624 7.4624 7.5457 7.5457 7.7493 7.7493 7.8319 7.8319 8.0486 8.0486 8.1435 8.1435 8.2066 8.2066 8.3545 8.3545 8.4773 8.4773 8.5789 8.5789 8.7494 8.7494 8.8608 8.8608 9.0393 9.0393 9.1538 9.1538 9.4959 9.4959 9.6203 9.6203 9.6810 9.6810 9.8020 9.8020 10.5222 10.5222 10.8931 10.8931 11.0319 11.0319 13.7324 13.7324 13.8126 13.8126 13.9253 13.9253 14.7064 14.7064 16.2905 16.2905 16.5356 16.5356 16.8839 16.8839 16.9937 16.9937 k = 0.1000 0.1000-0.0000 ( 5527 PWs) bands (ev): -2.3217 -2.3217 -0.4589 -0.4589 -0.4574 -0.4574 -0.3881 -0.3881 2.8199 2.8199 2.9190 2.9190 2.9950 2.9950 4.2116 4.2116 5.3197 5.3197 5.4310 5.4310 5.5582 5.5582 6.0660 6.0660 6.1593 6.1593 6.5528 6.5528 6.5657 6.5657 6.6358 6.6358 6.6903 6.6903 6.7700 6.7700 7.1386 7.1386 7.4813 7.4813 7.5630 7.5630 7.7799 7.7799 7.8637 7.8637 8.0423 8.0423 8.1252 8.1252 8.2006 8.2006 8.3348 8.3348 8.4282 8.4282 8.5424 8.5424 8.6981 8.6981 8.8180 8.8180 9.0252 9.0252 9.1154 9.1154 9.4877 9.4877 9.6040 9.6040 9.6635 9.6635 9.7620 9.7620 10.4941 10.4941 10.8567 10.8567 10.9821 10.9821 13.7453 13.7453 13.8113 13.8113 13.9260 13.9260 14.6739 14.6739 16.3556 16.3556 16.5514 16.5514 16.9391 16.9391 17.1144 17.1144 k = 0.0875 0.0875-0.0000 ( 5521 PWs) bands (ev): -2.3407 -2.3407 -0.4530 -0.4530 -0.4516 -0.4516 -0.3982 -0.3982 2.8356 2.8356 2.9400 2.9400 2.9983 2.9983 4.2931 4.2931 5.3096 5.3096 5.4089 5.4089 5.5307 5.5307 6.0713 6.0713 6.1488 6.1488 6.5693 6.5693 6.5916 6.5916 6.6717 6.6717 6.6961 6.6961 6.8048 6.8048 7.1396 7.1396 7.4959 7.4959 7.5802 7.5802 7.8068 7.8068 7.8945 7.8945 8.0345 8.0345 8.1058 8.1058 8.1917 8.1917 8.3159 8.3159 8.3775 8.3775 8.5146 8.5146 8.6520 8.6520 8.7677 8.7677 9.0150 9.0150 9.0839 9.0839 9.4801 9.4801 9.5932 9.5932 9.6479 9.6479 9.7294 9.7294 10.4647 10.4647 10.8254 10.8254 10.9328 10.9328 13.7582 13.7582 13.8106 13.8106 13.9285 13.9285 14.6430 14.6430 16.4141 16.4141 16.5659 16.5659 16.9801 16.9801 17.2466 17.2466 k = 0.0750 0.0750-0.0000 ( 5511 PWs) bands (ev): -2.3573 -2.3573 -0.4478 -0.4478 -0.4464 -0.4464 -0.4070 -0.4070 2.8491 2.8491 2.9589 2.9589 3.0016 3.0016 4.3709 4.3709 5.2994 5.2994 5.3843 5.3843 5.5060 5.5060 6.0748 6.0748 6.1363 6.1363 6.5791 6.5791 6.6023 6.6023 6.6627 6.6627 6.7472 6.7472 6.8666 6.8666 7.1435 7.1435 7.5070 7.5070 7.5936 7.5936 7.8258 7.8258 7.9201 7.9201 8.0278 8.0278 8.0883 8.0883 8.1771 8.1771 8.2995 8.2995 8.3351 8.3351 8.4943 8.4943 8.6102 8.6102 8.7112 8.7112 9.0079 9.0079 9.0584 9.0584 9.4737 9.4737 9.5862 9.5862 9.6327 9.6327 9.7056 9.7056 10.4348 10.4348 10.7991 10.7991 10.8857 10.8857 13.7707 13.7707 13.8103 13.8103 13.9322 13.9322 14.6142 14.6142 16.4659 16.4659 16.5790 16.5790 17.0158 17.0158 17.3790 17.3790 k = 0.0625 0.0625-0.0000 ( 5509 PWs) bands (ev): -2.3713 -2.3713 -0.4434 -0.4434 -0.4420 -0.4420 -0.4146 -0.4146 2.8602 2.8602 2.9754 2.9754 3.0049 3.0049 4.4436 4.4436 5.2895 5.2895 5.3580 5.3580 5.4848 5.4848 6.0770 6.0770 6.1227 6.1227 6.5849 6.5849 6.6072 6.6072 6.6454 6.6454 6.8111 6.8111 6.9371 6.9371 7.1498 7.1498 7.5149 7.5149 7.5990 7.5990 7.8303 7.8303 7.9346 7.9346 8.0308 8.0308 8.0755 8.0755 8.1577 8.1577 8.2869 8.2869 8.3096 8.3096 8.4772 8.4772 8.5734 8.5734 8.6504 8.6504 9.0032 9.0032 9.0382 9.0382 9.4687 9.4687 9.5816 9.5816 9.6173 9.6173 9.6911 9.6911 10.4056 10.4056 10.7776 10.7776 10.8424 10.8424 13.7822 13.7822 13.8104 13.8104 13.9363 13.9363 14.5882 14.5882 16.5107 16.5107 16.5904 16.5904 17.0473 17.0473 17.5048 17.5048 k = 0.0500 0.0500-0.0000 ( 5501 PWs) bands (ev): -2.3828 -2.3828 -0.4397 -0.4397 -0.4384 -0.4384 -0.4209 -0.4209 2.8691 2.8691 2.9893 2.9893 3.0080 3.0080 4.5095 4.5095 5.2806 5.2806 5.3310 5.3310 5.4673 5.4673 6.0783 6.0783 6.1093 6.1093 6.5851 6.5851 6.6112 6.6112 6.6329 6.6329 6.8734 6.8734 7.0100 7.0100 7.1591 7.1591 7.5192 7.5192 7.5925 7.5925 7.8145 7.8145 7.9384 7.9384 8.0483 8.0483 8.0678 8.0678 8.1423 8.1423 8.2803 8.2803 8.2985 8.2985 8.4576 8.4576 8.5427 8.5427 8.5892 8.5892 9.0002 9.0002 9.0226 9.0226 9.4654 9.4654 9.5784 9.5784 9.6026 9.6026 9.6841 9.6841 10.3784 10.3784 10.7605 10.7605 10.8044 10.8044 13.7923 13.7923 13.8107 13.8107 13.9405 13.9405 14.5657 14.5657 16.5482 16.5482 16.6000 16.6000 17.0742 17.0742 17.6039 17.6039 k = 0.0375 0.0375-0.0000 ( 5493 PWs) bands (ev): -2.3918 -2.3918 -0.4368 -0.4368 -0.4355 -0.4355 -0.4259 -0.4259 2.8758 2.8758 3.0003 3.0003 3.0107 3.0107 4.5663 4.5663 5.2731 5.2731 5.3052 5.3052 5.4535 5.4535 6.0790 6.0790 6.0972 6.0972 6.5804 6.5804 6.6154 6.6154 6.6264 6.6264 6.9284 6.9284 7.0811 7.0811 7.1722 7.1722 7.5192 7.5192 7.5728 7.5728 7.7834 7.7834 7.9382 7.9382 8.0536 8.0536 8.0841 8.0841 8.1398 8.1398 8.2804 8.2804 8.2965 8.2965 8.4315 8.4315 8.5052 8.5052 8.5450 8.5450 8.9984 8.9984 9.0110 9.0110 9.4634 9.4634 9.5761 9.5761 9.5901 9.5901 9.6819 9.6819 10.3547 10.3547 10.7475 10.7475 10.7733 10.7733 13.8006 13.8006 13.8111 13.8111 13.9444 13.9444 14.5474 14.5474 16.5781 16.5781 16.6076 16.6076 17.0960 17.0960 17.6420 17.6420 k = 0.0250 0.0250-0.0000 ( 5489 PWs) bands (ev): -2.3982 -2.3982 -0.4347 -0.4347 -0.4336 -0.4336 -0.4293 -0.4293 2.8805 2.8805 3.0083 3.0083 3.0129 3.0129 4.6108 4.6108 5.2674 5.2674 5.2832 5.2832 5.4437 5.4437 6.0793 6.0793 6.0877 6.0877 6.5743 6.5743 6.6191 6.6191 6.6236 6.6236 6.9706 6.9706 7.1455 7.1455 7.1892 7.1892 7.5143 7.5143 7.5436 7.5436 7.7498 7.7498 7.9369 7.9369 8.0467 8.0467 8.1175 8.1175 8.1466 8.1466 8.2873 8.2873 8.3017 8.3017 8.4008 8.4008 8.4472 8.4472 8.5317 8.5317 8.9974 8.9974 9.0030 9.0030 9.4623 9.4623 9.5746 9.5746 9.5809 9.5809 9.6819 9.6819 10.3363 10.3363 10.7384 10.7384 10.7502 10.7502 13.8068 13.8068 13.8116 13.8116 13.9475 13.9475 14.5338 14.5338 16.5999 16.5999 16.6131 16.6131 17.1120 17.1120 17.6520 17.6520 k = 0.0125 0.0125-0.0000 ( 5493 PWs) bands (ev): -2.4020 -2.4020 -0.4335 -0.4335 -0.4329 -0.4329 -0.4309 -0.4309 2.8832 2.8832 3.0131 3.0131 3.0143 3.0143 4.6397 4.6397 5.2638 5.2638 5.2680 5.2680 5.4377 5.4377 6.0794 6.0794 6.0815 6.0815 6.5699 6.5699 6.6215 6.6215 6.6226 6.6226 6.9964 6.9964 7.1944 7.1944 7.2061 7.2061 7.5065 7.5065 7.5151 7.5151 7.7250 7.7250 7.9360 7.9360 8.0420 8.0420 8.1463 8.1463 8.1546 8.1546 8.3038 8.3038 8.3139 8.3139 8.3706 8.3706 8.3901 8.3901 8.5278 8.5278 8.9970 8.9970 8.9984 8.9984 9.4619 9.4619 9.5737 9.5737 9.5753 9.5753 9.6827 9.6827 10.3244 10.3244 10.7330 10.7330 10.7360 10.7360 13.8106 13.8106 13.8118 13.8118 13.9494 13.9494 14.5254 14.5254 16.6131 16.6131 16.6165 16.6165 17.1219 17.1219 17.6549 17.6549 k = 0.0000 0.0000 0.0000 ( 5497 PWs) bands (ev): -2.4033 -2.4033 -0.4331 -0.4331 -0.4331 -0.4331 -0.4310 -0.4310 2.8841 2.8841 3.0148 3.0148 3.0148 3.0148 4.6497 4.6497 5.2626 5.2626 5.2626 5.2626 5.4357 5.4357 6.0794 6.0794 6.0794 6.0794 6.5683 6.5683 6.6224 6.6224 6.6224 6.6224 7.0048 7.0048 7.2137 7.2137 7.2137 7.2137 7.5024 7.5024 7.5024 7.5024 7.7161 7.7161 7.9356 7.9356 8.0404 8.0404 8.1579 8.1579 8.1579 8.1579 8.3257 8.3257 8.3257 8.3257 8.3525 8.3525 8.3525 8.3525 8.5270 8.5270 8.9969 8.9969 8.9969 8.9969 9.4617 9.4617 9.5735 9.5735 9.5735 9.5735 9.6831 9.6831 10.3204 10.3204 10.7312 10.7312 10.7312 10.7312 13.8119 13.8119 13.8119 13.8119 13.9501 13.9501 14.5225 14.5225 16.6176 16.6176 16.6176 16.6176 17.1252 17.1252 17.6555 17.6555 k = 0.0000 0.0000 0.0000 ( 5497 PWs) bands (ev): -2.4033 -2.4033 -0.4331 -0.4331 -0.4331 -0.4331 -0.4310 -0.4310 2.8841 2.8841 3.0148 3.0148 3.0148 3.0148 4.6497 4.6497 5.2626 5.2626 5.2626 5.2626 5.4357 5.4357 6.0794 6.0794 6.0794 6.0794 6.5683 6.5683 6.6224 6.6224 6.6224 6.6224 7.0048 7.0048 7.2137 7.2137 7.2137 7.2137 7.5024 7.5024 7.5024 7.5024 7.7161 7.7161 7.9356 7.9356 8.0404 8.0404 8.1579 8.1579 8.1579 8.1579 8.3257 8.3257 8.3257 8.3257 8.3525 8.3525 8.3525 8.3525 8.5270 8.5270 8.9969 8.9969 8.9969 8.9969 9.4617 9.4617 9.5735 9.5735 9.5735 9.5735 9.6831 9.6831 10.3204 10.3204 10.7312 10.7312 10.7312 10.7312 13.8119 13.8119 13.8119 13.8119 13.9501 13.9501 14.5225 14.5225 16.6176 16.6176 16.6176 16.6176 17.1252 17.1252 17.6555 17.6555 k = 0.0104 0.0104 0.0104 ( 5491 PWs) bands (ev): -2.4020 -2.4020 -0.4331 -0.4331 -0.4331 -0.4331 -0.4311 -0.4311 2.8831 2.8831 3.0131 3.0131 3.0142 3.0142 4.6392 4.6392 5.2638 5.2638 5.2682 5.2682 5.4378 5.4378 6.0793 6.0793 6.0817 6.0817 6.5700 6.5700 6.6215 6.6215 6.6227 6.6227 6.9961 6.9961 7.1966 7.1966 7.2025 7.2025 7.5103 7.5103 7.5122 7.5122 7.7253 7.7253 7.9360 7.9360 8.0421 8.0421 8.1474 8.1474 8.1528 8.1528 8.3056 8.3056 8.3102 8.3102 8.3777 8.3777 8.3860 8.3860 8.5279 8.5279 8.9970 8.9970 8.9984 8.9984 9.4619 9.4619 9.5737 9.5737 9.5754 9.5754 9.6827 9.6827 10.3246 10.3246 10.7335 10.7335 10.7358 10.7358 13.8105 13.8105 13.8119 13.8119 13.9494 13.9494 14.5255 14.5255 16.6134 16.6134 16.6160 16.6160 17.1217 17.1217 17.6549 17.6549 k = 0.0208 0.0208 0.0208 ( 5488 PWs) bands (ev): -2.3980 -2.3980 -0.4333 -0.4333 -0.4331 -0.4331 -0.4312 -0.4312 2.8803 2.8803 3.0082 3.0082 3.0126 3.0126 4.6092 4.6092 5.2675 5.2675 5.2840 5.2840 5.4441 5.4441 6.0791 6.0791 6.0881 6.0881 6.5744 6.5744 6.6189 6.6189 6.6240 6.6240 6.9698 6.9698 7.1548 7.1548 7.1731 7.1731 7.5263 7.5263 7.5376 7.5376 7.7499 7.7499 7.9364 7.9364 8.0472 8.0472 8.1194 8.1194 8.1417 8.1417 8.2914 8.2914 8.2948 8.2948 8.4182 8.4182 8.4369 8.4369 8.5320 8.5320 8.9976 8.9976 9.0031 9.0031 9.4623 9.4623 9.5745 9.5745 9.5814 9.5814 9.6819 9.6819 10.3371 10.3371 10.7401 10.7401 10.7494 10.7494 13.8063 13.8063 13.8118 13.8118 13.9474 13.9474 14.5342 14.5342 16.6008 16.6008 16.6112 16.6112 17.1114 17.1114 17.6523 17.6523 k = 0.0312 0.0312 0.0312 ( 5494 PWs) bands (ev): -2.3913 -2.3913 -0.4337 -0.4337 -0.4331 -0.4331 -0.4314 -0.4314 2.8755 2.8755 3.0000 3.0000 3.0100 3.0100 4.5629 4.5629 5.2736 5.2736 5.3068 5.3068 5.4547 5.4547 6.0786 6.0786 6.0979 6.0979 6.5801 6.5801 6.6146 6.6146 6.6279 6.6279 6.9267 6.9267 7.1039 7.1039 7.1326 7.1326 7.5398 7.5398 7.5708 7.5708 7.7807 7.7807 7.9348 7.9348 8.0556 8.0556 8.0826 8.0826 8.1354 8.1354 8.2860 8.2860 8.2888 8.2888 8.4579 8.4579 8.4909 8.4909 8.5449 8.5449 8.9988 8.9988 9.0112 9.0112 9.4635 9.4635 9.5755 9.5755 9.5915 9.5915 9.6820 9.6820 10.3569 10.3569 10.7512 10.7512 10.7713 10.7713 13.7995 13.7995 13.8117 13.8117 13.9442 13.9442 14.5484 14.5484 16.5804 16.5804 16.6033 16.6033 17.0941 17.0941 17.6445 17.6445 k = 0.0417 0.0417 0.0417 ( 5491 PWs) bands (ev): -2.3820 -2.3820 -0.4342 -0.4342 -0.4332 -0.4332 -0.4316 -0.4316 2.8685 2.8685 2.9887 2.9887 3.0067 3.0067 4.5040 4.5040 5.2818 5.2818 5.3332 5.3332 5.4697 5.4697 6.0777 6.0777 6.1098 6.1098 6.5840 6.5840 6.6088 6.6088 6.6371 6.6371 6.8694 6.8694 7.0529 7.0529 7.0864 7.0864 7.5467 7.5467 7.6055 7.6055 7.8071 7.8071 7.9264 7.9264 8.0451 8.0451 8.0653 8.0653 8.1450 8.1450 8.2849 8.2849 8.2938 8.2938 8.4856 8.4856 8.5446 8.5446 8.5759 8.5759 9.0009 9.0009 9.0230 9.0230 9.4656 9.4656 9.5764 9.5764 9.6060 9.6060 9.6842 9.6842 10.3829 10.3829 10.7664 10.7664 10.8004 10.8004 13.7904 13.7904 13.8116 13.8116 13.9403 13.9403 14.5676 14.5676 16.5526 16.5526 16.5920 16.5920 17.0699 17.0699 17.6207 17.6207 k = 0.0521 0.0521 0.0521 ( 5509 PWs) bands (ev): -2.3700 -2.3700 -0.4348 -0.4348 -0.4332 -0.4332 -0.4319 -0.4319 2.8593 2.8593 2.9743 2.9743 3.0027 3.0027 4.4355 4.4355 5.2920 5.2920 5.3604 5.3604 5.4894 5.4894 6.0761 6.0761 6.1222 6.1222 6.5841 6.5841 6.6019 6.6019 6.6516 6.6516 6.8044 6.8044 7.0048 7.0048 7.0374 7.0374 7.5467 7.5467 7.6369 7.6369 7.8225 7.8225 7.9096 7.9096 8.0122 8.0122 8.0747 8.0747 8.1675 8.1675 8.2990 8.2990 8.3042 8.3042 8.5025 8.5025 8.5955 8.5955 8.6230 8.6230 9.0042 9.0042 9.0390 9.0390 9.4692 9.4692 9.5769 9.5769 9.6253 9.6253 9.6904 9.6904 10.4141 10.4141 10.7856 10.7856 10.8355 10.8355 13.7792 13.7792 13.8118 13.8118 13.9359 13.9359 14.5910 14.5910 16.5183 16.5183 16.5775 16.5775 17.0384 17.0384 17.5590 17.5590 k = 0.0625 0.0625 0.0625 ( 5509 PWs) bands (ev): -2.3554 -2.3554 -0.4356 -0.4356 -0.4332 -0.4332 -0.4321 -0.4321 2.8477 2.8477 2.9569 2.9569 2.9983 2.9983 4.3600 4.3600 5.3038 5.3038 5.3867 5.3867 5.5135 5.5135 6.0738 6.0738 6.1338 6.1338 6.5804 6.5804 6.5940 6.5940 6.6597 6.6597 6.7475 6.7475 6.9600 6.9600 6.9877 6.9877 7.5398 7.5398 7.6611 7.6611 7.8222 7.8222 7.8921 7.8921 7.9880 7.9880 8.0845 8.0845 8.1844 8.1844 8.3189 8.3189 8.3386 8.3386 8.5184 8.5184 8.6421 8.6421 8.6767 8.6767 9.0094 9.0094 9.0594 9.0594 9.4748 9.4748 9.5771 9.5771 9.6498 9.6498 9.7015 9.7015 10.4492 10.4492 10.8087 10.8087 10.8748 10.8748 13.7665 13.7665 13.8125 13.8125 13.9316 13.9316 14.6182 14.6182 16.4781 16.4781 16.5595 16.5595 16.9991 16.9991 17.4708 17.4708 k = 0.0729 0.0729 0.0729 ( 5524 PWs) bands (ev): -2.3381 -2.3381 -0.4364 -0.4364 -0.4332 -0.4332 -0.4324 -0.4324 2.8335 2.8335 2.9367 2.9367 2.9937 2.9937 4.2792 4.2792 5.3169 5.3169 5.4112 5.4112 5.5413 5.5413 6.0702 6.0702 6.1431 6.1431 6.5726 6.5726 6.5857 6.5857 6.6230 6.6230 6.7395 6.7395 6.9202 6.9202 6.9385 6.9385 7.5260 7.5260 7.6753 7.6753 7.8003 7.8003 7.8867 7.8867 7.9752 7.9752 8.0947 8.0947 8.1898 8.1898 8.3377 8.3377 8.3981 8.3981 8.5405 8.5405 8.6835 8.6835 8.7313 8.7313 9.0173 9.0173 9.0842 9.0842 9.4826 9.4826 9.5774 9.5774 9.6796 9.6796 9.7184 9.7184 10.4874 10.4874 10.8352 10.8352 10.9169 10.9169 13.7529 13.7529 13.8138 13.8138 13.9275 13.9275 14.6483 14.6483 16.4330 16.4330 16.5379 16.5379 16.9511 16.9511 17.3785 17.3785 k = 0.0833 0.0833 0.0833 ( 5518 PWs) bands (ev): -2.3182 -2.3182 -0.4374 -0.4374 -0.4331 -0.4331 -0.4326 -0.4326 2.8167 2.8167 2.9137 2.9137 2.9889 2.9889 4.1944 4.1944 5.3310 5.3310 5.4336 5.4336 5.5719 5.5719 6.0651 6.0651 6.1491 6.1491 6.5431 6.5431 6.5759 6.5759 6.5772 6.5772 6.7606 6.7606 6.8902 6.8902 6.8905 6.8905 7.5046 7.5046 7.6787 7.6787 7.7644 7.7644 7.8922 7.8922 7.9743 7.9743 8.1044 8.1044 8.1907 8.1907 8.3602 8.3602 8.4584 8.4584 8.5763 8.5763 8.7197 8.7197 8.7841 8.7841 9.0293 9.0293 9.1130 9.1130 9.4927 9.4927 9.5790 9.5790 9.7149 9.7149 9.7414 9.7414 10.5278 10.5278 10.8648 10.8648 10.9602 10.9602 13.7389 13.7389 13.8160 13.8160 13.9241 13.9241 14.6807 14.6807 16.3838 16.3838 16.5125 16.5125 16.8938 16.8938 17.2897 17.2897 k = 0.0938 0.0937 0.0937 ( 5530 PWs) bands (ev): -2.2957 -2.2957 -0.4384 -0.4384 -0.4330 -0.4330 -0.4327 -0.4327 2.7973 2.7973 2.8882 2.8882 2.9839 2.9839 4.1066 4.1066 5.3456 5.3456 5.4541 5.4541 5.6038 5.6038 6.0580 6.0580 6.1510 6.1510 6.4762 6.4762 6.5609 6.5609 6.5690 6.5690 6.7728 6.7728 6.8448 6.8448 6.8831 6.8831 7.4742 7.4742 7.6737 7.6737 7.7263 7.7263 7.9028 7.9028 7.9831 7.9831 8.1123 8.1123 8.1924 8.1924 8.3858 8.3858 8.5044 8.5044 8.6313 8.6313 8.7514 8.7514 8.8331 8.8331 9.0474 9.0474 9.1450 9.1450 9.5044 9.5044 9.5835 9.5835 9.7555 9.7555 9.7703 9.7703 10.5696 10.5696 10.8973 10.8973 11.0031 11.0031 13.7252 13.7252 13.8194 13.8194 13.9215 13.9215 14.7148 14.7148 16.3309 16.3309 16.4830 16.4830 16.8267 16.8267 17.2073 17.2081 k = 0.1042 0.1042 0.1042 ( 5524 PWs) bands (ev): -2.2707 -2.2707 -0.4394 -0.4394 -0.4328 -0.4328 -0.4328 -0.4328 2.7754 2.7754 2.8603 2.8603 2.9788 2.9788 4.0166 4.0166 5.3603 5.3603 5.4726 5.4726 5.6354 5.6354 6.0486 6.0486 6.1487 6.1487 6.4080 6.4080 6.5477 6.5477 6.5612 6.5612 6.7638 6.7638 6.8022 6.8022 6.9062 6.9062 7.4338 7.4338 7.6638 7.6638 7.6929 7.6929 7.9165 7.9165 7.9980 7.9980 8.1170 8.1170 8.1979 8.1979 8.4137 8.4137 8.5373 8.5373 8.6976 8.6976 8.7797 8.7797 8.8768 8.8768 9.0744 9.0744 9.1795 9.1795 9.5162 9.5162 9.5934 9.5934 9.8010 9.8010 9.8051 9.8051 10.6121 10.6121 10.9323 10.9323 11.0444 11.0444 13.7125 13.7125 13.8244 13.8244 13.9202 13.9202 14.7498 14.7498 16.2749 16.2749 16.4489 16.4489 16.7509 16.7509 17.0943 17.0943 k = 0.1146 0.1146 0.1146 ( 5515 PWs) bands (ev): -2.2431 -2.2431 -0.4404 -0.4404 -0.4329 -0.4329 -0.4325 -0.4325 2.7510 2.7510 2.8300 2.8300 2.9735 2.9735 3.9250 3.9250 5.3748 5.3748 5.4888 5.4888 5.6648 5.6648 6.0365 6.0365 6.1420 6.1420 6.3450 6.3450 6.5326 6.5326 6.5534 6.5534 6.7468 6.7468 6.7641 6.7641 6.9437 6.9437 7.3840 7.3840 7.6524 7.6524 7.6683 7.6683 7.9328 7.9328 8.0159 8.0159 8.1183 8.1183 8.2085 8.2085 8.4429 8.4429 8.5641 8.5641 8.7624 8.7624 8.8063 8.8063 8.9142 8.9142 9.1131 9.1131 9.2159 9.2159 9.5268 9.5268 9.6113 9.6113 9.8452 9.8452 9.8506 9.8506 10.6544 10.6544 10.9695 10.9695 11.0832 11.0832 13.7013 13.7013 13.8313 13.8313 13.9205 13.9205 14.7852 14.7852 16.2162 16.2162 16.4096 16.4096 16.6682 16.6682 16.9783 16.9783 k = 0.1250 0.1250 0.1250 ( 5521 PWs) bands (ev): -2.2129 -2.2129 -0.4414 -0.4414 -0.4328 -0.4328 -0.4321 -0.4321 2.7243 2.7243 2.7977 2.7977 2.9677 2.9677 3.8323 3.8323 5.3887 5.3887 5.5026 5.5026 5.6893 5.6893 6.0215 6.0215 6.1321 6.1321 6.2896 6.2896 6.5157 6.5157 6.5444 6.5444 6.7319 6.7319 6.7323 6.7323 6.9815 6.9815 7.3294 7.3294 7.6418 7.6418 7.6534 7.6534 7.9515 7.9515 8.0349 8.0349 8.1169 8.1169 8.2240 8.2240 8.4721 8.4721 8.5881 8.5881 8.8186 8.8186 8.8324 8.8324 8.9454 8.9454 9.1635 9.1635 9.2538 9.2538 9.5365 9.5365 9.6382 9.6382 9.8901 9.8901 9.9033 9.9033 10.6957 10.6957 11.0083 11.0083 11.1186 11.1186 13.6922 13.6922 13.8405 13.8405 13.9226 13.9226 14.8203 14.8203 16.1549 16.1549 16.3640 16.3640 16.5815 16.5815 16.8655 16.8655 k = 0.1354 0.1354 0.1354 ( 5509 PWs) bands (ev): -2.1802 -2.1802 -0.4422 -0.4422 -0.4326 -0.4326 -0.4315 -0.4315 2.6954 2.6954 2.7634 2.7634 2.9614 2.9614 3.7390 3.7390 5.4017 5.4017 5.5133 5.5133 5.7058 5.7058 6.0038 6.0038 6.1212 6.1212 6.2432 6.2432 6.4973 6.4973 6.5323 6.5323 6.7092 6.7092 6.7224 6.7224 7.0081 7.0081 7.2799 7.2799 7.6333 7.6333 7.6476 7.6476 7.9722 7.9722 8.0540 8.0540 8.1140 8.1140 8.2439 8.2439 8.5001 8.5001 8.6100 8.6100 8.8595 8.8595 8.8641 8.8641 8.9724 8.9724 9.2217 9.2217 9.2933 9.2933 9.5478 9.5478 9.6738 9.6738 9.9388 9.9388 9.9579 9.9579 10.7350 10.7350 11.0486 11.0486 11.1503 11.1503 13.6857 13.6857 13.8524 13.8524 13.9270 13.9270 14.8542 14.8542 16.0912 16.0912 16.3113 16.3113 16.4937 16.4937 16.7575 16.7575 k = 0.1458 0.1458 0.1458 ( 5515 PWs) bands (ev): -2.1450 -2.1450 -0.4430 -0.4430 -0.4322 -0.4322 -0.4308 -0.4308 2.6644 2.6644 2.7273 2.7273 2.9542 2.9542 3.6453 3.6453 5.4135 5.4135 5.5202 5.5202 5.7108 5.7108 5.9835 5.9835 6.1128 6.1128 6.2062 6.2062 6.4784 6.4784 6.5153 6.5153 6.6971 6.6971 6.7189 6.7189 7.0076 7.0076 7.2519 7.2519 7.6277 7.6277 7.6497 7.6497 7.9947 7.9947 8.0730 8.0730 8.1108 8.1108 8.2679 8.2679 8.5257 8.5257 8.6299 8.6299 8.8885 8.8885 8.8995 8.8995 8.9976 8.9976 9.2801 9.2801 9.3346 9.3346 9.5644 9.5644 9.7174 9.7174 9.9904 9.9904 10.0132 10.0132 10.7711 10.7711 11.0899 11.0899 11.1783 11.1783 13.6820 13.6820 13.8673 13.8673 13.9340 13.9340 14.8863 14.8863 16.0251 16.0251 16.2500 16.2500 16.4076 16.4076 16.6560 16.6560 k = 0.1562 0.1562 0.1562 ( 5509 PWs) bands (ev): -2.1074 -2.1074 -0.4435 -0.4435 -0.4317 -0.4317 -0.4299 -0.4299 2.6316 2.6316 2.6895 2.6895 2.9461 2.9461 3.5517 3.5517 5.4238 5.4238 5.5225 5.5225 5.7029 5.7029 5.9609 5.9609 6.1087 6.1087 6.1790 6.1790 6.4597 6.4597 6.4929 6.4929 6.6963 6.6963 6.7211 6.7211 6.9715 6.9715 7.2553 7.2553 7.6254 7.6254 7.6587 7.6587 8.0180 8.0180 8.0916 8.0916 8.1083 8.1083 8.2959 8.2959 8.5480 8.5480 8.6476 8.6476 8.9200 8.9200 8.9266 8.9266 9.0231 9.0231 9.3308 9.3308 9.3781 9.3781 9.5904 9.5904 9.7686 9.7686 10.0440 10.0440 10.0679 10.0679 10.8028 10.8028 11.1319 11.1319 11.2032 11.2032 13.6813 13.6813 13.8855 13.8855 13.9439 13.9439 14.9157 14.9157 15.9565 15.9565 16.1793 16.1793 16.3259 16.3259 16.5623 16.5623 k = 0.1667 0.1667 0.1667 ( 5521 PWs) bands (ev): -2.0674 -2.0674 -0.4439 -0.4439 -0.4310 -0.4310 -0.4288 -0.4288 2.5969 2.5969 2.6501 2.6501 2.9366 2.9366 3.4583 3.4583 5.4325 5.4325 5.5190 5.5190 5.6837 5.6837 5.9368 5.9368 6.1028 6.1028 6.1668 6.1668 6.4419 6.4419 6.4665 6.4665 6.7052 6.7052 6.7289 6.7289 6.9122 6.9122 7.2795 7.2795 7.6264 7.6264 7.6737 7.6737 8.0404 8.0404 8.1087 8.1087 8.1099 8.1099 8.3279 8.3279 8.5668 8.5668 8.6632 8.6632 8.9469 8.9469 8.9540 8.9540 9.0502 9.0502 9.3682 9.3682 9.4241 9.4241 9.6285 9.6285 9.8264 9.8264 10.0987 10.0987 10.1208 10.1208 10.8288 10.8288 11.1743 11.1743 11.2258 11.2258 13.6837 13.6837 13.9074 13.9074 13.9571 13.9571 14.9416 14.9416 15.8853 15.8853 16.0992 16.0992 16.2511 16.2511 16.4765 16.4765 k = 0.1771 0.1771 0.1771 ( 5515 PWs) bands (ev): -2.0249 -2.0249 -0.4440 -0.4440 -0.4301 -0.4301 -0.4275 -0.4275 2.5607 2.5607 2.6094 2.6094 2.9256 2.9256 3.3654 3.3654 5.4392 5.4392 5.5083 5.5083 5.6581 5.6581 5.9116 5.9116 6.0872 6.0872 6.1732 6.1732 6.4249 6.4249 6.4379 6.4379 6.7217 6.7217 6.7417 6.7417 6.8449 6.8449 7.3117 7.3117 7.6310 7.6310 7.6938 7.6938 8.0575 8.0575 8.1159 8.1159 8.1280 8.1280 8.3639 8.3639 8.5821 8.5821 8.6768 8.6768 8.9620 8.9620 8.9903 8.9903 9.0792 9.0792 9.3921 9.3921 9.4731 9.4731 9.6772 9.6772 9.8895 9.8895 10.1537 10.1537 10.1709 10.1709 10.8482 10.8482 11.2169 11.2169 11.2473 11.2473 13.6890 13.6890 13.9330 13.9330 13.9737 13.9737 14.9628 14.9628 15.8114 15.8114 16.0110 16.0110 16.1857 16.1857 16.3979 16.3979 k = 0.1875 0.1875 0.1875 ( 5527 PWs) bands (ev): -1.9802 -1.9802 -0.4438 -0.4438 -0.4289 -0.4289 -0.4260 -0.4260 2.5230 2.5230 2.5675 2.5675 2.9126 2.9126 3.2734 3.2734 5.4439 5.4439 5.4889 5.4889 5.6314 5.6314 5.8861 5.8861 6.0658 6.0658 6.1890 6.1890 6.4085 6.4085 6.4087 6.4087 6.7441 6.7441 6.7571 6.7571 6.7812 6.7812 7.3459 7.3459 7.6389 7.6389 7.7178 7.7178 8.0657 8.0657 8.1337 8.1337 8.1461 8.1461 8.4036 8.4036 8.5943 8.5943 8.6890 8.6890 8.9730 8.9730 9.0285 9.0285 9.1100 9.1100 9.4068 9.4068 9.5250 9.5250 9.7322 9.7322 9.9552 9.9552 10.2085 10.2085 10.2175 10.2175 10.8604 10.8604 11.2594 11.2594 11.2686 11.2686 13.6968 13.6968 13.9626 13.9626 13.9938 13.9938 14.9786 14.9786 15.7351 15.7351 15.9165 15.9165 16.1316 16.1316 16.3245 16.3245 k = 0.1979 0.1979 0.1979 ( 5521 PWs) bands (ev): -1.9331 -1.9331 -0.4433 -0.4433 -0.4275 -0.4275 -0.4242 -0.4242 2.4839 2.4839 2.5245 2.5245 2.8972 2.8972 3.1825 3.1825 5.4463 5.4463 5.4607 5.4607 5.6069 5.6069 5.8609 5.8609 6.0431 6.0431 6.2037 6.2037 6.3791 6.3791 6.3925 6.3925 6.7191 6.7191 6.7709 6.7709 6.7842 6.7842 7.3802 7.3802 7.6501 7.6501 7.7447 7.7447 8.0675 8.0675 8.1590 8.1590 8.1640 8.1640 8.4463 8.4463 8.6038 8.6038 8.7004 8.7004 8.9809 8.9809 9.0680 9.0680 9.1420 9.1420 9.4167 9.4167 9.5800 9.5800 9.7900 9.7900 10.0208 10.0208 10.2599 10.2599 10.2625 10.2625 10.8655 10.8655 11.2907 11.2907 11.3016 11.3016 13.7065 13.7065 13.9960 13.9960 14.0175 14.0175 14.9881 14.9881 15.6571 15.6571 15.8181 15.8181 16.0902 16.0902 16.2545 16.2545 k = 0.2083 0.2083 0.2083 ( 5533 PWs) bands (ev): -1.8839 -1.8839 -0.4425 -0.4425 -0.4258 -0.4258 -0.4221 -0.4221 2.4438 2.4438 2.4806 2.4806 2.8790 2.8790 3.0931 3.0931 5.4257 5.4257 5.4463 5.4463 5.5851 5.5851 5.8368 5.8368 6.0205 6.0205 6.2099 6.2099 6.3502 6.3502 6.3743 6.3743 6.6781 6.6781 6.8014 6.8014 6.8108 6.8108 7.4139 7.4139 7.6642 7.6642 7.7735 7.7735 8.0671 8.0671 8.1820 8.1820 8.1879 8.1879 8.4909 8.4909 8.6112 8.6112 8.7119 8.7119 8.9864 8.9864 9.1083 9.1083 9.1744 9.1744 9.4254 9.4254 9.6378 9.6378 9.8483 9.8483 10.0832 10.0832 10.2978 10.2978 10.3150 10.3150 10.8653 10.8653 11.3139 11.3139 11.3431 11.3431 13.7176 13.7176 14.0330 14.0330 14.0447 14.0447 14.9908 14.9908 15.5780 15.5780 15.7177 15.7177 16.0620 16.0620 16.1861 16.1861 k = 0.2188 0.2187 0.2187 ( 5524 PWs) bands (ev): -1.8324 -1.8324 -0.4413 -0.4413 -0.4238 -0.4238 -0.4198 -0.4198 2.4026 2.4026 2.4359 2.4359 2.8571 2.8571 3.0059 3.0059 5.3868 5.3868 5.4437 5.4437 5.5650 5.5650 5.8144 5.8144 5.9984 5.9984 6.2023 6.2023 6.3221 6.3221 6.3527 6.3527 6.6593 6.6593 6.8347 6.8347 6.8421 6.8421 7.4471 7.4471 7.6811 7.6811 7.8032 7.8032 8.0665 8.0665 8.2000 8.2000 8.2182 8.2182 8.5355 8.5355 8.6170 8.6170 8.7246 8.7246 8.9898 8.9898 9.1490 9.1490 9.2056 9.2056 9.4362 9.4362 9.6981 9.6981 9.9056 9.9056 10.1409 10.1409 10.3311 10.3311 10.3639 10.3639 10.8628 10.8628 11.3378 11.3378 11.3839 11.3839 13.7293 13.7293 14.0734 14.0734 14.0750 14.0750 14.9868 14.9868 15.4988 15.4988 15.6168 15.6168 16.0470 16.0470 16.1183 16.1183 k = 0.2292 0.2292 0.2292 ( 5518 PWs) bands (ev): -1.7789 -1.7789 -0.4396 -0.4396 -0.4214 -0.4214 -0.4171 -0.4171 2.3606 2.3606 2.3907 2.3907 2.8294 2.8294 2.9228 2.9228 5.3465 5.3465 5.4383 5.4383 5.5453 5.5453 5.7942 5.7942 5.9766 5.9766 6.1787 6.1787 6.2951 6.2951 6.3290 6.3290 6.6637 6.6637 6.8703 6.8703 6.8772 6.8772 7.4800 7.4800 7.7005 7.7005 7.8331 7.8331 8.0666 8.0666 8.2179 8.2179 8.2491 8.2491 8.5775 8.5775 8.6216 8.6216 8.7402 8.7402 8.9917 8.9917 9.1898 9.1898 9.2336 9.2336 9.4522 9.4522 9.7603 9.7603 9.9600 9.9600 10.1937 10.1937 10.3601 10.3601 10.4057 10.4057 10.8624 10.8624 11.3622 11.3622 11.4237 11.4237 13.7408 13.7408 14.1082 14.1082 14.1165 14.1165 14.9765 14.9765 15.4202 15.4202 15.5164 15.5164 16.0441 16.0441 16.0501 16.0501 k = 0.2396 0.2396 0.2396 ( 5512 PWs) bands (ev): -1.7233 -1.7233 -0.4376 -0.4376 -0.4188 -0.4188 -0.4142 -0.4142 2.3180 2.3180 2.3450 2.3450 2.7887 2.7887 2.8509 2.8509 5.3068 5.3068 5.4301 5.4301 5.5253 5.5253 5.7768 5.7768 5.9541 5.9541 6.1420 6.1420 6.2691 6.2691 6.3062 6.3062 6.6864 6.6864 6.9077 6.9077 6.9161 6.9161 7.5127 7.5127 7.7221 7.7221 7.8622 7.8622 8.0683 8.0683 8.2357 8.2357 8.2801 8.2801 8.6138 8.6138 8.6255 8.6255 8.7607 8.7607 8.9920 8.9920 9.2302 9.2302 9.2565 9.2565 9.4761 9.4761 9.8238 9.8238 10.0096 10.0096 10.2434 10.2434 10.3856 10.3856 10.4357 10.4357 10.8695 10.8695 11.3861 11.3861 11.4620 11.4620 13.7513 13.7513 14.1435 14.1435 14.1616 14.1616 14.9607 14.9607 15.3430 15.3430 15.4173 15.4173 15.9812 15.9812 16.0519 16.0519 k = 0.2500 0.2500 0.2500 ( 5527 PWs) bands (ev): -1.6657 -1.6657 -0.4351 -0.4351 -0.4159 -0.4159 -0.4109 -0.4109 2.2749 2.2749 2.2990 2.2990 2.7246 2.7246 2.8006 2.8006 5.2688 5.2688 5.4190 5.4190 5.5047 5.5047 5.7623 5.7623 5.9291 5.9291 6.0991 6.0991 6.2443 6.2443 6.2855 6.2855 6.7213 6.7213 6.9467 6.9467 6.9582 6.9582 7.5453 7.5453 7.7456 7.7456 7.8899 7.8899 8.0722 8.0722 8.2534 8.2534 8.3108 8.3108 8.6289 8.6289 8.6425 8.6425 8.7868 8.7868 8.9910 8.9910 9.2696 9.2696 9.2734 9.2734 9.5088 9.5088 9.8877 9.8877 10.0519 10.0519 10.2929 10.2929 10.4088 10.4088 10.4503 10.4503 10.8885 10.8885 11.4091 11.4091 11.4987 11.4987 13.7600 13.7600 14.1803 14.1803 14.2078 14.2078 14.9405 14.9405 15.2673 15.2673 15.3201 15.3201 15.9115 15.9115 16.0677 16.0677 k = 0.2604 0.2604 0.2604 ( 5527 PWs) bands (ev): -1.6063 -1.6063 -0.4321 -0.4321 -0.4126 -0.4126 -0.4073 -0.4073 2.2314 2.2314 2.2530 2.2530 2.6481 2.6481 2.7605 2.7605 5.2333 5.2333 5.4053 5.4053 5.4834 5.4834 5.7510 5.7510 5.8987 5.8987 6.0581 6.0581 6.2208 6.2208 6.2664 6.2664 6.7635 6.7635 6.9870 6.9870 7.0032 7.0032 7.5780 7.5780 7.7705 7.7705 7.9152 7.9152 8.0791 8.0791 8.2708 8.2708 8.3410 8.3410 8.6321 8.6321 8.6638 8.6638 8.8168 8.8168 8.9886 8.9886 9.2852 9.2852 9.3075 9.3075 9.5494 9.5494 9.9510 9.9510 10.0852 10.0852 10.3453 10.3453 10.4314 10.4314 10.4494 10.4494 10.9202 10.9202 11.4303 11.4303 11.5334 11.5334 13.7664 13.7664 14.2176 14.2176 14.2541 14.2541 14.9170 14.9170 15.1932 15.1932 15.2253 15.2253 15.8409 15.8409 16.0585 16.0585 k = 0.2708 0.2708 0.2708 ( 5527 PWs) bands (ev): -1.5451 -1.5451 -0.4287 -0.4287 -0.4090 -0.4090 -0.4034 -0.4034 2.1879 2.1879 2.2070 2.2070 2.5698 2.5698 2.7203 2.7203 5.2009 5.2009 5.3892 5.3892 5.4616 5.4616 5.7427 5.7427 5.8603 5.8603 6.0252 6.0252 6.1985 6.1985 6.2482 6.2482 6.8102 6.8102 7.0284 7.0284 7.0509 7.0509 7.6106 7.6106 7.7966 7.7966 7.9376 7.9376 8.0896 8.0896 8.2879 8.2879 8.3703 8.3703 8.6355 8.6355 8.6801 8.6801 8.8471 8.8471 8.9850 8.9850 9.2937 9.2937 9.3428 9.3428 9.5948 9.5948 10.0127 10.0127 10.1095 10.1095 10.4017 10.4017 10.4378 10.4378 10.4554 10.4554 10.9616 10.9616 11.4494 11.4494 11.5658 11.5658 13.7700 13.7700 14.2545 14.2545 14.2992 14.2992 14.8909 14.8909 15.1204 15.1204 15.1332 15.1332 15.7696 15.7696 15.9790 15.9790 k = 0.2812 0.2812 0.2812 ( 5539 PWs) bands (ev): -1.4822 -1.4822 -0.4248 -0.4248 -0.4050 -0.4050 -0.3993 -0.3993 2.1444 2.1444 2.1614 2.1614 2.4922 2.4922 2.6773 2.6773 5.1718 5.1718 5.3712 5.3712 5.4392 5.4392 5.7370 5.7370 5.8144 5.8144 6.0021 6.0021 6.1776 6.1776 6.2306 6.2306 6.8595 6.8595 7.0707 7.0707 7.1007 7.1007 7.6430 7.6430 7.8236 7.8236 7.9568 7.9568 8.1041 8.1041 8.3045 8.3045 8.3984 8.3984 8.6392 8.6392 8.6938 8.6938 8.8741 8.8741 8.9801 8.9801 9.3005 9.3005 9.3743 9.3743 9.6409 9.6409 10.0717 10.0717 10.1268 10.1268 10.4194 10.4194 10.4646 10.4646 10.4832 10.4832 11.0087 11.0087 11.4657 11.4657 11.5955 11.5955 13.7704 13.7704 14.2898 14.2898 14.3417 14.3417 14.8629 14.8629 15.0445 15.0445 15.0485 15.0485 15.6980 15.6980 15.8946 15.8946 k = 0.2917 0.2917 0.2917 ( 5542 PWs) bands (ev): -1.4178 -1.4178 -0.4205 -0.4205 -0.4008 -0.4008 -0.3948 -0.3948 2.1012 2.1012 2.1161 2.1161 2.4164 2.4164 2.6308 2.6308 5.1464 5.1464 5.3518 5.3518 5.4165 5.4165 5.7338 5.7338 5.7639 5.7639 5.9870 5.9870 6.1579 6.1579 6.2135 6.2135 6.9106 6.9106 7.1138 7.1138 7.1524 7.1524 7.6749 7.6749 7.8509 7.8509 7.9730 7.9730 8.1224 8.1224 8.3205 8.3205 8.4251 8.4251 8.6434 8.6434 8.7065 8.7065 8.8948 8.8948 8.9749 8.9749 9.3059 9.3059 9.4005 9.4005 9.6829 9.6829 10.1274 10.1274 10.1408 10.1408 10.4044 10.4044 10.5171 10.5171 10.5295 10.5295 11.0579 11.0579 11.4790 11.4790 11.6223 11.6223 13.7676 13.7676 14.3224 14.3224 14.3797 14.3797 14.8332 14.8332 14.9596 14.9596 14.9772 14.9772 15.6265 15.6265 15.8095 15.8095 k = 0.3021 0.3021 0.3021 ( 5557 PWs) bands (ev): -1.3520 -1.3520 -0.4157 -0.4157 -0.3962 -0.3962 -0.3900 -0.3900 2.0584 2.0584 2.0715 2.0715 2.3426 2.3426 2.5806 2.5806 5.1246 5.1246 5.3314 5.3314 5.3935 5.3935 5.7120 5.7120 5.7324 5.7324 5.9777 5.9777 6.1396 6.1396 6.1968 6.1968 6.9627 6.9627 7.1578 7.1578 7.2056 7.2056 7.7060 7.7060 7.8785 7.8785 7.9873 7.9873 8.1436 8.1436 8.3359 8.3359 8.4501 8.4501 8.6482 8.6482 8.7192 8.7192 8.9066 8.9066 8.9709 8.9709 9.3094 9.3094 9.4201 9.4201 9.7148 9.7148 10.1560 10.1560 10.1800 10.1800 10.3970 10.3970 10.5587 10.5587 10.5974 10.5974 11.1068 11.1068 11.4890 11.4890 11.6458 11.6458 13.7615 13.7615 14.3509 14.3509 14.4110 14.4110 14.8014 14.8014 14.8799 14.8799 14.9065 14.9065 15.5556 15.5556 15.7247 15.7247 k = 0.3125 0.3125 0.3125 ( 5557 PWs) bands (ev): -1.2849 -1.2849 -0.4106 -0.4106 -0.3914 -0.3914 -0.3851 -0.3851 2.0162 2.0162 2.0277 2.0277 2.2711 2.2711 2.5267 2.5267 5.1063 5.1063 5.3105 5.3105 5.3705 5.3705 5.6608 5.6608 5.7326 5.7326 5.9723 5.9723 6.1227 6.1227 6.1806 6.1806 7.0157 7.0157 7.2025 7.2025 7.2599 7.2599 7.7358 7.7358 7.9058 7.9058 8.0009 8.0009 8.1667 8.1667 8.3506 8.3506 8.4732 8.4732 8.6539 8.6539 8.7326 8.7326 8.9071 8.9071 8.9704 8.9704 9.3093 9.3093 9.4314 9.4314 9.7310 9.7310 10.1769 10.1769 10.2308 10.2308 10.4027 10.4027 10.6083 10.6083 10.6670 10.6670 11.1537 11.1537 11.4960 11.4960 11.6659 11.6659 13.7523 13.7523 14.3736 14.3736 14.4321 14.4321 14.7646 14.7646 14.8077 14.8077 14.8395 14.8395 15.4858 15.4858 15.6411 15.6411 k = 0.3229 0.3229 0.3229 ( 5545 PWs) bands (ev): -1.2168 -1.2168 -0.4050 -0.4050 -0.3863 -0.3863 -0.3799 -0.3799 1.9749 1.9749 1.9849 1.9849 2.2022 2.2022 2.4693 2.4693 5.0916 5.0916 5.2894 5.2894 5.3474 5.3474 5.6117 5.6117 5.7340 5.7340 5.9698 5.9698 6.1072 6.1072 6.1649 6.1649 7.0692 7.0692 7.2479 7.2479 7.3150 7.3150 7.7638 7.7638 7.9327 7.9327 8.0151 8.0151 8.1905 8.1905 8.3644 8.3644 8.4944 8.4944 8.6603 8.6603 8.7468 8.7468 8.8976 8.8976 8.9731 8.9731 9.3036 9.3036 9.4336 9.4336 9.7284 9.7284 10.2061 10.2061 10.2816 10.2816 10.4252 10.4252 10.6652 10.6652 10.7375 10.7375 11.1976 11.1976 11.5000 11.5000 11.6825 11.6825 13.7405 13.7405 14.3885 14.3885 14.4378 14.4378 14.7135 14.7135 14.7472 14.7472 14.7863 14.7863 15.4177 15.4177 15.5595 15.5595 k = 0.3333 0.3333 0.3333 ( 5532 PWs) bands (ev): -1.1478 -1.1478 -0.3991 -0.3991 -0.3810 -0.3810 -0.3745 -0.3745 1.9346 1.9346 1.9433 1.9433 2.1360 2.1360 2.4087 2.4087 5.0802 5.0802 5.2684 5.2684 5.3244 5.3244 5.5654 5.5654 5.7362 5.7362 5.9695 5.9695 6.0931 6.0931 6.1499 6.1499 7.1234 7.1234 7.2941 7.2941 7.3705 7.3705 7.7894 7.7894 7.9589 7.9589 8.0307 8.0307 8.2144 8.2144 8.3773 8.3773 8.5136 8.5136 8.6675 8.6675 8.7619 8.7619 8.8817 8.8817 8.9767 8.9767 9.2907 9.2907 9.4262 9.4262 9.7079 9.7079 10.2440 10.2440 10.3343 10.3343 10.4652 10.4653 10.7279 10.7279 10.8082 10.8082 11.2378 11.2378 11.5017 11.5017 11.6956 11.6956 13.7262 13.7262 14.3927 14.3927 14.4216 14.4216 14.6438 14.6438 14.7042 14.7042 14.7526 14.7526 15.3519 15.3519 15.4808 15.4808 k = 0.3438 0.3437 0.3437 ( 5544 PWs) bands (ev): -1.0783 -1.0783 -0.3930 -0.3930 -0.3754 -0.3754 -0.3689 -0.3689 1.8955 1.8955 1.9030 1.9030 2.0727 2.0727 2.3454 2.3454 5.0717 5.0717 5.2479 5.2479 5.3016 5.3016 5.5224 5.5224 5.7389 5.7389 5.9708 5.9708 6.0805 6.0805 6.1354 6.1354 7.1781 7.1781 7.3410 7.3410 7.4263 7.4263 7.8123 7.8123 7.9842 7.9842 8.0484 8.0484 8.2376 8.2376 8.3893 8.3893 8.5308 8.5308 8.6754 8.6754 8.7771 8.7771 8.8625 8.8625 8.9799 8.9799 9.2696 9.2696 9.4096 9.4096 9.6731 9.6731 10.2899 10.2899 10.3901 10.3901 10.5208 10.5208 10.7950 10.7950 10.8785 10.8785 11.2733 11.2733 11.5021 11.5021 11.7051 11.7051 13.7100 13.7100 14.3814 14.3814 14.3831 14.3831 14.5648 14.5648 14.6803 14.6803 14.7321 14.7321 15.2888 15.2888 15.4056 15.4056 k = 0.3542 0.3542 0.3542 ( 5547 PWs) bands (ev): -1.0083 -1.0083 -0.3866 -0.3866 -0.3698 -0.3698 -0.3633 -0.3633 1.8579 1.8579 1.8642 1.8642 2.0123 2.0123 2.2797 2.2797 5.0660 5.0660 5.2281 5.2281 5.2789 5.2789 5.4832 5.4832 5.7419 5.7419 5.9733 5.9733 6.0693 6.0693 6.1216 6.1216 7.2335 7.2335 7.3886 7.3886 7.4821 7.4821 7.8322 7.8322 8.0084 8.0084 8.0685 8.0685 8.2597 8.2597 8.4003 8.4003 8.5459 8.5459 8.6837 8.6837 8.7901 8.7901 8.8436 8.8436 8.9825 8.9825 9.2404 9.2404 9.3845 9.3845 9.6280 9.6280 10.3431 10.3431 10.4495 10.4495 10.5881 10.5881 10.8651 10.8651 10.9479 10.9479 11.3036 11.3036 11.5025 11.5025 11.7114 11.7114 13.6922 13.6922 14.3225 14.3225 14.3564 14.3564 14.4829 14.4829 14.6700 14.6700 14.7213 14.7213 15.2289 15.2289 15.3347 15.3347 k = 0.3646 0.3646 0.3646 ( 5553 PWs) bands (ev): -0.9384 -0.9384 -0.3802 -0.3802 -0.3640 -0.3640 -0.3577 -0.3577 1.8218 1.8218 1.8272 1.8272 1.9552 1.9552 2.2123 2.2123 5.0626 5.0626 5.2091 5.2091 5.2565 5.2565 5.4478 5.4478 5.7449 5.7449 5.9769 5.9769 6.0595 6.0595 6.1086 6.1086 7.2894 7.2894 7.4367 7.4367 7.5377 7.5377 7.8493 7.8493 8.0315 8.0315 8.0909 8.0909 8.2804 8.2804 8.4104 8.4104 8.5587 8.5587 8.6921 8.6921 8.7919 8.7919 8.8347 8.8347 8.9843 8.9843 9.2041 9.2041 9.3523 9.3523 9.5760 9.5760 10.4030 10.4030 10.5122 10.5122 10.6627 10.6627 10.9370 10.9370 11.0158 11.0158 11.3276 11.3276 11.5050 11.5050 11.7145 11.7145 13.6732 13.6732 14.2523 14.2523 14.3101 14.3101 14.4029 14.4029 14.6659 14.6659 14.7189 14.7189 15.1725 15.1725 15.2684 15.2684 k = 0.3750 0.3750 0.3750 ( 5559 PWs) bands (ev): -0.8688 -0.8688 -0.3736 -0.3736 -0.3581 -0.3581 -0.3521 -0.3521 1.7874 1.7874 1.7920 1.7920 1.9014 1.9014 2.1438 2.1438 5.0612 5.0612 5.1910 5.1910 5.2345 5.2345 5.4164 5.4164 5.7477 5.7477 5.9811 5.9811 6.0512 6.0512 6.0964 6.0964 7.3459 7.3459 7.4853 7.4853 7.5927 7.5927 7.8641 7.8641 8.0536 8.0536 8.1150 8.1150 8.2994 8.2994 8.4196 8.4196 8.5686 8.5686 8.7001 8.7001 8.7764 8.7764 8.8422 8.8422 8.9856 8.9856 9.1627 9.1627 9.3145 9.3145 9.5194 9.5194 10.4685 10.4685 10.5773 10.5773 10.7410 10.7410 11.0098 11.0098 11.0816 11.0816 11.3448 11.3448 11.5115 11.5115 11.7150 11.7150 13.6534 13.6534 14.1758 14.1758 14.2432 14.2432 14.3288 14.3288 14.6633 14.6633 14.7229 14.7229 15.1200 15.1200 15.2069 15.2069 k = 0.3854 0.3854 0.3854 ( 5550 PWs) bands (ev): -0.8000 -0.8000 -0.3672 -0.3672 -0.3523 -0.3523 -0.3465 -0.3465 1.7551 1.7551 1.7588 1.7588 1.8510 1.8510 2.0749 2.0749 5.0613 5.0613 5.1741 5.1741 5.2131 5.2131 5.3888 5.3888 5.7503 5.7503 5.9858 5.9858 6.0442 6.0442 6.0850 6.0850 7.4029 7.4029 7.5343 7.5343 7.6470 7.6470 7.8771 7.8771 8.0745 8.0745 8.1405 8.1405 8.3167 8.3167 8.4279 8.4279 8.5749 8.5749 8.7070 8.7070 8.7556 8.7556 8.8537 8.8537 8.9864 8.9864 9.1189 9.1189 9.2730 9.2730 9.4603 9.4603 10.5384 10.5384 10.6437 10.6437 10.8195 10.8195 11.0828 11.0828 11.1447 11.1447 11.3563 11.3563 11.5230 11.5230 11.7132 11.7132 13.6330 13.6330 14.0960 14.0960 14.1612 14.1612 14.2587 14.2587 14.6602 14.6602 14.7314 14.7314 15.0715 15.0715 15.1502 15.1502 k = 0.3958 0.3958 0.3958 ( 5562 PWs) bands (ev): -0.7326 -0.7326 -0.3609 -0.3609 -0.3465 -0.3465 -0.3411 -0.3411 1.7248 1.7248 1.7279 1.7279 1.8044 1.8044 2.0063 2.0063 5.0627 5.0627 5.1584 5.1584 5.1925 5.1925 5.3651 5.3651 5.7525 5.7525 5.9908 5.9908 6.0385 6.0385 6.0745 6.0745 7.4603 7.4603 7.5832 7.5832 7.6998 7.6998 7.8892 7.8892 8.0946 8.0946 8.1668 8.1668 8.3322 8.3322 8.4354 8.4354 8.5762 8.5762 8.7118 8.7118 8.7356 8.7356 8.8611 8.8611 8.9866 8.9866 9.0772 9.0772 9.2295 9.2295 9.4001 9.4001 10.6111 10.6111 10.7101 10.7101 10.8947 10.8947 11.1553 11.1553 11.2039 11.2039 11.3655 11.3655 11.5391 11.5391 11.7097 11.7097 13.6124 13.6124 14.0146 14.0146 14.0723 14.0723 14.1886 14.1886 14.6556 14.6556 14.7426 14.7426 15.0272 15.0272 15.0981 15.0981 k = 0.4062 0.4062 0.4062 ( 5565 PWs) bands (ev): -0.6671 -0.6671 -0.3549 -0.3549 -0.3408 -0.3408 -0.3360 -0.3360 1.6968 1.6968 1.6994 1.6994 1.7615 1.7615 1.9390 1.9390 5.0648 5.0648 5.1440 5.1440 5.1729 5.1729 5.3448 5.3448 5.7543 5.7543 5.9958 5.9958 6.0340 6.0340 6.0649 6.0649 7.5179 7.5179 7.6317 7.6317 7.7502 7.7502 7.9015 7.9015 8.1141 8.1141 8.1935 8.1935 8.3460 8.3460 8.4421 8.4421 8.5716 8.5716 8.7133 8.7133 8.7185 8.7185 8.8570 8.8570 8.9867 8.9867 9.0443 9.0443 9.1861 9.1861 9.3404 9.3404 10.6848 10.6848 10.7750 10.7750 10.9626 10.9626 11.2267 11.2267 11.2566 11.2566 11.3786 11.3786 11.5586 11.5586 11.7050 11.7050 13.5918 13.5918 13.9329 13.9329 13.9814 13.9814 14.1173 14.1173 14.6492 14.6492 14.7552 14.7552 14.9873 14.9873 15.0504 15.0504 k = 0.4167 0.4167 0.4167 ( 5547 PWs) bands (ev): -0.6043 -0.6043 -0.3492 -0.3492 -0.3353 -0.3353 -0.3311 -0.3311 1.6713 1.6713 1.6734 1.6734 1.7226 1.7226 1.8738 1.8738 5.0674 5.0674 5.1309 5.1309 5.1547 5.1547 5.3279 5.3279 5.7557 5.7557 6.0008 6.0008 6.0305 6.0305 6.0563 6.0563 7.5755 7.5755 7.6792 7.6792 7.7964 7.7964 7.9157 7.9157 8.1335 8.1335 8.2205 8.2205 8.3581 8.3581 8.4481 8.4481 8.5608 8.5608 8.7046 8.7046 8.7099 8.7099 8.8347 8.8347 8.9887 8.9887 9.0255 9.0255 9.1449 9.1449 9.2826 9.2826 10.7578 10.7578 10.8371 10.8371 11.0192 11.0192 11.2961 11.2961 11.2995 11.2995 11.4038 11.4038 11.5799 11.5799 11.6998 11.6998 13.5714 13.5714 13.8524 13.8524 13.8914 13.8914 14.0458 14.0458 14.6412 14.6412 14.7683 14.7683 14.9520 14.9520 15.0071 15.0071 k = 0.4271 0.4271 0.4271 ( 5550 PWs) bands (ev): -0.5450 -0.5450 -0.3440 -0.3440 -0.3301 -0.3301 -0.3266 -0.3266 1.6484 1.6484 1.6501 1.6501 1.6879 1.6879 1.8119 1.8119 5.0701 5.0701 5.1193 5.1193 5.1381 5.1381 5.3140 5.3140 5.7567 5.7567 6.0055 6.0055 6.0279 6.0279 6.0486 6.0486 7.6326 7.6326 7.7250 7.7250 7.8350 7.8350 7.9347 7.9347 8.1532 8.1532 8.2479 8.2479 8.3686 8.3686 8.4534 8.4534 8.5451 8.5451 8.6922 8.6922 8.7001 8.7001 8.7955 8.7955 8.9945 8.9945 9.0182 9.0182 9.1082 9.1082 9.2281 9.2281 10.8282 10.8282 10.8949 10.8949 11.0607 11.0607 11.3327 11.3327 11.3627 11.3627 11.4442 11.4442 11.6020 11.6020 11.6946 11.6946 13.5513 13.5513 13.7742 13.7742 13.8044 13.8044 13.9760 13.9760 14.6318 14.6318 14.7812 14.7812 14.9215 14.9215 14.9680 14.9680 k = 0.4375 0.4375 0.4375 ( 5538 PWs) bands (ev): -0.4902 -0.4902 -0.3392 -0.3392 -0.3253 -0.3253 -0.3225 -0.3225 1.6283 1.6283 1.6296 1.6296 1.6574 1.6574 1.7544 1.7544 5.0727 5.0727 5.1091 5.1091 5.1232 5.1232 5.3028 5.3028 5.7573 5.7573 6.0098 6.0098 6.0261 6.0261 6.0419 6.0419 7.6885 7.6885 7.7681 7.7681 7.8627 7.8627 7.9610 7.9610 8.1738 8.1738 8.2760 8.2760 8.3777 8.3777 8.4580 8.4580 8.5268 8.5268 8.6785 8.6785 8.6828 8.6828 8.7470 8.7470 9.0026 9.0026 9.0171 9.0171 9.0778 9.0778 9.1789 9.1789 10.8940 10.8940 10.9472 10.9472 11.0863 11.0863 11.3625 11.3625 11.4252 11.4252 11.4937 11.4937 11.6238 11.6238 11.6902 11.6902 13.5316 13.5316 13.7002 13.7002 13.7224 13.7224 13.9100 13.9100 14.6214 14.6214 14.7934 14.7934 14.8959 14.8959 14.9333 14.9333 k = 0.4479 0.4479 0.4479 ( 5547 PWs) bands (ev): -0.4410 -0.4410 -0.3350 -0.3350 -0.3210 -0.3210 -0.3189 -0.3189 1.6110 1.6110 1.6120 1.6120 1.6313 1.6313 1.7025 1.7025 5.0751 5.0751 5.1004 5.1004 5.1104 5.1104 5.2940 5.2940 5.7577 5.7577 6.0137 6.0137 6.0248 6.0248 6.0362 6.0362 7.7424 7.7424 7.8073 7.8073 7.8801 7.8801 7.9931 7.9931 8.1961 8.1961 8.3053 8.3053 8.3851 8.3851 8.4621 8.4621 8.5080 8.5080 8.6577 8.6577 8.6607 8.6607 8.6960 8.6960 9.0092 9.0092 9.0201 9.0201 9.0547 9.0547 9.1367 9.1367 10.9533 10.9533 10.9928 10.9928 11.0991 11.0991 11.3919 11.3919 11.4820 11.4820 11.5457 11.5457 11.6445 11.6445 11.6871 11.6871 13.5124 13.5124 13.6320 13.6320 13.6474 13.6474 13.8502 13.8502 14.6106 14.6106 14.8043 14.8043 14.8750 14.8750 14.9032 14.9032 k = 0.4583 0.4583 0.4583 ( 5544 PWs) bands (ev): -0.3988 -0.3988 -0.3312 -0.3312 -0.3173 -0.3173 -0.3159 -0.3159 1.5967 1.5967 1.5975 1.5975 1.6098 1.6098 1.6576 1.6576 5.0771 5.0771 5.0933 5.0933 5.0998 5.0998 5.2873 5.2873 5.7580 5.7580 6.0170 6.0170 6.0240 6.0240 6.0315 6.0315 7.7926 7.7926 7.8413 7.8413 7.8909 7.8909 8.0259 8.0259 8.2202 8.2202 8.3358 8.3358 8.3910 8.3910 8.4656 8.4656 8.4911 8.4911 8.6262 8.6262 8.6344 8.6344 8.6490 8.6490 9.0128 9.0128 9.0250 9.0250 9.0385 9.0385 9.1038 9.1038 11.0042 11.0042 11.0309 11.0309 11.1035 11.1035 11.4196 11.4196 11.5310 11.5310 11.5953 11.5953 11.6632 11.6632 11.6862 11.6862 13.4942 13.4942 13.5717 13.5717 13.5815 13.5815 13.7987 13.7987 14.6002 14.6002 14.8138 14.8138 14.8587 14.8587 14.8780 14.8780 k = 0.4688 0.4687 0.4687 ( 5544 PWs) bands (ev): -0.3650 -0.3650 -0.3275 -0.3275 -0.3143 -0.3143 -0.3135 -0.3135 1.5855 1.5855 1.5860 1.5860 1.5930 1.5930 1.6208 1.6208 5.0786 5.0786 5.0877 5.0877 5.0914 5.0914 5.2824 5.2824 5.7580 5.7580 6.0196 6.0196 6.0235 6.0235 6.0278 6.0278 7.8373 7.8373 7.8689 7.8689 7.8978 7.8978 8.0551 8.0551 8.2459 8.2459 8.3654 8.3654 8.3973 8.3973 8.4688 8.4688 8.4788 8.4788 8.5910 8.5910 8.5946 8.5946 8.6137 8.6137 9.0149 9.0149 9.0271 9.0271 9.0280 9.0280 9.0824 9.0824 11.0453 11.0453 11.0609 11.0609 11.1035 11.1035 11.4435 11.4435 11.5695 11.5695 11.6385 11.6385 11.6789 11.6789 11.6882 11.6882 13.4777 13.4777 13.5215 13.5215 13.5269 13.5269 13.7575 13.7575 14.5910 14.5910 14.8215 14.8215 14.8465 14.8465 14.8580 14.8580 k = 0.4792 0.4792 0.4792 ( 5544 PWs) bands (ev): -0.3424 -0.3424 -0.3222 -0.3222 -0.3121 -0.3121 -0.3117 -0.3117 1.5774 1.5774 1.5778 1.5778 1.5809 1.5809 1.5936 1.5936 5.0797 5.0797 5.0837 5.0837 5.0854 5.0854 5.2791 5.2791 5.7580 5.7580 6.0215 6.0215 6.0233 6.0233 6.0252 6.0252 7.8733 7.8733 7.8892 7.8892 7.9023 7.9023 8.0779 8.0779 8.2712 8.2712 8.3799 8.3799 8.4177 8.4177 8.4720 8.4720 8.4733 8.4733 8.5561 8.5561 8.5563 8.5563 8.5787 8.5787 9.0164 9.0164 9.0218 9.0218 9.0241 9.0241 9.0728 9.0728 11.0754 11.0754 11.0825 11.0825 11.1019 11.1019 11.4620 11.4620 11.5957 11.5957 11.6722 11.6722 11.6909 11.6909 11.6930 11.6930 13.4641 13.4641 13.4835 13.4835 13.4860 13.4860 13.7277 13.7277 14.5838 14.5838 14.8271 14.8271 14.8382 14.8382 14.8435 14.8435 k = 0.4896 0.4896 0.4896 ( 5520 PWs) bands (ev): -0.3333 -0.3333 -0.3142 -0.3142 -0.3108 -0.3108 -0.3107 -0.3107 1.5725 1.5725 1.5729 1.5729 1.5736 1.5736 1.5768 1.5768 5.0803 5.0803 5.0813 5.0813 5.0817 5.0817 5.2772 5.2772 5.7580 5.7580 6.0227 6.0227 6.0231 6.0231 6.0236 6.0236 7.8972 7.8972 7.9014 7.9014 7.9048 7.9048 8.0925 8.0925 8.2914 8.2914 8.3797 8.3797 8.4524 8.4524 8.4751 8.4751 8.4758 8.4758 8.5275 8.5275 8.5276 8.5276 8.5416 8.5416 9.0173 9.0173 9.0186 9.0186 9.0196 9.0196 9.0704 9.0704 11.0937 11.0937 11.0955 11.0955 11.1004 11.1004 11.4737 11.4737 11.6098 11.6098 11.6936 11.6936 11.6984 11.6984 11.6985 11.6985 13.4551 13.4551 13.4599 13.4599 13.4605 13.4605 13.7098 13.7098 14.5791 14.5791 14.8305 14.8305 14.8333 14.8333 14.8347 14.8347 k = 0.5000 0.5000 0.5000 ( 5520 PWs) bands (ev): -0.3315 -0.3315 -0.3103 -0.3103 -0.3103 -0.3103 -0.3103 -0.3103 1.5706 1.5706 1.5713 1.5713 1.5713 1.5713 1.5713 1.5713 5.0805 5.0805 5.0805 5.0805 5.0805 5.0805 5.2766 5.2766 5.7580 5.7580 6.0231 6.0231 6.0231 6.0231 6.0231 6.0231 7.9056 7.9056 7.9056 7.9056 7.9056 7.9056 8.0974 8.0974 8.2996 8.2996 8.3784 8.3784 8.4784 8.4784 8.4784 8.4784 8.4784 8.4784 8.5152 8.5152 8.5152 8.5152 8.5152 8.5152 9.0177 9.0177 9.0177 9.0177 9.0177 9.0177 9.0701 9.0701 11.0998 11.0998 11.0998 11.0998 11.0998 11.0998 11.4777 11.4777 11.6141 11.6141 11.7009 11.7009 11.7009 11.7009 11.7009 11.7009 13.4518 13.4518 13.4518 13.4518 13.4518 13.4518 13.7039 13.7039 14.5775 14.5775 14.8317 14.8317 14.8317 14.8317 14.8317 14.8317 k = 0.5000 0.5000 0.5000 ( 5520 PWs) bands (ev): -0.3315 -0.3315 -0.3103 -0.3103 -0.3103 -0.3103 -0.3103 -0.3103 1.5706 1.5706 1.5713 1.5713 1.5713 1.5713 1.5713 1.5713 5.0805 5.0805 5.0805 5.0805 5.0805 5.0805 5.2766 5.2766 5.7580 5.7580 6.0231 6.0231 6.0231 6.0231 6.0231 6.0231 7.9056 7.9056 7.9056 7.9056 7.9056 7.9056 8.0974 8.0974 8.2996 8.2996 8.3784 8.3784 8.4784 8.4784 8.4784 8.4784 8.4784 8.4784 8.5152 8.5152 8.5152 8.5152 8.5152 8.5152 9.0177 9.0177 9.0177 9.0177 9.0177 9.0177 9.0701 9.0701 11.0998 11.0998 11.0998 11.0998 11.0998 11.0998 11.4777 11.4777 11.6141 11.6141 11.7009 11.7009 11.7009 11.7009 11.7009 11.7009 13.4518 13.4518 13.4518 13.4518 13.4518 13.4518 13.7039 13.7039 14.5775 14.5775 14.8317 14.8317 14.8317 14.8317 14.8317 14.8317 k = 0.4875 0.5000 0.4875 ( 5520 PWs) bands (ev): -0.3331 -0.3331 -0.3137 -0.3137 -0.3117 -0.3117 -0.3101 -0.3101 1.5722 1.5722 1.5726 1.5726 1.5752 1.5752 1.5753 1.5753 5.0805 5.0805 5.0810 5.0810 5.0817 5.0817 5.2772 5.2772 5.7580 5.7580 6.0228 6.0228 6.0231 6.0231 6.0236 6.0236 7.8975 7.8975 7.9025 7.9025 7.9038 7.9038 8.0926 8.0926 8.2918 8.2918 8.3797 8.3797 8.4586 8.4586 8.4598 8.4598 8.4881 8.4881 8.5183 8.5183 8.5368 8.5368 8.5374 8.5374 9.0174 9.0174 9.0188 9.0188 9.0194 9.0194 9.0703 9.0703 11.0936 11.0936 11.0968 11.0968 11.0994 11.0994 11.4738 11.4738 11.6101 11.6101 11.6948 11.6948 11.6967 11.6967 11.6994 11.6994 13.4558 13.4558 13.4582 13.4582 13.4607 13.4607 13.7096 13.7096 14.5791 14.5791 14.8310 14.8310 14.8328 14.8328 14.8345 14.8345 k = 0.4750 0.5000 0.4750 ( 5544 PWs) bands (ev): -0.3397 -0.3397 -0.3238 -0.3238 -0.3145 -0.3145 -0.3094 -0.3094 1.5762 1.5762 1.5767 1.5767 1.5874 1.5874 1.5875 1.5875 5.0804 5.0804 5.0827 5.0827 5.0853 5.0853 5.2790 5.2790 5.7581 5.7581 6.0219 6.0219 6.0231 6.0231 6.0250 6.0250 7.8745 7.8745 7.8935 7.8935 7.8987 7.8987 8.0786 8.0786 8.2728 8.2728 8.3808 8.3808 8.4314 8.4314 8.4341 8.4341 8.5133 8.5133 8.5276 8.5276 8.5707 8.5707 8.5731 8.5731 9.0165 9.0165 9.0213 9.0213 9.0247 9.0247 9.0721 9.0721 11.0752 11.0752 11.0877 11.0877 11.0983 11.0983 11.4618 11.4618 11.5977 11.5977 11.6769 11.6769 11.6857 11.6857 11.6953 11.6953 13.4674 13.4674 13.4765 13.4765 13.4867 13.4867 13.7266 13.7266 14.5836 14.5836 14.8290 14.8290 14.8363 14.8363 14.8429 14.8429 k = 0.4625 0.5000 0.4625 ( 5552 PWs) bands (ev): -0.3535 -0.3535 -0.3403 -0.3403 -0.3159 -0.3159 -0.3083 -0.3083 1.5828 1.5828 1.5836 1.5836 1.6072 1.6072 1.6078 1.6078 5.0804 5.0804 5.0854 5.0854 5.0913 5.0913 5.2821 5.2821 5.7580 5.7580 6.0204 6.0204 6.0232 6.0232 6.0273 6.0273 7.8394 7.8394 7.8782 7.8782 7.8905 7.8905 8.0562 8.0562 8.2494 8.2494 8.3733 8.3733 8.4117 8.4117 8.4128 8.4128 8.5425 8.5425 8.5474 8.5474 8.6042 8.6042 8.6114 8.6114 9.0151 9.0151 9.0229 9.0229 9.0342 9.0342 9.0789 9.0789 11.0446 11.0446 11.0717 11.0717 11.0958 11.0958 11.4408 11.4408 11.5764 11.5764 11.6486 11.6486 11.6724 11.6724 11.6891 11.6891 13.4862 13.4862 13.5049 13.5049 13.5281 13.5281 13.7548 13.7548 14.5908 14.5908 14.8256 14.8256 14.8424 14.8424 14.8565 14.8565 k = 0.4500 0.5000 0.4500 ( 5556 PWs) bands (ev): -0.3743 -0.3743 -0.3627 -0.3627 -0.3156 -0.3156 -0.3068 -0.3068 1.5920 1.5920 1.5931 1.5931 1.6341 1.6341 1.6355 1.6355 5.0803 5.0803 5.0890 5.0890 5.0997 5.0997 5.2866 5.2866 5.7580 5.7580 6.0183 6.0183 6.0234 6.0234 6.0305 6.0305 7.7955 7.7955 7.8566 7.8566 7.8794 7.8794 8.0275 8.0275 8.2261 8.2261 8.3523 8.3523 8.3930 8.3930 8.4067 8.4067 8.5610 8.5610 8.5859 8.5859 8.6341 8.6341 8.6507 8.6507 9.0137 9.0137 9.0207 9.0207 9.0488 9.0488 9.0946 9.0946 11.0025 11.0025 11.0477 11.0477 11.0914 11.0914 11.4100 11.4100 11.5467 11.5467 11.6119 11.6119 11.6613 11.6613 11.6819 11.6819 13.5113 13.5113 13.5411 13.5411 13.5827 13.5827 13.7936 13.7936 14.6002 14.6002 14.8211 14.8211 14.8514 14.8514 14.8751 14.8751 k = 0.4375 0.5000 0.4375 ( 5554 PWs) bands (ev): -0.4009 -0.4009 -0.3904 -0.3904 -0.3144 -0.3144 -0.3049 -0.3049 1.6038 1.6038 1.6054 1.6054 1.6675 1.6675 1.6699 1.6699 5.0804 5.0804 5.0933 5.0933 5.1105 5.1105 5.2927 5.2927 5.7578 5.7578 6.0156 6.0156 6.0237 6.0237 6.0346 6.0346 7.7456 7.7456 7.8287 7.8287 7.8659 7.8659 7.9949 7.9949 8.2046 8.2046 8.3259 8.3259 8.3774 8.3774 8.4040 8.4040 8.5800 8.5800 8.6249 8.6249 8.6596 8.6596 8.6902 8.6902 9.0125 9.0125 9.0146 9.0146 9.0694 9.0694 9.1207 9.1207 10.9495 10.9495 11.0148 11.0148 11.0842 11.0842 11.3693 11.3693 11.5109 11.5109 11.5688 11.5688 11.6546 11.6546 11.6750 11.6750 13.5417 13.5417 13.5822 13.5822 13.6479 13.6479 13.8423 13.8423 14.6115 14.6115 14.8155 14.8155 14.8636 14.8636 14.8982 14.8982 k = 0.4250 0.5000 0.4250 ( 5542 PWs) bands (ev): -0.4324 -0.4324 -0.4227 -0.4227 -0.3124 -0.3124 -0.3026 -0.3026 1.6182 1.6182 1.6203 1.6203 1.7067 1.7067 1.7101 1.7101 5.0805 5.0805 5.0983 5.0983 5.1237 5.1237 5.3006 5.3006 5.7575 5.7575 6.0125 6.0125 6.0243 6.0243 6.0396 6.0396 7.6916 7.6916 7.7946 7.7946 7.8505 7.8505 7.9609 7.9609 8.1852 8.1852 8.2983 8.2983 8.3637 8.3637 8.4008 8.4008 8.5964 8.5964 8.6561 8.6561 8.6863 8.6863 8.7291 8.7291 9.0062 9.0062 9.0123 9.0123 9.0966 9.0966 9.1563 9.1563 10.8866 10.8866 10.9719 10.9719 11.0733 11.0733 11.3203 11.3203 11.4714 11.4714 11.5212 11.5212 11.6531 11.6531 11.6695 11.6695 13.5762 13.5762 13.6258 13.6258 13.7211 13.7211 13.8995 13.8995 14.6241 14.6241 14.8091 14.8091 14.8796 14.8796 14.9252 14.9252 k = 0.4125 0.5000 0.4125 ( 5538 PWs) bands (ev): -0.4679 -0.4679 -0.4589 -0.4589 -0.3099 -0.3099 -0.2998 -0.2998 1.6351 1.6351 1.6379 1.6379 1.7508 1.7508 1.7555 1.7555 5.0809 5.0809 5.1038 5.1038 5.1392 5.1392 5.3106 5.3106 5.7570 5.7570 6.0088 6.0088 6.0252 6.0252 6.0455 6.0455 7.6352 7.6352 7.7548 7.7548 7.8336 7.8336 7.9274 7.9274 8.1674 8.1674 8.2700 8.2700 8.3513 8.3513 8.3963 8.3963 8.6082 8.6082 8.6700 8.6700 8.7216 8.7216 8.7662 8.7662 8.9976 8.9976 9.0142 9.0142 9.1305 9.1305 9.1999 9.1999 10.8151 10.8151 10.9186 10.9186 11.0580 11.0580 11.2658 11.2658 11.4296 11.4296 11.4708 11.4708 11.6563 11.6563 11.6664 11.6664 13.6136 13.6136 13.6700 13.6700 13.8000 13.8000 13.9635 13.9635 14.6379 14.6379 14.8022 14.8022 14.8994 14.8994 14.9554 14.9554 k = 0.4000 0.5000 0.4000 ( 5558 PWs) bands (ev): -0.5067 -0.5067 -0.4983 -0.4983 -0.3069 -0.3069 -0.2967 -0.2967 1.6545 1.6545 1.6581 1.6581 1.7991 1.7991 1.8052 1.8052 5.0815 5.0815 5.1095 5.1095 5.1570 5.1570 5.3229 5.3229 5.7561 5.7561 6.0047 6.0047 6.0265 6.0265 6.0523 6.0523 7.5773 7.5773 7.7104 7.7104 7.8157 7.8157 7.8954 7.8954 8.1509 8.1509 8.2410 8.2410 8.3393 8.3393 8.3908 8.3908 8.6145 8.6145 8.6727 8.6727 8.7577 8.7577 8.7997 8.7997 8.9913 8.9913 9.0198 9.0198 9.1707 9.1707 9.2498 9.2498 10.7365 10.7365 10.8554 10.8554 11.0378 11.0378 11.2085 11.2085 11.3859 11.3859 11.4189 11.4189 11.6636 11.6636 11.6663 11.6663 13.6526 13.6526 13.7135 13.7135 13.8827 13.8827 14.0320 14.0320 14.6530 14.6530 14.7950 14.7950 14.9231 14.9231 14.9881 14.9881 k = 0.3875 0.5000 0.3875 ( 5566 PWs) bands (ev): -0.5480 -0.5480 -0.5402 -0.5402 -0.3036 -0.3036 -0.2933 -0.2933 1.6764 1.6764 1.6808 1.6808 1.8507 1.8507 1.8584 1.8584 5.0825 5.0825 5.1155 5.1155 5.1772 5.1772 5.3376 5.3376 5.7549 5.7549 6.0002 6.0002 6.0283 6.0283 6.0599 6.0599 7.5189 7.5189 7.6626 7.6626 7.7971 7.7971 7.8653 7.8653 8.1349 8.1349 8.2108 8.2108 8.3274 8.3274 8.3842 8.3842 8.6153 8.6153 8.6684 8.6684 8.7878 8.7878 8.8270 8.8270 8.9910 8.9910 9.0310 9.0310 9.2160 9.2160 9.3044 9.3044 10.6523 10.6523 10.7835 10.7835 11.0125 11.0125 11.1506 11.1506 11.3407 11.3407 11.3663 11.3663 11.6694 11.6694 11.6742 11.6742 13.6921 13.6921 13.7552 13.7552 13.9671 13.9671 14.1024 14.1024 14.6699 14.6699 14.7883 14.7883 14.9505 14.9505 15.0226 15.0226 k = 0.3750 0.5000 0.3750 ( 5574 PWs) bands (ev): -0.5914 -0.5914 -0.5842 -0.5842 -0.2998 -0.2998 -0.2895 -0.2895 1.7006 1.7006 1.7060 1.7060 1.9050 1.9050 1.9144 1.9144 5.0839 5.0839 5.1216 5.1216 5.1997 5.1997 5.3548 5.3548 5.7532 5.7532 5.9953 5.9953 6.0308 6.0308 6.0683 6.0683 7.4606 7.4606 7.6127 7.6127 7.7783 7.7783 7.8369 7.8369 8.1191 8.1191 8.1791 8.1791 8.3151 8.3151 8.3768 8.3768 8.6113 8.6113 8.6588 8.6588 8.8071 8.8071 8.8464 8.8464 9.0005 9.0005 9.0493 9.0493 9.2653 9.2653 9.3624 9.3624 10.5640 10.5640 10.7046 10.7046 10.9825 10.9825 11.0933 11.0933 11.2943 11.2943 11.3138 11.3138 11.6753 11.6753 11.6870 11.6870 13.7308 13.7308 13.7942 13.7942 14.0516 14.0516 14.1721 14.1721 14.6897 14.6897 14.7826 14.7826 14.9808 14.9808 15.0580 15.0580 k = 0.3625 0.5000 0.3625 ( 5562 PWs) bands (ev): -0.6362 -0.6362 -0.6295 -0.6295 -0.2957 -0.2957 -0.2853 -0.2853 1.7272 1.7272 1.7336 1.7336 1.9613 1.9613 1.9725 1.9725 5.0860 5.0860 5.1279 5.1279 5.2243 5.2243 5.3747 5.3747 5.7509 5.7509 5.9902 5.9902 6.0339 6.0339 6.0776 6.0776 7.4029 7.4029 7.5619 7.5619 7.7594 7.7594 7.8101 7.8101 8.1028 8.1028 8.1458 8.1458 8.3021 8.3021 8.3685 8.3685 8.6033 8.6033 8.6450 8.6450 8.8139 8.8139 8.8574 8.8574 9.0211 9.0211 9.0743 9.0743 9.3172 9.3172 9.4225 9.4225 10.4732 10.4732 10.6209 10.6209 10.9485 10.9485 11.0372 11.0372 11.2473 11.2473 11.2620 11.2620 11.6834 11.6834 11.7010 11.7010 13.7678 13.7678 13.8298 13.8298 14.1344 14.1344 14.2385 14.2385 14.7138 14.7138 14.7791 14.7791 15.0135 15.0135 15.0937 15.0937 k = 0.3500 0.5000 0.3500 ( 5560 PWs) bands (ev): -0.6821 -0.6821 -0.6758 -0.6758 -0.2913 -0.2913 -0.2809 -0.2809 1.7560 1.7560 1.7636 1.7636 2.0188 2.0188 2.0320 2.0320 5.0886 5.0886 5.1345 5.1345 5.2511 5.2511 5.3971 5.3971 5.7480 5.7480 5.9847 5.9847 6.0380 6.0380 6.0875 6.0875 7.3464 7.3464 7.5109 7.5109 7.7407 7.7407 7.7848 7.7848 8.0856 8.0856 8.1105 8.1105 8.2881 8.2881 8.3595 8.3595 8.5922 8.5922 8.6277 8.6277 8.8107 8.8107 8.8616 8.8616 9.0500 9.0500 9.1040 9.1040 9.3705 9.3705 9.4836 9.4836 10.3813 10.3813 10.5344 10.5344 10.9112 10.9112 10.9829 10.9829 11.2001 11.2001 11.2114 11.2114 11.6928 11.6928 11.7152 11.7152 13.8020 13.8020 13.8613 13.8613 14.2133 14.2133 14.2987 14.2987 14.7441 14.7441 14.7791 14.7791 15.0477 15.0477 15.1289 15.1289 k = 0.3375 0.5000 0.3375 ( 5566 PWs) bands (ev): -0.7284 -0.7284 -0.7226 -0.7226 -0.2865 -0.2865 -0.2762 -0.2762 1.7869 1.7869 1.7959 1.7959 2.0770 2.0770 2.0924 2.0924 5.0921 5.0921 5.1414 5.1414 5.2799 5.2799 5.4221 5.4221 5.7444 5.7444 5.9790 5.9790 6.0430 6.0430 6.0982 6.0982 7.2914 7.2914 7.4605 7.4605 7.7222 7.7222 7.7607 7.7607 8.0673 8.0673 8.0732 8.0732 8.2731 8.2731 8.3496 8.3496 8.5786 8.5786 8.6078 8.6078 8.8015 8.8015 8.8608 8.8608 9.0828 9.0828 9.1359 9.1359 9.4241 9.4241 9.5449 9.5449 10.2896 10.2896 10.4470 10.4470 10.8715 10.8715 10.9307 10.9307 11.1533 11.1533 11.1624 11.1624 11.7024 11.7024 11.7285 11.7285 13.8326 13.8326 13.8883 13.8883 14.2861 14.2861 14.3506 14.3506 14.7816 14.7816 14.7845 14.7845 15.0826 15.0826 15.1630 15.1630 k = 0.3250 0.5000 0.3250 ( 5558 PWs) bands (ev): -0.7750 -0.7750 -0.7696 -0.7696 -0.2815 -0.2815 -0.2712 -0.2712 1.8199 1.8199 1.8304 1.8304 2.1354 2.1354 2.1530 2.1530 5.0965 5.0965 5.1488 5.1488 5.3106 5.3106 5.4492 5.4492 5.7401 5.7401 5.9731 5.9731 6.0490 6.0490 6.1096 6.1096 7.2383 7.2383 7.4112 7.4112 7.7040 7.7040 7.7377 7.7377 8.0339 8.0339 8.0473 8.0473 8.2569 8.2569 8.3388 8.3388 8.5631 8.5631 8.5858 8.5858 8.7894 8.7894 8.8569 8.8569 9.1159 9.1159 9.1675 9.1675 9.4766 9.4766 9.6055 9.6055 10.1997 10.1997 10.3606 10.3606 10.8305 10.8305 10.8809 10.8809 11.1076 11.1076 11.1155 11.1155 11.7112 11.7112 11.7401 11.7401 13.8589 13.8589 13.9106 13.9106 14.3498 14.3498 14.3931 14.3931 14.7976 14.7976 14.8267 14.8267 15.1176 15.1176 15.1959 15.1959 k = 0.3125 0.5000 0.3125 ( 5556 PWs) bands (ev): -0.8214 -0.8214 -0.8164 -0.8164 -0.2763 -0.2763 -0.2661 -0.2661 1.8549 1.8549 1.8670 1.8670 2.1934 2.1934 2.2134 2.2134 5.1018 5.1018 5.1568 5.1568 5.3430 5.3430 5.4784 5.4784 5.7352 5.7352 5.9671 5.9671 6.0562 6.0562 6.1216 6.1216 7.1875 7.1875 7.3635 7.3635 7.6861 7.6861 7.7155 7.7155 7.9927 7.9927 8.0255 8.0255 8.2396 8.2396 8.3270 8.3270 8.5462 8.5462 8.5625 8.5625 8.7760 8.7760 8.8510 8.8510 9.1469 9.1469 9.1971 9.1971 9.5268 9.5268 9.6641 9.6641 10.1132 10.1132 10.2770 10.2770 10.7889 10.7889 10.8338 10.8338 11.0637 11.0637 11.0712 11.0712 11.7181 11.7181 11.7490 11.7490 13.8803 13.8803 13.9279 13.9279 14.4020 14.4020 14.4265 14.4265 14.8202 14.8202 14.8778 14.8778 15.1528 15.1528 15.2274 15.2274 k = 0.3000 0.5000 0.3000 ( 5556 PWs) bands (ev): -0.8674 -0.8674 -0.8628 -0.8628 -0.2709 -0.2709 -0.2607 -0.2607 1.8918 1.8918 1.9055 1.9055 2.2505 2.2505 2.2732 2.2732 5.1081 5.1081 5.1657 5.1657 5.3768 5.3768 5.5092 5.5092 5.7297 5.7297 5.9611 5.9611 6.0648 6.0648 6.1342 6.1342 7.1395 7.1395 7.3176 7.3176 7.6683 7.6683 7.6939 7.6939 7.9499 7.9499 8.0016 8.0016 8.2211 8.2211 8.3140 8.3140 8.5283 8.5283 8.5385 8.5385 8.7623 8.7623 8.8438 8.8438 9.1741 9.1741 9.2232 9.2232 9.5731 9.5731 9.7187 9.7187 10.0326 10.0326 10.1980 10.1980 10.7476 10.7476 10.7896 10.7896 11.0226 11.0226 11.0302 11.0302 11.7222 11.7222 11.7544 11.7544 13.8965 13.8965 13.9404 13.9404 14.4414 14.4414 14.4520 14.4520 14.8527 14.8527 14.9320 14.9320 15.1887 15.1887 15.2583 15.2583 k = 0.2875 0.5000 0.2875 ( 5558 PWs) bands (ev): -0.9128 -0.9128 -0.9085 -0.9085 -0.2653 -0.2653 -0.2552 -0.2552 1.9303 1.9303 1.9459 1.9459 2.3064 2.3064 2.3318 2.3318 5.1156 5.1156 5.1754 5.1754 5.4118 5.4118 5.5411 5.5411 5.7238 5.7238 5.9551 5.9551 6.0748 6.0748 6.1473 6.1473 7.0944 7.0944 7.2739 7.2739 7.6503 7.6503 7.6725 7.6725 7.9059 7.9059 7.9756 7.9756 8.2017 8.2017 8.2997 8.2997 8.5096 8.5096 8.5143 8.5143 8.7487 8.7487 8.8358 8.8358 9.1958 9.1958 9.2449 9.2449 9.6132 9.6132 9.7641 9.7641 9.9636 9.9636 10.1259 10.1259 10.7071 10.7071 10.7484 10.7484 10.9852 10.9852 10.9931 10.9931 11.7225 11.7225 11.7555 11.7555 13.9077 13.9077 13.9484 13.9484 14.4690 14.4690 14.4712 14.4712 14.8927 14.8927 14.9849 14.9849 15.2271 15.2271 15.2898 15.2898 k = 0.2750 0.5000 0.2750 ( 5558 PWs) bands (ev): -0.9573 -0.9573 -0.9533 -0.9533 -0.2595 -0.2595 -0.2496 -0.2496 1.9704 1.9704 1.9880 1.9880 2.3606 2.3606 2.3889 2.3889 5.1243 5.1243 5.1862 5.1862 5.4474 5.4474 5.5732 5.5732 5.7179 5.7179 5.9493 5.9493 6.0865 6.0865 6.1610 6.1610 7.0528 7.0528 7.2325 7.2325 7.6315 7.6315 7.6509 7.6509 7.8614 7.8614 7.9476 7.9476 8.1815 8.1815 8.2841 8.2841 8.4903 8.4903 8.4904 8.4904 8.7356 8.7356 8.8274 8.8274 9.2110 9.2110 9.2612 9.2612 9.6441 9.6441 9.7823 9.7823 9.9245 9.9245 10.0641 10.0641 10.6679 10.6679 10.7099 10.7099 10.9527 10.9527 10.9606 10.9606 11.7184 11.7184 11.7518 11.7518 13.9141 13.9141 13.9526 13.9526 14.4856 14.4856 14.4871 14.4871 14.9358 14.9358 15.0321 15.0321 15.2708 15.2708 15.3240 15.3240 k = 0.2625 0.5000 0.2625 ( 5546 PWs) bands (ev): -1.0007 -1.0007 -0.9970 -0.9970 -0.2536 -0.2536 -0.2439 -0.2439 2.0120 2.0120 2.0317 2.0317 2.4128 2.4128 2.4442 2.4442 5.1341 5.1341 5.1980 5.1980 5.4831 5.4831 5.6042 5.6042 5.7130 5.7130 5.9440 5.9440 6.1001 6.1001 6.1752 6.1752 7.0149 7.0149 7.1937 7.1937 7.6111 7.6111 7.6285 7.6285 7.8175 7.8175 7.9180 7.9180 8.1607 8.1607 8.2671 8.2671 8.4673 8.4673 8.4707 8.4707 8.7230 8.7230 8.8189 8.8189 9.2186 9.2186 9.2715 9.2715 9.6614 9.6614 9.7533 9.7533 9.9354 9.9354 10.0167 10.0167 10.6305 10.6305 10.6740 10.6740 10.9262 10.9262 10.9334 10.9334 11.7093 11.7093 11.7427 11.7427 13.9164 13.9164 13.9537 13.9537 14.4964 14.4964 14.4988 14.4988 14.9770 14.9770 15.0697 15.0697 15.3223 15.3223 15.3635 15.3635 k = 0.2500 0.5000 0.2500 ( 5528 PWs) bands (ev): -1.0428 -1.0428 -1.0394 -1.0394 -0.2477 -0.2477 -0.2381 -0.2381 2.0547 2.0547 2.0768 2.0768 2.4628 2.4628 2.4974 2.4974 5.1450 5.1450 5.2109 5.2109 5.5181 5.5181 5.6311 5.6311 5.7113 5.7113 5.9394 5.9394 6.1161 6.1161 6.1900 6.1900 6.9810 6.9810 7.1574 7.1574 7.5879 7.5879 7.6049 7.6049 7.7758 7.7758 7.8877 7.8877 8.1396 8.1396 8.2485 8.2485 8.4453 8.4453 8.4509 8.4509 8.7108 8.7108 8.8104 8.8104 9.2178 9.2178 9.2755 9.2755 9.6610 9.6610 9.7037 9.7037 9.9697 9.9697 9.9875 9.9875 10.5952 10.5952 10.6404 10.6404 10.9065 10.9065 10.9122 10.9122 11.6948 11.6948 11.7281 11.7281 13.9154 13.9154 13.9523 13.9523 14.5042 14.5042 14.5063 14.5063 15.0120 15.0120 15.0966 15.0966 15.3821 15.3821 15.4104 15.4104 k = 0.2375 0.5000 0.2375 ( 5540 PWs) bands (ev): -1.0836 -1.0836 -1.0805 -1.0805 -0.2417 -0.2417 -0.2324 -0.2324 2.0985 2.0985 2.1231 2.1231 2.5103 2.5103 2.5482 2.5482 5.1571 5.1571 5.2247 5.2247 5.5516 5.5516 5.6485 5.6485 5.7177 5.7177 5.9361 5.9361 6.1347 6.1347 6.2053 6.2053 6.9513 6.9513 7.1237 7.1237 7.5604 7.5604 7.5794 7.5794 7.7382 7.7382 7.8577 7.8577 8.1181 8.1181 8.2284 8.2284 8.4244 8.4244 8.4311 8.4311 8.6990 8.6990 8.8022 8.8022 9.2086 9.2086 9.2731 9.2731 9.6432 9.6432 9.6537 9.6537 9.9760 9.9760 10.0066 10.0066 10.5624 10.5624 10.6088 10.6088 10.8942 10.8942 10.8975 10.8975 11.6747 11.6747 11.7078 11.7078 13.9120 13.9120 13.9495 13.9495 14.5097 14.5097 14.5110 14.5110 15.0387 15.0387 15.1142 15.1142 15.4488 15.4488 15.4655 15.4655 k = 0.2250 0.5000 0.2250 ( 5548 PWs) bands (ev): -1.1229 -1.1229 -1.1200 -1.1200 -0.2357 -0.2357 -0.2266 -0.2266 2.1431 2.1431 2.1703 2.1703 2.5551 2.5551 2.5964 2.5964 5.1701 5.1701 5.2394 5.2394 5.5822 5.5822 5.6531 5.6531 5.7348 5.7348 5.9346 5.9346 6.1564 6.1564 6.2212 6.2212 6.9262 6.9262 7.0925 7.0925 7.5277 7.5277 7.5515 7.5515 7.7061 7.7061 7.8291 7.8291 8.0965 8.0965 8.2068 8.2068 8.4050 8.4050 8.4114 8.4114 8.6874 8.6874 8.7943 8.7943 9.1915 9.1915 9.2646 9.2646 9.6081 9.6081 9.6129 9.6129 9.9765 9.9765 10.0398 10.0398 10.5328 10.5328 10.5794 10.5794 10.8893 10.8893 10.8894 10.8894 11.6492 11.6492 11.6820 11.6820 13.9074 13.9074 13.9460 13.9460 14.5132 14.5132 14.5140 14.5140 15.0573 15.0573 15.1246 15.1246 15.5203 15.5203 15.5284 15.5284 k = 0.2125 0.5000 0.2125 ( 5544 PWs) bands (ev): -1.1606 -1.1606 -1.1579 -1.1579 -0.2297 -0.2297 -0.2209 -0.2209 2.1883 2.1883 2.2183 2.2183 2.5971 2.5971 2.6419 2.6419 5.1840 5.1840 5.2548 5.2548 5.6087 5.6087 5.6498 5.6498 5.7572 5.7572 5.9357 5.9357 6.1815 6.1815 6.2377 6.2377 6.9057 6.9057 7.0636 7.0636 7.4898 7.4898 7.5211 7.5211 7.6801 7.6801 7.8030 7.8030 8.0745 8.0745 8.1838 8.1838 8.3870 8.3870 8.3920 8.3920 8.6759 8.6759 8.7867 8.7867 9.1678 9.1678 9.2505 9.2505 9.5677 9.5677 9.5767 9.5767 9.9819 9.9819 10.0665 10.0665 10.5070 10.5070 10.5523 10.5523 10.8879 10.8879 10.8913 10.8913 11.6186 11.6186 11.6512 11.6512 13.9025 13.9025 13.9426 13.9426 14.5151 14.5151 14.5156 14.5156 15.0689 15.0689 15.1299 15.1299 15.5946 15.5946 15.5974 15.5974 k = 0.2000 0.5000 0.2000 ( 5528 PWs) bands (ev): -1.1965 -1.1965 -1.1941 -1.1941 -0.2238 -0.2238 -0.2154 -0.2154 2.2338 2.2338 2.2667 2.2667 2.6363 2.6363 2.6847 2.6847 5.1986 5.1986 5.2706 5.2706 5.6299 5.6299 5.6434 5.6434 5.7798 5.7798 5.9401 5.9401 6.2102 6.2102 6.2550 6.2550 6.8897 6.8897 7.0367 7.0367 7.4483 7.4483 7.4887 7.4887 7.6594 7.6594 7.7799 7.7799 8.0524 8.0524 8.1595 8.1595 8.3706 8.3706 8.3729 8.3729 8.6644 8.6644 8.7794 8.7794 9.1394 9.1394 9.2315 9.2315 9.5319 9.5319 9.5392 9.5392 9.9871 9.9871 10.0851 10.0851 10.4856 10.4856 10.5278 10.5278 10.8927 10.8927 10.8995 10.8995 11.5836 11.5836 11.6163 11.6163 13.8982 13.8982 13.9398 13.9398 14.5155 14.5155 14.5161 14.5161 15.0754 15.0754 15.1316 15.1316 15.6705 15.6705 15.6706 15.6706 k = 0.1875 0.5000 0.1875 ( 5532 PWs) bands (ev): -1.2307 -1.2307 -1.2284 -1.2284 -0.2180 -0.2180 -0.2099 -0.2099 2.2794 2.2794 2.3154 2.3154 2.6725 2.6725 2.7245 2.7245 5.2138 5.2138 5.2863 5.2863 5.6361 5.6361 5.6446 5.6446 5.8001 5.8001 5.9482 5.9482 6.2423 6.2423 6.2728 6.2728 6.8781 6.8781 7.0116 7.0116 7.4055 7.4055 7.4551 7.4551 7.6427 7.6427 7.7602 7.7602 8.0301 8.0301 8.1342 8.1342 8.3544 8.3544 8.3559 8.3559 8.6525 8.6525 8.7725 8.7725 9.1082 9.1082 9.2086 9.2086 9.4997 9.4997 9.5026 9.5026 9.9891 9.9891 10.0944 10.0944 10.4691 10.4691 10.5061 10.5061 10.9030 10.9030 10.9126 10.9126 11.5452 11.5452 11.5781 11.5781 13.8951 13.8951 13.9382 13.9382 14.5147 14.5147 14.5156 14.5156 15.0781 15.0781 15.1309 15.1309 15.7462 15.7462 15.7470 15.7470 k = 0.1750 0.5000 0.1750 ( 5532 PWs) bands (ev): -1.2629 -1.2629 -1.2608 -1.2608 -0.2124 -0.2124 -0.2046 -0.2046 2.3247 2.3247 2.3638 2.3638 2.7059 2.7059 2.7614 2.7614 5.2292 5.2292 5.3015 5.3015 5.6288 5.6288 5.6527 5.6527 5.8175 5.8175 5.9596 5.9596 6.2773 6.2773 6.2911 6.2911 6.8705 6.8705 6.9876 6.9876 7.3637 7.3637 7.4217 7.4217 7.6288 7.6288 7.7438 7.7438 8.0076 8.0076 8.1082 8.1082 8.3366 8.3366 8.3429 8.3429 8.6403 8.6403 8.7657 8.7657 9.0761 9.0761 9.1827 9.1827 9.4684 9.4684 9.4701 9.4701 9.9864 9.9864 10.0944 10.0944 10.4569 10.4569 10.4869 10.4869 10.9181 10.9181 10.9296 10.9296 11.5044 11.5044 11.5379 11.5379 13.8937 13.8937 13.9380 13.9380 14.5127 14.5127 14.5143 14.5143 15.0784 15.0784 15.1284 15.1284 15.8228 15.8228 15.8232 15.8232 k = 0.1625 0.5000 0.1625 ( 5536 PWs) bands (ev): -1.2932 -1.2932 -1.2913 -1.2913 -0.2069 -0.2069 -0.1996 -0.1996 2.3694 2.3694 2.4117 2.4117 2.7365 2.7365 2.7954 2.7954 5.2447 5.2447 5.3157 5.3157 5.6224 5.6224 5.6548 5.6548 5.8318 5.8318 5.9736 5.9736 6.3096 6.3096 6.3144 6.3144 6.8661 6.8661 6.9643 6.9643 7.3252 7.3252 7.3900 7.3900 7.6167 7.6167 7.7305 7.7305 7.9851 7.9851 8.0819 8.0819 8.3195 8.3195 8.3317 8.3317 8.6276 8.6276 8.7590 8.7590 9.0444 9.0444 9.1547 9.1547 9.4370 9.4370 9.4427 9.4427 9.9787 9.9787 10.0859 10.0859 10.4478 10.4478 10.4697 10.4697 10.9370 10.9370 10.9493 10.9493 11.4627 11.4627 11.4971 11.4971 13.8944 13.8944 13.9395 13.9395 14.5097 14.5097 14.5121 14.5121 15.0769 15.0769 15.1247 15.1247 15.8986 15.8986 15.8993 15.8993 k = 0.1500 0.5000 0.1500 ( 5536 PWs) bands (ev): -1.3214 -1.3214 -1.3197 -1.3197 -0.2017 -0.2017 -0.1947 -0.1947 2.4132 2.4132 2.4585 2.4585 2.7644 2.7644 2.8264 2.8264 5.2600 5.2600 5.3284 5.3284 5.6171 5.6171 5.6517 5.6517 5.8434 5.8434 5.9889 5.9889 6.3279 6.3279 6.3524 6.3524 6.8640 6.8640 6.9412 6.9412 7.2921 7.2921 7.3616 7.3616 7.6060 7.6060 7.7200 7.7200 7.9626 7.9626 8.0559 8.0559 8.3034 8.3034 8.3224 8.3224 8.6144 8.6144 8.7522 8.7522 9.0142 9.0142 9.1254 9.1254 9.4086 9.4086 9.4172 9.4172 9.9662 9.9662 10.0706 10.0706 10.4399 10.4399 10.4536 10.4536 10.9587 10.9587 10.9707 10.9707 11.4215 11.4215 11.4571 11.4571 13.8971 13.8971 13.9426 13.9426 14.5059 14.5059 14.5091 14.5091 15.0745 15.0745 15.1202 15.1202 15.9724 15.9724 15.9746 15.9746 k = 0.1375 0.5000 0.1375 ( 5540 PWs) bands (ev): -1.3476 -1.3476 -1.3461 -1.3461 -0.1967 -0.1967 -0.1902 -0.1902 2.4557 2.4557 2.5039 2.5039 2.7898 2.7898 2.8546 2.8546 5.2748 5.2748 5.3390 5.3390 5.6132 5.6132 5.6449 5.6449 5.8529 5.8529 6.0041 6.0041 6.3454 6.3454 6.3902 6.3902 6.8626 6.8626 6.9180 6.9180 7.2665 7.2665 7.3376 7.3376 7.5961 7.5961 7.7121 7.7121 7.9403 7.9403 8.0305 8.0305 8.2883 8.2883 8.3150 8.3150 8.6006 8.6006 8.7450 8.7450 8.9861 8.9861 9.0957 9.0957 9.3833 9.3833 9.3934 9.3934 9.9498 9.9498 10.0502 10.0502 10.4315 10.4315 10.4376 10.4376 10.9824 10.9824 10.9927 10.9927 11.3820 11.3820 11.4193 11.4193 13.9020 13.9020 13.9472 13.9472 14.5012 14.5012 14.5053 14.5053 15.0715 15.0715 15.1150 15.1150 16.0441 16.0441 16.0478 16.0478 k = 0.1250 0.5000 0.1250 ( 5540 PWs) bands (ev): -1.3717 -1.3717 -1.3703 -1.3703 -0.1919 -0.1919 -0.1860 -0.1860 2.4965 2.4965 2.5472 2.5472 2.8131 2.8131 2.8799 2.8799 5.2888 5.2888 5.3472 5.3472 5.6107 5.6107 5.6356 5.6356 5.8611 5.8611 6.0182 6.0182 6.3618 6.3618 6.4264 6.4264 6.8607 6.8607 6.8947 6.8947 7.2501 7.2501 7.3190 7.3190 7.5871 7.5871 7.7067 7.7067 7.9183 7.9183 8.0061 8.0061 8.2744 8.2744 8.3094 8.3094 8.5864 8.5864 8.7370 8.7370 8.9606 8.9606 9.0661 9.0661 9.3611 9.3611 9.3716 9.3716 9.9305 9.9305 10.0263 10.0263 10.4209 10.4209 10.4211 10.4211 11.0071 11.0071 11.0145 11.0145 11.3457 11.3457 11.3848 11.3848 13.9089 13.9089 13.9532 13.9532 14.4959 14.4959 14.5007 14.5007 15.0682 15.0682 15.1094 15.1094 16.1131 16.1131 16.1179 16.1179 k = 0.1125 0.5000 0.1125 ( 5538 PWs) bands (ev): -1.3935 -1.3935 -1.3923 -1.3923 -0.1875 -0.1875 -0.1821 -0.1821 2.5354 2.5354 2.5879 2.5879 2.8343 2.8343 2.9024 2.9024 5.3018 5.3018 5.3529 5.3529 5.6094 5.6094 5.6249 5.6249 5.8688 5.8688 6.0303 6.0303 6.3769 6.3769 6.4596 6.4596 6.8571 6.8571 6.8716 6.8716 7.2436 7.2436 7.3057 7.3057 7.5792 7.5792 7.7038 7.7038 7.8968 7.8968 7.9832 7.9832 8.2618 8.2618 8.3055 8.3055 8.5721 8.5721 8.7280 8.7280 8.9379 8.9379 9.0371 9.0371 9.3419 9.3419 9.3517 9.3517 9.9092 9.9092 10.0002 10.0002 10.4032 10.4032 10.4081 10.4081 11.0319 11.0319 11.0354 11.0354 11.3135 11.3135 11.3545 11.3545 13.9175 13.9175 13.9603 13.9603 14.4900 14.4900 14.4954 14.4954 15.0650 15.0650 15.1035 15.1035 16.1785 16.1785 16.1841 16.1841 k = 0.1000 0.5000 0.1000 ( 5542 PWs) bands (ev): -1.4132 -1.4132 -1.4121 -1.4121 -0.1834 -0.1834 -0.1785 -0.1785 2.5718 2.5718 2.6252 2.6252 2.8540 2.8540 2.9221 2.9221 5.3135 5.3135 5.3561 5.3561 5.6088 5.6088 5.6138 5.6138 5.8767 5.8767 6.0396 6.0396 6.3907 6.3907 6.4886 6.4886 6.8495 6.8495 6.8513 6.8513 7.2464 7.2464 7.2976 7.2976 7.5727 7.5727 7.7035 7.7035 7.8759 7.8759 7.9619 7.9619 8.2509 8.2509 8.3030 8.3030 8.5581 8.5581 8.7176 8.7176 8.9182 8.9182 9.0094 9.0094 9.3255 9.3255 9.3341 9.3341 9.8870 9.8870 9.9728 9.9728 10.3843 10.3843 10.3924 10.3924 11.0548 11.0548 11.0559 11.0559 11.2861 11.2861 11.3289 11.3289 13.9275 13.9275 13.9682 13.9682 14.4837 14.4837 14.4896 14.4896 15.0619 15.0619 15.0975 15.0975 16.2398 16.2398 16.2456 16.2456 k = 0.0875 0.5000 0.0875 ( 5532 PWs) bands (ev): -1.4306 -1.4306 -1.4296 -1.4296 -0.1797 -0.1797 -0.1754 -0.1754 2.6056 2.6056 2.6584 2.6584 2.8724 2.8724 2.9389 2.9389 5.3237 5.3237 5.3574 5.3574 5.6032 5.6032 5.6082 5.6082 5.8855 5.8855 6.0455 6.0455 6.4035 6.4035 6.5121 6.5121 6.8293 6.8293 6.8438 6.8438 7.2566 7.2566 7.2939 7.2939 7.5686 7.5686 7.7055 7.7055 7.8558 7.8558 7.9423 7.9423 8.2418 8.2418 8.3012 8.3012 8.5452 8.5452 8.7053 8.7053 8.9016 8.9016 8.9833 8.9833 9.3120 9.3120 9.3188 9.3188 9.8650 9.8650 9.9449 9.9449 10.3648 10.3648 10.3745 10.3745 11.0724 11.0724 11.0785 11.0785 11.2638 11.2638 11.3081 11.3081 13.9385 13.9385 13.9764 13.9764 14.4772 14.4772 14.4834 14.4834 15.0592 15.0592 15.0915 15.0915 16.2962 16.2962 16.3018 16.3018 k = 0.0750 0.5000 0.0750 ( 5524 PWs) bands (ev): -1.4457 -1.4457 -1.4449 -1.4449 -0.1764 -0.1764 -0.1726 -0.1726 2.6363 2.6363 2.6870 2.6870 2.8898 2.8898 2.9528 2.9528 5.3321 5.3321 5.3573 5.3573 5.5938 5.5938 5.6070 5.6070 5.8959 5.8959 6.0476 6.0476 6.4161 6.4161 6.5292 6.5292 6.8122 6.8122 6.8353 6.8353 7.2711 7.2711 7.2936 7.2936 7.5677 7.5677 7.7095 7.7095 7.8369 7.8369 7.9242 7.9242 8.2349 8.2349 8.2994 8.2994 8.5346 8.5346 8.6910 8.6910 8.8882 8.8882 8.9593 8.9593 9.3009 9.3009 9.3058 9.3058 9.8442 9.8442 9.9172 9.9172 10.3454 10.3454 10.3554 10.3554 11.0878 11.0878 11.0988 11.0988 11.2468 11.2468 11.2916 11.2916 13.9501 13.9501 13.9844 13.9844 14.4707 14.4707 14.4769 14.4769 15.0571 15.0571 15.0856 15.0856 16.3471 16.3471 16.3520 16.3520 k = 0.0625 0.5000 0.0625 ( 5522 PWs) bands (ev): -1.4585 -1.4585 -1.4579 -1.4579 -0.1735 -0.1735 -0.1704 -0.1704 2.6637 2.6637 2.7102 2.7102 2.9065 2.9065 2.9637 2.9637 5.3387 5.3387 5.3562 5.3562 5.5863 5.5863 5.6048 5.6048 5.9080 5.9080 6.0458 6.0458 6.4289 6.4289 6.5392 6.5392 6.7990 6.7990 6.8265 6.8265 7.2864 7.2864 7.2956 7.2956 7.5715 7.5715 7.7142 7.7142 7.8201 7.8201 7.9074 7.9074 8.2306 8.2306 8.2965 8.2965 8.5274 8.5274 8.6744 8.6744 8.8779 8.8779 8.9377 8.9377 9.2921 9.2921 9.2952 9.2952 9.8257 9.8257 9.8903 9.8903 10.3271 10.3271 10.3365 10.3365 11.1010 11.1010 11.1159 11.1159 11.2349 11.2349 11.2788 11.2788 13.9618 13.9618 13.9918 13.9918 14.4646 14.4646 14.4705 14.4705 15.0555 15.0555 15.0799 15.0799 16.3919 16.3919 16.3958 16.3958 k = 0.0500 0.5000 0.0500 ( 5514 PWs) bands (ev): -1.4691 -1.4691 -1.4685 -1.4685 -0.1711 -0.1711 -0.1685 -0.1685 2.6876 2.6876 2.7278 2.7278 2.9223 2.9223 2.9714 2.9714 5.3434 5.3434 5.3546 5.3546 5.5810 5.5810 5.6015 5.6015 5.9219 5.9219 6.0400 6.0400 6.4424 6.4424 6.5421 6.5421 6.7904 6.7904 6.8181 6.8181 7.2991 7.2991 7.2997 7.2997 7.5807 7.5807 7.7167 7.7167 7.8077 7.8077 7.8915 7.8915 8.2292 8.2292 8.2917 8.2917 8.5251 8.5251 8.6556 8.6556 8.8707 8.8707 8.9189 8.9189 9.2853 9.2853 9.2870 9.2870 9.8104 9.8104 9.8651 9.8651 10.3108 10.3108 10.3189 10.3189 11.1121 11.1121 11.1290 11.1290 11.2283 11.2283 11.2688 11.2688 13.9730 13.9730 13.9981 13.9981 14.4591 14.4591 14.4645 14.4645 15.0546 15.0546 15.0746 15.0746 16.4300 16.4300 16.4328 16.4328 k = 0.0375 0.5000 0.0375 ( 5506 PWs) bands (ev): -1.4772 -1.4772 -1.4769 -1.4769 -0.1691 -0.1691 -0.1671 -0.1671 2.7078 2.7078 2.7398 2.7398 2.9370 2.9370 2.9759 2.9759 5.3466 5.3466 5.3531 5.3531 5.5782 5.5782 5.5972 5.5972 5.9373 5.9373 6.0307 6.0307 6.4568 6.4568 6.5386 6.5386 6.7861 6.7861 6.8102 6.8102 7.3033 7.3033 7.3092 7.3092 7.5956 7.5956 7.7130 7.7130 7.8029 7.8029 7.8760 7.8760 8.2308 8.2308 8.2843 8.2843 8.5286 8.5286 8.6350 8.6350 8.8666 8.8666 8.9029 8.9029 9.2802 9.2802 9.2809 9.2809 9.7993 9.7993 9.8424 9.8424 10.2974 10.2974 10.3038 10.3038 11.1212 11.1212 11.1372 11.1372 11.2267 11.2267 11.2607 11.2607 13.9833 13.9833 14.0028 14.0028 14.4547 14.4547 14.4590 14.4590 15.0545 15.0545 15.0697 15.0697 16.4609 16.4609 16.4627 16.4627 k = 0.0250 0.5000 0.0250 ( 5510 PWs) bands (ev): -1.4831 -1.4831 -1.4828 -1.4828 -0.1675 -0.1675 -0.1662 -0.1662 2.7241 2.7241 2.7463 2.7463 2.9502 2.9502 2.9771 2.9771 5.3485 5.3485 5.3518 5.3518 5.5778 5.5778 5.5923 5.5923 5.9538 5.9538 6.0184 6.0184 6.4720 6.4720 6.5300 6.5300 6.7854 6.7854 6.8030 6.8030 7.3077 7.3077 7.3144 7.3144 7.6150 7.6150 7.7009 7.7009 7.8070 7.8070 7.8608 7.8608 8.2355 8.2355 8.2747 8.2747 8.5379 8.5379 8.6133 8.6133 8.8655 8.8655 8.8898 8.8898 9.2767 9.2767 9.2768 9.2768 9.7932 9.7932 9.8230 9.8230 10.2876 10.2876 10.2920 10.2920 11.1286 11.1286 11.1410 11.1410 11.2292 11.2292 11.2536 11.2536 13.9921 13.9921 14.0054 14.0054 14.4515 14.4515 14.4546 14.4546 15.0551 15.0551 15.0654 15.0654 16.4840 16.4840 16.4850 16.4850 k = 0.0125 0.5000 0.0125 ( 5518 PWs) bands (ev): -1.4866 -1.4866 -1.4864 -1.4864 -0.1665 -0.1665 -0.1658 -0.1658 2.7363 2.7363 2.7477 2.7477 2.9612 2.9612 2.9750 2.9750 5.3495 5.3495 5.3509 5.3509 5.5795 5.5795 5.5873 5.5873 5.9709 5.9709 6.0039 6.0039 6.4878 6.4878 6.5178 6.5178 6.7875 6.7875 6.7967 6.7967 7.3117 7.3117 7.3159 7.3159 7.6374 7.6374 7.6824 7.6824 7.8173 7.8173 7.8456 7.8456 8.2430 8.2430 8.2638 8.2638 8.5523 8.5523 8.5914 8.5914 8.8673 8.8673 8.8795 8.8795 9.2745 9.2745 9.2746 9.2746 9.7925 9.7925 9.8078 9.8078 10.2820 10.2820 10.2842 10.2842 11.1344 11.1344 11.1411 11.1411 11.2343 11.2343 11.2470 11.2470 13.9990 13.9990 14.0058 14.0058 14.4498 14.4498 14.4514 14.4514 15.0565 15.0565 15.0617 15.0617 16.4985 16.4985 16.4989 16.4989 k = 0.0000 0.5000-0.0000 ( 5542 PWs) bands (ev): -1.4877 -1.4877 -1.4877 -1.4877 -0.1659 -0.1659 -0.1659 -0.1659 2.7443 2.7443 2.7443 2.7443 2.9696 2.9696 2.9696 2.9696 5.3502 5.3502 5.3502 5.3502 5.5829 5.5829 5.5829 5.5829 5.9878 5.9878 5.9878 5.9878 6.5033 6.5033 6.5033 6.5033 6.7914 6.7914 6.7914 6.7914 7.3146 7.3146 7.3146 7.3146 7.6605 7.6605 7.6605 7.6605 7.8308 7.8308 7.8308 7.8308 8.2528 8.2528 8.2528 8.2528 8.5706 8.5706 8.5706 8.5706 8.8720 8.8720 8.8720 8.8720 9.2738 9.2738 9.2738 9.2738 9.7974 9.7974 9.7974 9.7974 10.2809 10.2809 10.2809 10.2809 11.1387 11.1387 11.1387 11.1387 11.2405 11.2405 11.2405 11.2405 14.0036 14.0036 14.0036 14.0036 14.4497 14.4497 14.4497 14.4497 15.0587 15.0587 15.0587 15.0587 16.5035 16.5035 16.5035 16.5035 k = 0.5000 0.5000-0.0000 ( 5472 PWs) bands (ev): -0.7036 -0.7036 -0.7036 -0.7036 -0.6971 -0.6971 -0.6971 -0.6971 2.3684 2.3684 2.3684 2.3684 2.3827 2.3827 2.3827 2.3827 5.2968 5.2968 5.2968 5.2968 5.3884 5.3884 5.3884 5.3884 5.8340 5.8340 5.8340 5.8340 6.0222 6.0222 6.0222 6.0222 7.1786 7.1786 7.1786 7.1786 7.3916 7.3916 7.3916 7.3916 8.0592 8.0592 8.0592 8.0592 8.1973 8.1973 8.1973 8.1973 8.5318 8.5318 8.5318 8.5318 8.5705 8.5705 8.5705 8.5705 9.4312 9.4312 9.4312 9.4312 9.4682 9.4682 9.4682 9.4682 9.9825 9.9825 9.9825 9.9825 9.9994 9.9994 9.9994 9.9994 11.8329 11.8329 11.8329 11.8329 11.9241 11.9241 11.9241 11.9241 14.2820 14.2820 14.2820 14.2820 14.3056 14.3056 14.3056 14.3056 14.8417 14.8417 14.8417 14.8417 14.8444 14.8444 14.8444 14.8444 k = 0.5000 0.5000 0.0179 ( 5500 PWs) bands (ev): -0.7031 -0.7031 -0.7023 -0.7023 -0.6962 -0.6962 -0.6962 -0.6962 2.3655 2.3655 2.3663 2.3663 2.3800 2.3800 2.3804 2.3804 5.2935 5.2935 5.2985 5.2985 5.3780 5.3780 5.3976 5.3976 5.8227 5.8227 5.8457 5.8457 6.0221 6.0221 6.0226 6.0226 7.1700 7.1700 7.1898 7.1898 7.3920 7.3920 7.3928 7.3928 8.0566 8.0566 8.0627 8.0627 8.1916 8.1916 8.2048 8.2048 8.5321 8.5321 8.5343 8.5343 8.5510 8.5510 8.5913 8.5913 9.4265 9.4265 9.4394 9.4394 9.4702 9.4702 9.4712 9.4712 9.9789 9.9789 9.9858 9.9858 9.9944 9.9944 10.0022 10.0022 11.8287 11.8287 11.8350 11.8350 11.9201 11.9201 11.9258 11.9258 14.2705 14.2705 14.2909 14.2909 14.3020 14.3020 14.3062 14.3062 14.8354 14.8354 14.8390 14.8390 14.8506 14.8506 14.8527 14.8527 k = 0.5000 0.5000 0.0357 ( 5500 PWs) bands (ev): -0.7007 -0.7007 -0.6990 -0.6990 -0.6933 -0.6933 -0.6933 -0.6933 2.3579 2.3579 2.3595 2.3595 2.3725 2.3725 2.3731 2.3731 5.2887 5.2887 5.2985 5.2985 5.3665 5.3665 5.4054 5.4054 5.8122 5.8122 5.8579 5.8579 6.0225 6.0225 6.0234 6.0234 7.1643 7.1643 7.2035 7.2035 7.3940 7.3940 7.3958 7.3958 8.0551 8.0551 8.0671 8.0671 8.1880 8.1880 8.2136 8.2136 8.5337 8.5337 8.5352 8.5352 8.5395 8.5395 8.6127 8.6127 9.4251 9.4251 9.4507 9.4507 9.4769 9.4769 9.4792 9.4792 9.9751 9.9751 9.9876 9.9876 9.9891 9.9891 10.0030 10.0030 11.8223 11.8223 11.8350 11.8350 11.9140 11.9140 11.9253 11.9253 14.2566 14.2566 14.2957 14.2957 14.2968 14.2968 14.3034 14.3034 14.8321 14.8321 14.8367 14.8367 14.8616 14.8616 14.8637 14.8637 k = 0.5000 0.5000 0.0536 ( 5508 PWs) bands (ev): -0.6965 -0.6965 -0.6938 -0.6938 -0.6886 -0.6886 -0.6885 -0.6885 2.3456 2.3456 2.3480 2.3480 2.3602 2.3602 2.3611 2.3611 5.2826 5.2826 5.2967 5.2967 5.3541 5.3541 5.4116 5.4116 5.8024 5.8024 5.8704 5.8704 6.0233 6.0233 6.0244 6.0244 7.1617 7.1617 7.2194 7.2194 7.3976 7.3976 7.4006 7.4006 8.0550 8.0550 8.0720 8.0720 8.1866 8.1866 8.2232 8.2232 8.5194 8.5194 8.5413 8.5413 8.5469 8.5469 8.6339 8.6339 9.4267 9.4267 9.4643 9.4643 9.4876 9.4876 9.4915 9.4915 9.9715 9.9715 9.9796 9.9796 9.9933 9.9933 10.0024 10.0024 11.8139 11.8139 11.8328 11.8328 11.9057 11.9057 11.9225 11.9225 14.2408 14.2408 14.2870 14.2870 14.2972 14.2972 14.2997 14.2997 14.8320 14.8320 14.8373 14.8373 14.8741 14.8741 14.8767 14.8767 k = 0.5000 0.5000 0.0714 ( 5516 PWs) bands (ev): -0.6903 -0.6903 -0.6869 -0.6869 -0.6820 -0.6820 -0.6819 -0.6819 2.3288 2.3288 2.3319 2.3319 2.3432 2.3432 2.3443 2.3443 5.2753 5.2753 5.2932 5.2932 5.3408 5.3408 5.4162 5.4162 5.7935 5.7935 5.8830 5.8830 6.0245 6.0245 6.0256 6.0256 7.1622 7.1622 7.2376 7.2376 7.4027 7.4027 7.4074 7.4074 8.0564 8.0564 8.0775 8.0775 8.1874 8.1874 8.2329 8.2329 8.5089 8.5089 8.5501 8.5501 8.5561 8.5561 8.6542 8.6542 9.4303 9.4303 9.4789 9.4789 9.5013 9.5013 9.5073 9.5073 9.9693 9.9693 9.9718 9.9718 9.9996 9.9996 10.0013 10.0013 11.8035 11.8035 11.8285 11.8285 11.8954 11.8954 11.9175 11.9175 14.2234 14.2234 14.2760 14.2760 14.2875 14.2875 14.2994 14.2994 14.8351 14.8351 14.8404 14.8404 14.8874 14.8874 14.8914 14.8914 k = 0.5000 0.5000 0.0893 ( 5532 PWs) bands (ev): -0.6824 -0.6824 -0.6781 -0.6781 -0.6736 -0.6736 -0.6735 -0.6735 2.3077 2.3077 2.3114 2.3114 2.3217 2.3217 2.3232 2.3232 5.2670 5.2670 5.2879 5.2879 5.3268 5.3268 5.4190 5.4190 5.7856 5.7856 5.8956 5.8956 6.0260 6.0260 6.0269 6.0269 7.1662 7.1662 7.2577 7.2577 7.4096 7.4096 7.4164 7.4164 8.0595 8.0595 8.0834 8.0834 8.1906 8.1906 8.2421 8.2421 8.5030 8.5030 8.5612 8.5612 8.5669 8.5669 8.6731 8.6731 9.4343 9.4343 9.4928 9.4928 9.5160 9.5160 9.5249 9.5249 9.9661 9.9661 9.9701 9.9701 10.0013 10.0013 10.0100 10.0100 11.7912 11.7912 11.8222 11.8222 11.8832 11.8832 11.9103 11.9103 14.2047 14.2047 14.2631 14.2631 14.2743 14.2743 14.2961 14.2961 14.8409 14.8409 14.8453 14.8453 14.9009 14.9009 14.9069 14.9069 k = 0.5000 0.5000 0.1071 ( 5524 PWs) bands (ev): -0.6727 -0.6727 -0.6675 -0.6675 -0.6634 -0.6634 -0.6633 -0.6633 2.2825 2.2825 2.2867 2.2867 2.2962 2.2962 2.2978 2.2978 5.2578 5.2578 5.2811 5.2811 5.3122 5.3122 5.4200 5.4200 5.7787 5.7787 5.9081 5.9081 6.0278 6.0278 6.0282 6.0282 7.1737 7.1737 7.2798 7.2798 7.4182 7.4182 7.4277 7.4277 8.0642 8.0642 8.0897 8.0897 8.1959 8.1959 8.2501 8.2501 8.5020 8.5020 8.5745 8.5745 8.5787 8.5787 8.6904 8.6904 9.4369 9.4369 9.5039 9.5039 9.5292 9.5292 9.5421 9.5421 9.9650 9.9650 9.9762 9.9762 10.0048 10.0048 10.0263 10.0263 11.7772 11.7772 11.8139 11.8139 11.8691 11.8691 11.9010 11.9010 14.1848 14.1848 14.2483 14.2483 14.2579 14.2579 14.2901 14.2901 14.8490 14.8490 14.8513 14.8513 14.9139 14.9139 14.9228 14.9228 k = 0.5000 0.5000 0.1250 ( 5532 PWs) bands (ev): -0.6614 -0.6614 -0.6553 -0.6553 -0.6515 -0.6515 -0.6513 -0.6513 2.2536 2.2536 2.2583 2.2583 2.2668 2.2668 2.2686 2.2686 5.2478 5.2478 5.2728 5.2728 5.2973 5.2973 5.4191 5.4191 5.7730 5.7730 5.9203 5.9203 6.0295 6.0295 6.0297 6.0297 7.1848 7.1848 7.3036 7.3036 7.4287 7.4287 7.4415 7.4415 8.0705 8.0705 8.0964 8.0964 8.2033 8.2033 8.2567 8.2567 8.5060 8.5060 8.5894 8.5894 8.5913 8.5913 8.7057 8.7057 9.4360 9.4360 9.5098 9.5098 9.5375 9.5375 9.5560 9.5560 9.9720 9.9720 9.9897 9.9897 10.0147 10.0147 10.0507 10.0507 11.7615 11.7615 11.8037 11.8037 11.8533 11.8533 11.8896 11.8896 14.1638 14.1638 14.2315 14.2315 14.2385 14.2385 14.2815 14.2815 14.8572 14.8572 14.8589 14.8589 14.9259 14.9259 14.9382 14.9382 k = 0.5000 0.5000 0.1429 ( 5524 PWs) bands (ev): -0.6484 -0.6484 -0.6414 -0.6414 -0.6380 -0.6380 -0.6378 -0.6378 2.2213 2.2213 2.2264 2.2264 2.2340 2.2340 2.2359 2.2359 5.2373 5.2373 5.2631 5.2631 5.2820 5.2820 5.4164 5.4164 5.7683 5.7683 5.9321 5.9321 6.0306 6.0306 6.0316 6.0316 7.1996 7.1996 7.3292 7.3292 7.4413 7.4413 7.4578 7.4578 8.0784 8.0784 8.1034 8.1034 8.2124 8.2124 8.2618 8.2618 8.5147 8.5147 8.6043 8.6043 8.6056 8.6056 8.7191 8.7191 9.4299 9.4299 9.5086 9.5086 9.5381 9.5381 9.5633 9.5633 9.9901 9.9901 10.0128 10.0128 10.0340 10.0340 10.0847 10.0847 11.7445 11.7445 11.7919 11.7919 11.8360 11.8360 11.8762 11.8762 14.1417 14.1417 14.2128 14.2128 14.2162 14.2162 14.2707 14.2707 14.8621 14.8621 14.8696 14.8696 14.9363 14.9363 14.9525 14.9525 k = 0.5000 0.5000 0.1607 ( 5524 PWs) bands (ev): -0.6339 -0.6339 -0.6260 -0.6260 -0.6230 -0.6230 -0.6227 -0.6227 2.1861 2.1861 2.1913 2.1913 2.1981 2.1981 2.2001 2.2001 5.2264 5.2264 5.2523 5.2523 5.2666 5.2666 5.4120 5.4120 5.7646 5.7646 5.9434 5.9434 6.0316 6.0316 6.0333 6.0333 7.2181 7.2181 7.3564 7.3564 7.4560 7.4560 7.4768 7.4768 8.0878 8.0878 8.1108 8.1108 8.2232 8.2232 8.2657 8.2657 8.5274 8.5274 8.6175 8.6175 8.6226 8.6226 8.7307 8.7307 9.4176 9.4176 9.4992 9.4992 9.5290 9.5290 9.5617 9.5617 10.0210 10.0210 10.0464 10.0464 10.0649 10.0649 10.1292 10.1292 11.7262 11.7262 11.7785 11.7785 11.8174 11.8174 11.8610 11.8610 14.1186 14.1186 14.1913 14.1913 14.1919 14.1919 14.2578 14.2578 14.8651 14.8651 14.8806 14.8806 14.9447 14.9447 14.9650 14.9650 k = 0.5000 0.5000 0.1786 ( 5524 PWs) bands (ev): -0.6180 -0.6180 -0.6092 -0.6092 -0.6065 -0.6065 -0.6062 -0.6062 2.1482 2.1482 2.1536 2.1536 2.1595 2.1595 2.1616 2.1616 5.2152 5.2152 5.2407 5.2407 5.2511 5.2511 5.4060 5.4060 5.7619 5.7619 5.9541 5.9541 6.0323 6.0323 6.0349 6.0349 7.2404 7.2404 7.3852 7.3852 7.4731 7.4731 7.4985 7.4985 8.0985 8.0985 8.1185 8.1185 8.2352 8.2352 8.2690 8.2690 8.5432 8.5432 8.6307 8.6307 8.6400 8.6400 8.7405 8.7405 9.3987 9.3987 9.4818 9.4818 9.5101 9.5101 9.5504 9.5504 10.0647 10.0647 10.0905 10.0905 10.1082 10.1082 10.1842 10.1842 11.7070 11.7070 11.7638 11.7638 11.7977 11.7977 11.8442 11.8442 14.0941 14.0941 14.1639 14.1639 14.1686 14.1686 14.2430 14.2430 14.8651 14.8651 14.8911 14.8911 14.9506 14.9506 14.9752 14.9752 k = 0.5000 0.5000 0.1964 ( 5548 PWs) bands (ev): -0.6008 -0.6008 -0.5911 -0.5911 -0.5887 -0.5887 -0.5884 -0.5884 2.1082 2.1082 2.1137 2.1137 2.1187 2.1187 2.1208 2.1208 5.2038 5.2038 5.2283 5.2283 5.2357 5.2357 5.3987 5.3987 5.7600 5.7600 5.9640 5.9640 6.0328 6.0328 6.0361 6.0361 7.2663 7.2663 7.4155 7.4155 7.4925 7.4925 7.5230 7.5230 8.1104 8.1104 8.1265 8.1265 8.2483 8.2483 8.2720 8.2720 8.5612 8.5612 8.6437 8.6437 8.6574 8.6574 8.7486 8.7486 9.3737 9.3737 9.4572 9.4572 9.4829 9.4829 9.5299 9.5299 10.1197 10.1197 10.1441 10.1441 10.1630 10.1630 10.2490 10.2490 11.6872 11.6872 11.7481 11.7481 11.7773 11.7773 11.8258 11.8258 14.0681 14.0681 14.1341 14.1341 14.1427 14.1427 14.2263 14.2263 14.8615 14.8615 14.9004 14.9004 14.9539 14.9539 14.9826 14.9826 k = 0.5000 0.5000 0.2143 ( 5556 PWs) bands (ev): -0.5825 -0.5825 -0.5719 -0.5719 -0.5698 -0.5698 -0.5695 -0.5695 2.0666 2.0666 2.0719 2.0719 2.0763 2.0763 2.0783 2.0783 5.1923 5.1923 5.2155 5.2155 5.2204 5.2204 5.3903 5.3903 5.7587 5.7587 5.9731 5.9731 6.0331 6.0331 6.0369 6.0369 7.2956 7.2956 7.4472 7.4472 7.5143 7.5143 7.5502 7.5502 8.1233 8.1233 8.1346 8.1346 8.2621 8.2621 8.2752 8.2752 8.5804 8.5804 8.6562 8.6562 8.6744 8.6744 8.7550 8.7550 9.3435 9.3435 9.4267 9.4267 9.4492 9.4492 9.5016 9.5016 10.1841 10.1841 10.2060 10.2060 10.2276 10.2276 10.3224 10.3224 11.6670 11.6670 11.7316 11.7316 11.7564 11.7564 11.8062 11.8062 14.0404 14.0404 14.1017 14.1017 14.1138 14.1138 14.2076 14.2076 14.8539 14.8539 14.9079 14.9079 14.9544 14.9544 14.9867 14.9867 k = 0.5000 0.5000 0.2321 ( 5548 PWs) bands (ev): -0.5632 -0.5632 -0.5517 -0.5517 -0.5498 -0.5498 -0.5495 -0.5495 2.0236 2.0236 2.0289 2.0289 2.0325 2.0325 2.0346 2.0346 5.1810 5.1810 5.2024 5.2024 5.2056 5.2056 5.3810 5.3810 5.7580 5.7580 5.9814 5.9814 6.0332 6.0332 6.0373 6.0373 7.3283 7.3283 7.4803 7.4803 7.5385 7.5385 7.5802 7.5802 8.1371 8.1371 8.1429 8.1429 8.2763 8.2763 8.2788 8.2788 8.6001 8.6001 8.6683 8.6683 8.6906 8.6906 8.7598 8.7598 9.3092 9.3092 9.3917 9.3917 9.4106 9.4106 9.4672 9.4672 10.2558 10.2558 10.2745 10.2745 10.2999 10.2999 10.4032 10.4032 11.6470 11.6470 11.7148 11.7148 11.7355 11.7355 11.7855 11.7855 14.0107 14.0107 14.0668 14.0668 14.0818 14.0818 14.1867 14.1867 14.8419 14.8419 14.9132 14.9132 14.9521 14.9521 14.9873 14.9873 k = 0.5000 0.5000 0.2500 ( 5552 PWs) bands (ev): -0.5431 -0.5431 -0.5307 -0.5307 -0.5291 -0.5291 -0.5288 -0.5288 1.9800 1.9800 1.9850 1.9850 1.9880 1.9880 1.9900 1.9900 5.1698 5.1698 5.1894 5.1894 5.1911 5.1911 5.3712 5.3712 5.7576 5.7576 5.9887 5.9887 6.0329 6.0329 6.0374 6.0374 7.3642 7.3642 7.5145 7.5145 7.5648 7.5648 7.6127 7.6127 8.1512 8.1512 8.1517 8.1517 8.2830 8.2830 8.2906 8.2906 8.6195 8.6195 8.6795 8.6795 8.7055 8.7055 8.7627 8.7627 9.2721 9.2721 9.3533 9.3533 9.3688 9.3688 9.4281 9.4281 10.3330 10.3330 10.3484 10.3484 10.3779 10.3779 10.4901 10.4901 11.6277 11.6277 11.6980 11.6980 11.7149 11.7149 11.7641 11.7641 13.9786 13.9786 14.0293 14.0293 14.0463 14.0463 14.1635 14.1635 14.8257 14.8257 14.9160 14.9160 14.9472 14.9472 14.9843 14.9843 k = 0.5000 0.5000 0.2679 ( 5556 PWs) bands (ev): -0.5224 -0.5224 -0.5091 -0.5091 -0.5077 -0.5077 -0.5075 -0.5075 1.9361 1.9361 1.9408 1.9408 1.9432 1.9432 1.9451 1.9451 5.1590 5.1590 5.1764 5.1764 5.1772 5.1772 5.3610 5.3610 5.7575 5.7575 5.9952 5.9952 6.0325 6.0325 6.0370 6.0370 7.4028 7.4028 7.5498 7.5498 7.5931 7.5931 7.6476 7.6476 8.1595 8.1595 8.1671 8.1671 8.2881 8.2881 8.3048 8.3048 8.6379 8.6379 8.6897 8.6897 8.7184 8.7184 8.7634 8.7634 9.2333 9.2333 9.3126 9.3126 9.3252 9.3252 9.3857 9.3857 10.4141 10.4141 10.4262 10.4262 10.4599 10.4599 10.5816 10.5816 11.6094 11.6094 11.6818 11.6818 11.6951 11.6951 11.7423 11.7423 13.9439 13.9439 13.9890 13.9890 14.0071 14.0071 14.1376 14.1376 14.8056 14.8056 14.9162 14.9162 14.9399 14.9399 14.9779 14.9779 k = 0.5000 0.5000 0.2857 ( 5540 PWs) bands (ev): -0.5013 -0.5013 -0.4872 -0.4872 -0.4860 -0.4860 -0.4858 -0.4858 1.8924 1.8924 1.8968 1.8968 1.8987 1.8987 1.9005 1.9005 5.1485 5.1485 5.1639 5.1639 5.1640 5.1640 5.3507 5.3507 5.7575 5.7575 6.0007 6.0007 6.0319 6.0319 6.0362 6.0362 7.4441 7.4441 7.5859 7.5859 7.6232 7.6232 7.6849 7.6849 8.1678 8.1678 8.1831 8.1831 8.2940 8.2940 8.3185 8.3185 8.6546 8.6546 8.6986 8.6986 8.7285 8.7285 8.7613 8.7613 9.1945 9.1945 9.2708 9.2708 9.2813 9.2813 9.3412 9.3412 10.4973 10.4973 10.5064 10.5064 10.5441 10.5441 10.6766 10.6766 11.5931 11.5931 11.6666 11.6666 11.6767 11.6767 11.7204 11.7204 13.9065 13.9065 13.9459 13.9459 13.9642 13.9642 14.1086 14.1086 14.7825 14.7825 14.9137 14.9137 14.9307 14.9307 14.9682 14.9682 k = 0.5000 0.5000 0.3036 ( 5540 PWs) bands (ev): -0.4802 -0.4802 -0.4652 -0.4652 -0.4642 -0.4642 -0.4640 -0.4640 1.8495 1.8495 1.8535 1.8535 1.8549 1.8549 1.8566 1.8566 5.1385 5.1385 5.1514 5.1514 5.1518 5.1518 5.3405 5.3405 5.7576 5.7576 6.0055 6.0055 6.0311 6.0311 6.0352 6.0352 7.4876 7.4876 7.6225 7.6225 7.6546 7.6546 7.7243 7.7243 8.1759 8.1759 8.1999 8.1999 8.3009 8.3009 8.3315 8.3315 8.6688 8.6688 8.7055 8.7055 8.7349 8.7349 8.7556 8.7556 9.1570 9.1570 9.2290 9.2290 9.2384 9.2384 9.2957 9.2957 10.5812 10.5812 10.5876 10.5876 10.6286 10.6286 10.7738 10.7738 11.5794 11.5794 11.6531 11.6531 11.6603 11.6603 11.6987 11.6987 13.8661 13.8661 13.9001 13.9001 13.9177 13.9177 14.0764 14.0764 14.7571 14.7571 14.9088 14.9088 14.9201 14.9201 14.9560 14.9560 k = 0.5000 0.5000 0.3214 ( 5548 PWs) bands (ev): -0.4593 -0.4593 -0.4434 -0.4434 -0.4426 -0.4426 -0.4424 -0.4424 1.8079 1.8079 1.8115 1.8115 1.8125 1.8125 1.8140 1.8140 5.1291 5.1291 5.1397 5.1397 5.1403 5.1403 5.3307 5.3307 5.7578 5.7578 6.0095 6.0095 6.0303 6.0303 6.0339 6.0339 7.5330 7.5330 7.6594 7.6594 7.6870 7.6870 7.7656 7.7656 8.1840 8.1840 8.2175 8.2175 8.3088 8.3088 8.3437 8.3437 8.6795 8.6795 8.7101 8.7101 8.7363 8.7363 8.7452 8.7452 9.1226 9.1226 9.1884 9.1884 9.1983 9.1983 9.2503 9.2503 10.6640 10.6640 10.6682 10.6682 10.7113 10.7113 10.8718 10.8718 11.5694 11.5694 11.6420 11.6420 11.6466 11.6466 11.6776 11.6776 13.8229 13.8229 13.8516 13.8516 13.8677 13.8677 14.0407 14.0407 14.7307 14.7307 14.9019 14.9019 14.9085 14.9085 14.9416 14.9416 k = 0.5000 0.5000 0.3393 ( 5564 PWs) bands (ev): -0.4388 -0.4388 -0.4221 -0.4221 -0.4214 -0.4214 -0.4213 -0.4213 1.7681 1.7681 1.7712 1.7712 1.7718 1.7718 1.7733 1.7733 5.1204 5.1204 5.1289 5.1289 5.1296 5.1296 5.3213 5.3213 5.7579 5.7579 6.0128 6.0128 6.0293 6.0293 6.0325 6.0325 7.5797 7.5797 7.6961 7.6961 7.7196 7.7196 7.8083 7.8083 8.1920 8.1920 8.2362 8.2362 8.3180 8.3180 8.3547 8.3547 8.6859 8.6859 8.7114 8.7114 8.7294 8.7294 8.7314 8.7314 9.0927 9.0927 9.1502 9.1502 9.1626 9.1626 9.2061 9.2061 10.7439 10.7439 10.7464 10.7464 10.7902 10.7902 10.9693 10.9693 11.5640 11.5640 11.6341 11.6341 11.6364 11.6364 11.6575 11.6575 13.7772 13.7772 13.8009 13.8009 13.8150 13.8150 14.0017 14.0017 14.7043 14.7043 14.8934 14.8934 14.8965 14.8965 14.9260 14.9260 k = 0.5000 0.5000 0.3571 ( 5556 PWs) bands (ev): -0.4192 -0.4192 -0.4017 -0.4017 -0.4011 -0.4011 -0.4010 -0.4010 1.7306 1.7306 1.7332 1.7332 1.7336 1.7336 1.7348 1.7348 5.1124 5.1124 5.1191 5.1191 5.1197 5.1197 5.3125 5.3125 5.7580 5.7580 6.0155 6.0155 6.0283 6.0283 6.0310 6.0310 7.6274 7.6274 7.7321 7.7321 7.7520 7.7520 7.8520 7.8520 8.2001 8.2001 8.2562 8.2562 8.3286 8.3286 8.3644 8.3644 8.6867 8.6867 8.7077 8.7077 8.7087 8.7087 8.7190 8.7190 9.0684 9.0684 9.1157 9.1157 9.1327 9.1327 9.1646 9.1646 10.8189 10.8189 10.8202 10.8202 10.8629 10.8629 11.0645 11.0645 11.5646 11.5646 11.6301 11.6301 11.6306 11.6306 11.6390 11.6390 13.7294 13.7294 13.7486 13.7486 13.7602 13.7602 13.9597 13.9597 14.6790 14.6790 14.8839 14.8839 14.8846 14.8846 14.9098 14.9098 k = 0.5000 0.5000 0.3750 ( 5540 PWs) bands (ev): -0.4007 -0.4007 -0.3824 -0.3824 -0.3820 -0.3820 -0.3819 -0.3819 1.6960 1.6960 1.6981 1.6981 1.6982 1.6982 1.6993 1.6993 5.1051 5.1051 5.1102 5.1102 5.1108 5.1108 5.3045 5.3045 5.7581 5.7581 6.0177 6.0177 6.0272 6.0272 6.0294 6.0294 7.6753 7.6753 7.7667 7.7667 7.7832 7.7832 7.8962 7.8962 8.2085 8.2085 8.2778 8.2778 8.3407 8.3407 8.3725 8.3725 8.6805 8.6805 8.6811 8.6811 8.6984 8.6984 8.7009 8.7009 9.0501 9.0501 9.0863 9.0863 9.1096 9.1096 9.1271 9.1271 10.8872 10.8872 10.8877 10.8877 10.9271 10.9271 11.1558 11.1558 11.5721 11.5721 11.6224 11.6224 11.6299 11.6299 11.6308 11.6308 13.6806 13.6806 13.6956 13.6956 13.7046 13.7046 13.9158 13.9158 14.6558 14.6558 14.8733 14.8733 14.8740 14.8740 14.8939 14.8939 k = 0.5000 0.5000 0.3929 ( 5536 PWs) bands (ev): -0.3837 -0.3837 -0.3648 -0.3648 -0.3645 -0.3645 -0.3644 -0.3644 1.6647 1.6647 1.6662 1.6662 1.6663 1.6663 1.6672 1.6672 5.0987 5.0987 5.1025 5.1025 5.1030 5.1030 5.2974 5.2974 5.7581 5.7581 6.0194 6.0194 6.0263 6.0263 6.0279 6.0279 7.7227 7.7227 7.7994 7.7994 7.8126 7.8126 7.9399 7.9399 8.2175 8.2175 8.3013 8.3013 8.3548 8.3548 8.3790 8.3790 8.6492 8.6492 8.6685 8.6685 8.6702 8.6702 8.6872 8.6872 9.0372 9.0372 9.0628 9.0628 9.0931 9.0931 9.0947 9.0947 10.9469 10.9469 10.9471 10.9471 10.9808 10.9808 11.2410 11.2410 11.5869 11.5869 11.6086 11.6086 11.6345 11.6345 11.6364 11.6364 13.6318 13.6318 13.6432 13.6432 13.6497 13.6497 13.8713 13.8713 14.6351 14.6351 14.8629 14.8629 14.8643 14.8643 14.8788 14.8788 k = 0.5000 0.5000 0.4107 ( 5544 PWs) bands (ev): -0.3686 -0.3686 -0.3490 -0.3490 -0.3488 -0.3488 -0.3488 -0.3488 1.6373 1.6373 1.6381 1.6381 1.6384 1.6384 1.6391 1.6391 5.0932 5.0932 5.0958 5.0958 5.0962 5.0962 5.2912 5.2912 5.7581 5.7581 6.0207 6.0207 6.0254 6.0254 6.0266 6.0266 7.7684 7.7684 7.8291 7.8291 7.8391 7.8391 7.9819 7.9819 8.2279 8.2279 8.3273 8.3273 8.3711 8.3711 8.3834 8.3834 8.6160 8.6160 8.6357 8.6357 8.6492 8.6492 8.6671 8.6671 9.0287 9.0287 9.0453 9.0453 9.0684 9.0684 9.0824 9.0824 10.9967 10.9967 10.9968 10.9968 11.0231 11.0231 11.3172 11.3172 11.5984 11.5984 11.6080 11.6080 11.6444 11.6444 11.6466 11.6466 13.5849 13.5849 13.5930 13.5930 13.5973 13.5973 13.8278 13.8278 14.6174 14.6174 14.8537 14.8537 14.8552 14.8552 14.8652 14.8652 k = 0.5000 0.5000 0.4286 ( 5552 PWs) bands (ev): -0.3557 -0.3557 -0.3356 -0.3356 -0.3355 -0.3355 -0.3354 -0.3354 1.6141 1.6141 1.6145 1.6145 1.6149 1.6149 1.6153 1.6153 5.0887 5.0887 5.0903 5.0903 5.0906 5.0906 5.2860 5.2860 5.7581 5.7581 6.0216 6.0216 6.0246 6.0246 6.0254 6.0254 7.8110 7.8110 7.8551 7.8551 7.8621 7.8621 8.0204 8.0204 8.2405 8.2405 8.3558 8.3558 8.3855 8.3855 8.3900 8.3900 8.5837 8.5837 8.5970 8.5970 8.6242 8.6242 8.6410 8.6410 9.0234 9.0234 9.0332 9.0332 9.0483 9.0483 9.0761 9.0761 11.0360 11.0360 11.0361 11.0361 11.0544 11.0544 11.3811 11.3811 11.5931 11.5931 11.6332 11.6332 11.6581 11.6581 11.6602 11.6602 13.5418 13.5418 13.5471 13.5471 13.5497 13.5497 13.7877 13.7877 14.6030 14.6030 14.8459 14.8459 14.8472 14.8472 14.8535 14.8535 k = 0.5000 0.5000 0.4464 ( 5552 PWs) bands (ev): -0.3453 -0.3453 -0.3248 -0.3248 -0.3247 -0.3247 -0.3247 -0.3247 1.5956 1.5956 1.5956 1.5956 1.5961 1.5961 1.5963 1.5963 5.0851 5.0851 5.0861 5.0861 5.0862 5.0862 5.2819 5.2819 5.7581 5.7581 6.0223 6.0223 6.0240 6.0240 6.0244 6.0244 7.8487 7.8487 7.8765 7.8765 7.8807 7.8807 8.0531 8.0531 8.2562 8.2562 8.3851 8.3851 8.3869 8.3869 8.4116 8.4116 8.5552 8.5552 8.5570 8.5570 8.5952 8.5952 8.6097 8.6097 9.0203 9.0203 9.0254 9.0254 9.0339 9.0339 9.0726 9.0726 11.0651 11.0651 11.0652 11.0652 11.0760 11.0760 11.4290 11.4290 11.5943 11.5943 11.6588 11.6588 11.6734 11.6734 11.6750 11.6750 13.5048 13.5048 13.5079 13.5079 13.5092 13.5092 13.7532 13.7532 14.5918 14.5918 14.8398 14.8398 14.8406 14.8406 14.8442 14.8442 k = 0.5000 0.5000 0.4643 ( 5544 PWs) bands (ev): -0.3377 -0.3377 -0.3168 -0.3168 -0.3168 -0.3168 -0.3168 -0.3168 1.5818 1.5818 1.5822 1.5822 1.5824 1.5824 1.5825 1.5825 5.0826 5.0826 5.0830 5.0830 5.0830 5.0830 5.2790 5.2790 5.7581 5.7581 6.0228 6.0228 6.0235 6.0235 6.0237 6.0237 7.8788 7.8788 7.8924 7.8924 7.8944 7.8944 8.0776 8.0776 8.2746 8.2746 8.3827 8.3827 8.4203 8.4203 8.4358 8.4358 8.5194 8.5194 8.5332 8.5332 8.5642 8.5642 8.5750 8.5750 9.0187 9.0187 9.0208 9.0208 9.0246 9.0246 9.0710 9.0710 11.0848 11.0848 11.0849 11.0849 11.0898 11.0898 11.4589 11.4589 11.6016 11.6016 11.6808 11.6808 11.6875 11.6875 11.6883 11.6883 13.4762 13.4762 13.4776 13.4776 13.4782 13.4782 13.7265 13.7265 14.5838 14.5838 14.8353 14.8353 14.8357 14.8357 14.8373 14.8373 k = 0.5000 0.5000 0.4821 ( 5520 PWs) bands (ev): -0.3330 -0.3330 -0.3119 -0.3119 -0.3119 -0.3119 -0.3119 -0.3119 1.5734 1.5734 1.5740 1.5740 1.5741 1.5741 1.5741 1.5741 5.0810 5.0810 5.0811 5.0811 5.0811 5.0811 5.2772 5.2772 5.7580 5.7580 6.0230 6.0230 6.0232 6.0232 6.0233 6.0233 7.8986 7.8986 7.9022 7.9022 7.9028 7.9028 8.0925 8.0925 8.2919 8.2919 8.3798 8.3798 8.4547 8.4547 8.4614 8.4614 8.4901 8.4901 8.5197 8.5197 8.5339 8.5339 8.5394 8.5394 9.0179 9.0179 9.0184 9.0184 9.0193 9.0193 9.0703 9.0703 11.0961 11.0961 11.0961 11.0961 11.0974 11.0974 11.4735 11.4735 11.6103 11.6103 11.6957 11.6957 11.6974 11.6974 11.6976 11.6976 13.4581 13.4581 13.4584 13.4584 13.4586 13.4586 13.7097 13.7097 14.5791 14.5791 14.8326 14.8326 14.8327 14.8327 14.8331 14.8331 k = 0.5000 0.5000 0.5000 ( 5520 PWs) bands (ev): -0.3315 -0.3315 -0.3103 -0.3103 -0.3103 -0.3103 -0.3103 -0.3103 1.5706 1.5706 1.5713 1.5713 1.5713 1.5713 1.5713 1.5713 5.0805 5.0805 5.0805 5.0805 5.0805 5.0805 5.2766 5.2766 5.7580 5.7580 6.0231 6.0231 6.0231 6.0231 6.0231 6.0231 7.9056 7.9056 7.9056 7.9056 7.9056 7.9056 8.0974 8.0974 8.2996 8.2996 8.3784 8.3784 8.4784 8.4784 8.4784 8.4784 8.4784 8.4784 8.5152 8.5152 8.5152 8.5152 8.5152 8.5152 9.0177 9.0177 9.0177 9.0177 9.0177 9.0177 9.0701 9.0701 11.0998 11.0998 11.0998 11.0998 11.0998 11.0998 11.4777 11.4777 11.6141 11.6141 11.7009 11.7009 11.7009 11.7009 11.7009 11.7009 13.4518 13.4518 13.4518 13.4518 13.4518 13.4518 13.7039 13.7039 14.5775 14.5775 14.8317 14.8317 14.8317 14.8317 14.8317 14.8317 Writing output data file P2Pt.save init_run : 0.46s CPU 0.67s WALL ( 1 calls) electrons : 449.55s CPU 454.24s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 449.54s CPU 454.22s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.20s CPU 0.29s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.14s CPU 0.13s WALL ( 218 calls) cegterg : 416.26s CPU 420.35s WALL ( 398 calls) Called by sum_band: Called by *egterg: h_psi : 213.05s CPU 215.58s WALL ( 7052 calls) s_psi : 37.86s CPU 38.03s WALL ( 7052 calls) g_psi : 0.42s CPU 0.55s WALL ( 6436 calls) cdiaghg : 141.00s CPU 142.61s WALL ( 6654 calls) cegterg:over : 19.91s CPU 19.97s WALL ( 6436 calls) cegterg:upda : 15.49s CPU 15.31s WALL ( 6436 calls) cegterg:last : 8.65s CPU 8.68s WALL ( 1052 calls) cdiaghg:chol : 8.70s CPU 8.65s WALL ( 6654 calls) cdiaghg:inve : 6.11s CPU 6.37s WALL ( 6654 calls) cdiaghg:para : 11.85s CPU 11.53s WALL ( 13308 calls) Called by h_psi: h_psi:vloc : 148.84s CPU 151.02s WALL ( 7052 calls) h_psi:vnl : 63.62s CPU 63.97s WALL ( 7052 calls) add_vuspsi : 35.45s CPU 35.41s WALL ( 7052 calls) General routines calbec : 28.14s CPU 28.53s WALL ( 7052 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 138.12s CPU 139.86s WALL ( 1312740 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.16s CPU 0.21s WALL ( 436 calls) Parallel routines fft_scatter : 47.14s CPU 47.87s WALL ( 1312763 calls) PWSCF : 7m51.99s CPU 8m15.42s WALL This run was terminated on: 21:12:55 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=