Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:15:38 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: ./FePt3.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized 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 51 21 6 1639 447 76 Max 52 22 7 1643 460 79 Sum 1837 777 241 59085 16375 2801 bravais-lattice index = 14 lattice parameter (alat) = 7.3019 a.u. unit-cell volume = 389.3210 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 38.00 number of Kohn-Sham states= 46 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.301901 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 Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 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 atomic species valence mass pseudopotential Fe 8.00 55.84500 Fe( 1.00) Pt 10.00 195.08400 Pt( 1.00) 48 Sym. Ops., with inversion, found 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 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cart. axis [1,0,1] cryst. s( 9) = ( 0 0 1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 10 180 deg rotation - cart. axis [-1,0,1] cryst. s(10) = ( 0 0 -1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(10) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 11 90 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 0 0 -1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(11) = ( -0.0000000 0.0000000 1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 12 90 deg rotation - cart. axis [0,-1,0] cryst. s(12) = ( 0 0 1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(12) = ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 13 180 deg rotation - cart. axis [0,1,1] cryst. s(13) = ( -1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 14 180 deg rotation - cart. axis [0,1,-1] cryst. s(14) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(14) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 15 90 deg rotation - cart. axis [-1,0,0] cryst. s(15) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 16 90 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( 1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(16) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 17 120 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 = 18 120 deg rotation - cart. axis [-1,1,1] cryst. s(18) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s(18) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 19 120 deg rotation - cart. axis [1,1,-1] cryst. s(19) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s(19) = ( -0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 20 120 deg rotation - cart. axis [1,-1,1] cryst. s(20) = ( 0 0 1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(20) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 21 120 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 = 22 120 deg rotation - cart. axis [-1,1,-1] cryst. s(22) = ( 0 -1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(22) = ( -0.0000000 -0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 23 120 deg rotation - cart. axis [1,-1,-1] cryst. s(23) = ( 0 -1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(23) = ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 24 120 deg rotation - cart. axis [-1,-1,1] cryst. s(24) = ( 0 1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(24) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 25 inversion cryst. s(25) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(25) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 26 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(26) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(26) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 27 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(27) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(27) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 28 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(28) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(28) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 29 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(29) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(29) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 30 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(30) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(30) = ( 0.0000000 1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 31 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(31) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(31) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 32 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(32) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(32) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 33 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(33) = ( 0 0 -1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(33) = ( -0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 34 inv. 180 deg rotation - cart. axis [-1,0,1] cryst. s(34) = ( 0 0 1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(34) = ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 35 inv. 90 deg rotation - cart. axis [0,1,0] cryst. s(35) = ( 0 0 1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(35) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 36 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(36) = ( 0 0 -1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s(36) = ( -0.0000000 -0.0000000 1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 37 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(37) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(37) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 38 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(38) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(38) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 39 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(39) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(39) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 40 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(40) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(40) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 41 inv. 120 deg rotation - cart. axis [-1,-1,-1] cryst. s(41) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(41) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 42 inv. 120 deg rotation - cart. axis [-1,1,1] cryst. s(42) = ( 0 0 1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s(42) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 43 inv. 120 deg rotation - cart. axis [1,1,-1] cryst. s(43) = ( 0 0 1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s(43) = ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 44 inv. 120 deg rotation - cart. axis [1,-1,1] cryst. s(44) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s(44) = ( -0.0000000 1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 45 inv. 120 deg rotation - cart. axis [1,1,1] cryst. s(45) = ( 0 -1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(45) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 46 inv. 120 deg rotation - cart. axis [-1,1,-1] cryst. s(46) = ( 0 1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(46) = ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 47 inv. 120 deg rotation - cart. axis [1,-1,-1] cryst. s(47) = ( 0 1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(47) = ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 48 inv. 120 deg rotation - cart. axis [-1,-1,1] cryst. s(48) = ( 0 -1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s(48) = ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) double point group O_h (m-3m) there are 16 classes and 6 irreducible representations the character table: E -E 8C3 -8C3 3C2 6C4 -6C4 6C2' i -i 8S6 -8S6 -3C2 -6C2' G_6+ 2.00 -2.00 1.00 -1.00 0.00 1.41 -1.41 0.00 2.00 -2.00 1.00 -1.00 G_7+ 2.00 -2.00 1.00 -1.00 0.00 -1.41 1.41 0.00 2.00 -2.00 1.00 -1.00 G_8+ 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 4.00 -4.00 -1.00 1.00 G_6- 2.00 -2.00 1.00 -1.00 0.00 1.41 -1.41 0.00 -2.00 2.00 -1.00 1.00 G_7- 2.00 -2.00 1.00 -1.00 0.00 -1.41 1.41 0.00 -2.00 2.00 -1.00 1.00 G_8- 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 -4.00 4.00 1.00 -1.00 3s_h 6S4 -6S4 6s_d -3s_h -6s_d G_6+ 0.00 1.41 -1.41 0.00 G_7+ 0.00 -1.41 1.41 0.00 G_8+ 0.00 0.00 0.00 0.00 G_6- 0.00 -1.41 1.41 0.00 G_7- 0.00 1.41 -1.41 0.00 G_8- 0.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 8C3 17 19 20 18 24 21 22 23 120 deg rotation - cart. axis [-1,-1,-1] -8C3 -17 -19 -20 -18 -24 -21 -22 -23 120 deg rotation - cart. axis [-1,-1,-1] E 3C2 -3C2 2 -2 4 -4 3 -3 180 deg rotation - cart. axis [0,0,1] 6C4 7 8 15 16 12 11 90 deg rotation - cart. axis [0,0,-1] -6C4 -7 -8 -15 -16 -12 -11 90 deg rotation - cart. axis [0,0,-1] E 6C2'-6C2' 5 -5 6 -6 14 -13 -14 13 -10 -9 10 9 180 deg rotation - cart. axis [1,1,0] i 25 inversion -i -25 inversion E 8S6 41 43 44 42 48 45 46 47 inv. 120 deg rotation - cart. axis [-1,-1,-1] -8S6 -41 -43 -44 -42 -48 -45 -46 -47 inv. 120 deg rotation - cart. axis [-1,-1,-1] E 3s_h-3s_h 26 -26 28 -28 27 -27 inv. 180 deg rotation - cart. axis [0,0,1] 6S4 31 32 39 40 36 35 inv. 90 deg rotation - cart. axis [0,0,-1] -6S4 -31 -32 -39 -40 -36 -35 inv. 90 deg rotation - cart. axis [0,0,-1] E 6s_d-6s_d 29 -29 30 -30 38 -37 -38 37 -34 -33 34 33 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 316 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031646 k( 2) = ( 0.0000000 0.0121951 -0.0000000), wk = 0.0031646 k( 3) = ( 0.0000000 0.0243902 -0.0000000), wk = 0.0031646 k( 4) = ( 0.0000000 0.0365854 -0.0000000), wk = 0.0031646 k( 5) = ( 0.0000000 0.0487805 -0.0000000), wk = 0.0031646 k( 6) = ( 0.0000000 0.0609756 -0.0000000), wk = 0.0031646 k( 7) = ( 0.0000000 0.0731707 -0.0000000), wk = 0.0031646 k( 8) = ( 0.0000000 0.0853658 -0.0000000), wk = 0.0031646 k( 9) = ( 0.0000000 0.0975610 -0.0000000), wk = 0.0031646 k( 10) = ( 0.0000000 0.1097561 -0.0000000), wk = 0.0031646 k( 11) = ( 0.0000000 0.1219512 -0.0000000), wk = 0.0031646 k( 12) = ( 0.0000000 0.1341463 -0.0000000), wk = 0.0031646 k( 13) = ( 0.0000000 0.1463415 -0.0000000), wk = 0.0031646 k( 14) = ( 0.0000000 0.1585366 -0.0000000), wk = 0.0031646 k( 15) = ( 0.0000000 0.1707317 -0.0000000), wk = 0.0031646 k( 16) = ( 0.0000000 0.1829268 -0.0000000), wk = 0.0031646 k( 17) = ( 0.0000000 0.1951219 -0.0000000), wk = 0.0031646 k( 18) = ( 0.0000000 0.2073171 -0.0000000), wk = 0.0031646 k( 19) = ( 0.0000000 0.2195122 -0.0000000), wk = 0.0031646 k( 20) = ( 0.0000000 0.2317073 -0.0000000), wk = 0.0031646 k( 21) = ( 0.0000000 0.2439024 -0.0000000), wk = 0.0031646 k( 22) = ( 0.0000000 0.2560976 -0.0000000), wk = 0.0031646 k( 23) = ( 0.0000000 0.2682927 -0.0000000), wk = 0.0031646 k( 24) = ( 0.0000000 0.2804878 -0.0000000), wk = 0.0031646 k( 25) = ( 0.0000000 0.2926829 -0.0000000), wk = 0.0031646 k( 26) = ( 0.0000000 0.3048781 -0.0000000), wk = 0.0031646 k( 27) = ( 0.0000000 0.3170732 -0.0000000), wk = 0.0031646 k( 28) = ( 0.0000000 0.3292683 -0.0000000), wk = 0.0031646 k( 29) = ( 0.0000000 0.3414634 -0.0000000), wk = 0.0031646 k( 30) = ( 0.0000000 0.3536585 -0.0000000), wk = 0.0031646 k( 31) = ( 0.0000000 0.3658537 -0.0000000), wk = 0.0031646 k( 32) = ( 0.0000000 0.3780488 -0.0000000), wk = 0.0031646 k( 33) = ( 0.0000000 0.3902439 -0.0000000), wk = 0.0031646 k( 34) = ( 0.0000000 0.4024390 -0.0000000), wk = 0.0031646 k( 35) = ( 0.0000000 0.4146341 -0.0000000), wk = 0.0031646 k( 36) = ( 0.0000000 0.4268293 -0.0000000), wk = 0.0031646 k( 37) = ( 0.0000000 0.4390244 -0.0000000), wk = 0.0031646 k( 38) = ( 0.0000000 0.4512195 -0.0000000), wk = 0.0031646 k( 39) = ( 0.0000000 0.4634146 -0.0000000), wk = 0.0031646 k( 40) = ( 0.0000000 0.4756098 -0.0000000), wk = 0.0031646 k( 41) = ( 0.0000000 0.4878049 -0.0000000), wk = 0.0031646 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031646 k( 43) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031646 k( 44) = ( 0.0121951 0.5000000 -0.0000000), wk = 0.0031646 k( 45) = ( 0.0243902 0.5000000 -0.0000000), wk = 0.0031646 k( 46) = ( 0.0365854 0.5000000 -0.0000000), wk = 0.0031646 k( 47) = ( 0.0487805 0.5000000 -0.0000000), wk = 0.0031646 k( 48) = ( 0.0609756 0.5000000 -0.0000000), wk = 0.0031646 k( 49) = ( 0.0731707 0.5000000 -0.0000000), wk = 0.0031646 k( 50) = ( 0.0853658 0.5000000 -0.0000000), wk = 0.0031646 k( 51) = ( 0.0975610 0.5000000 -0.0000000), wk = 0.0031646 k( 52) = ( 0.1097561 0.5000000 -0.0000000), wk = 0.0031646 k( 53) = ( 0.1219512 0.5000000 -0.0000000), wk = 0.0031646 k( 54) = ( 0.1341463 0.5000000 -0.0000000), wk = 0.0031646 k( 55) = ( 0.1463415 0.5000000 -0.0000000), wk = 0.0031646 k( 56) = ( 0.1585366 0.5000000 -0.0000000), wk = 0.0031646 k( 57) = ( 0.1707317 0.5000000 -0.0000000), wk = 0.0031646 k( 58) = ( 0.1829268 0.5000000 -0.0000000), wk = 0.0031646 k( 59) = ( 0.1951219 0.5000000 -0.0000000), wk = 0.0031646 k( 60) = ( 0.2073171 0.5000000 -0.0000000), wk = 0.0031646 k( 61) = ( 0.2195122 0.5000000 -0.0000000), wk = 0.0031646 k( 62) = ( 0.2317073 0.5000000 -0.0000000), wk = 0.0031646 k( 63) = ( 0.2439024 0.5000000 -0.0000000), wk = 0.0031646 k( 64) = ( 0.2560976 0.5000000 -0.0000000), wk = 0.0031646 k( 65) = ( 0.2682927 0.5000000 -0.0000000), wk = 0.0031646 k( 66) = ( 0.2804878 0.5000000 -0.0000000), wk = 0.0031646 k( 67) = ( 0.2926829 0.5000000 -0.0000000), wk = 0.0031646 k( 68) = ( 0.3048781 0.5000000 -0.0000000), wk = 0.0031646 k( 69) = ( 0.3170732 0.5000000 -0.0000000), wk = 0.0031646 k( 70) = ( 0.3292683 0.5000000 -0.0000000), wk = 0.0031646 k( 71) = ( 0.3414634 0.5000000 -0.0000000), wk = 0.0031646 k( 72) = ( 0.3536585 0.5000000 -0.0000000), wk = 0.0031646 k( 73) = ( 0.3658537 0.5000000 -0.0000000), wk = 0.0031646 k( 74) = ( 0.3780488 0.5000000 -0.0000000), wk = 0.0031646 k( 75) = ( 0.3902439 0.5000000 -0.0000000), wk = 0.0031646 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0031646 k( 77) = ( 0.4146341 0.5000000 -0.0000000), wk = 0.0031646 k( 78) = ( 0.4268293 0.5000000 -0.0000000), wk = 0.0031646 k( 79) = ( 0.4390244 0.5000000 -0.0000000), wk = 0.0031646 k( 80) = ( 0.4512195 0.5000000 -0.0000000), wk = 0.0031646 k( 81) = ( 0.4634146 0.5000000 -0.0000000), wk = 0.0031646 k( 82) = ( 0.4756098 0.5000000 -0.0000000), wk = 0.0031646 k( 83) = ( 0.4878049 0.5000000 -0.0000000), wk = 0.0031646 k( 84) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031646 k( 85) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031646 k( 86) = ( 0.4913793 0.4913793 -0.0000000), wk = 0.0031646 k( 87) = ( 0.4827586 0.4827586 -0.0000000), wk = 0.0031646 k( 88) = ( 0.4741379 0.4741379 -0.0000000), wk = 0.0031646 k( 89) = ( 0.4655172 0.4655172 -0.0000000), wk = 0.0031646 k( 90) = ( 0.4568966 0.4568965 -0.0000000), wk = 0.0031646 k( 91) = ( 0.4482759 0.4482759 -0.0000000), wk = 0.0031646 k( 92) = ( 0.4396552 0.4396552 -0.0000000), wk = 0.0031646 k( 93) = ( 0.4310345 0.4310345 -0.0000000), wk = 0.0031646 k( 94) = ( 0.4224138 0.4224138 -0.0000000), wk = 0.0031646 k( 95) = ( 0.4137931 0.4137931 -0.0000000), wk = 0.0031646 k( 96) = ( 0.4051724 0.4051724 -0.0000000), wk = 0.0031646 k( 97) = ( 0.3965517 0.3965517 -0.0000000), wk = 0.0031646 k( 98) = ( 0.3879310 0.3879310 -0.0000000), wk = 0.0031646 k( 99) = ( 0.3793103 0.3793103 -0.0000000), wk = 0.0031646 k( 100) = ( 0.3706897 0.3706897 -0.0000000), wk = 0.0031646 k( 101) = ( 0.3620690 0.3620690 -0.0000000), wk = 0.0031646 k( 102) = ( 0.3534483 0.3534483 -0.0000000), wk = 0.0031646 k( 103) = ( 0.3448276 0.3448276 -0.0000000), wk = 0.0031646 k( 104) = ( 0.3362069 0.3362069 -0.0000000), wk = 0.0031646 k( 105) = ( 0.3275862 0.3275862 -0.0000000), wk = 0.0031646 k( 106) = ( 0.3189655 0.3189655 -0.0000000), wk = 0.0031646 k( 107) = ( 0.3103448 0.3103448 -0.0000000), wk = 0.0031646 k( 108) = ( 0.3017241 0.3017241 -0.0000000), wk = 0.0031646 k( 109) = ( 0.2931034 0.2931034 -0.0000000), wk = 0.0031646 k( 110) = ( 0.2844828 0.2844828 -0.0000000), wk = 0.0031646 k( 111) = ( 0.2758621 0.2758621 -0.0000000), wk = 0.0031646 k( 112) = ( 0.2672414 0.2672414 -0.0000000), wk = 0.0031646 k( 113) = ( 0.2586207 0.2586207 -0.0000000), wk = 0.0031646 k( 114) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0031646 k( 115) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0031646 k( 116) = ( 0.2327586 0.2327586 -0.0000000), wk = 0.0031646 k( 117) = ( 0.2241379 0.2241379 -0.0000000), wk = 0.0031646 k( 118) = ( 0.2155172 0.2155172 -0.0000000), wk = 0.0031646 k( 119) = ( 0.2068966 0.2068965 -0.0000000), wk = 0.0031646 k( 120) = ( 0.1982759 0.1982759 -0.0000000), wk = 0.0031646 k( 121) = ( 0.1896552 0.1896552 -0.0000000), wk = 0.0031646 k( 122) = ( 0.1810345 0.1810345 -0.0000000), wk = 0.0031646 k( 123) = ( 0.1724138 0.1724138 -0.0000000), wk = 0.0031646 k( 124) = ( 0.1637931 0.1637931 -0.0000000), wk = 0.0031646 k( 125) = ( 0.1551724 0.1551724 -0.0000000), wk = 0.0031646 k( 126) = ( 0.1465517 0.1465517 -0.0000000), wk = 0.0031646 k( 127) = ( 0.1379310 0.1379310 -0.0000000), wk = 0.0031646 k( 128) = ( 0.1293103 0.1293103 -0.0000000), wk = 0.0031646 k( 129) = ( 0.1206897 0.1206897 -0.0000000), wk = 0.0031646 k( 130) = ( 0.1120690 0.1120690 -0.0000000), wk = 0.0031646 k( 131) = ( 0.1034483 0.1034483 -0.0000000), wk = 0.0031646 k( 132) = ( 0.0948276 0.0948276 -0.0000000), wk = 0.0031646 k( 133) = ( 0.0862069 0.0862069 -0.0000000), wk = 0.0031646 k( 134) = ( 0.0775862 0.0775862 -0.0000000), wk = 0.0031646 k( 135) = ( 0.0689655 0.0689655 -0.0000000), wk = 0.0031646 k( 136) = ( 0.0603448 0.0603448 -0.0000000), wk = 0.0031646 k( 137) = ( 0.0517241 0.0517241 -0.0000000), wk = 0.0031646 k( 138) = ( 0.0431035 0.0431034 -0.0000000), wk = 0.0031646 k( 139) = ( 0.0344828 0.0344828 -0.0000000), wk = 0.0031646 k( 140) = ( 0.0258621 0.0258621 -0.0000000), wk = 0.0031646 k( 141) = ( 0.0172414 0.0172414 -0.0000000), wk = 0.0031646 k( 142) = ( 0.0086207 0.0086207 -0.0000000), wk = 0.0031646 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031646 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031646 k( 145) = ( 0.0070422 0.0070422 0.0070422), wk = 0.0031646 k( 146) = ( 0.0140845 0.0140845 0.0140845), wk = 0.0031646 k( 147) = ( 0.0211268 0.0211268 0.0211268), wk = 0.0031646 k( 148) = ( 0.0281690 0.0281690 0.0281690), wk = 0.0031646 k( 149) = ( 0.0352113 0.0352113 0.0352113), wk = 0.0031646 k( 150) = ( 0.0422535 0.0422535 0.0422535), wk = 0.0031646 k( 151) = ( 0.0492958 0.0492958 0.0492958), wk = 0.0031646 k( 152) = ( 0.0563380 0.0563380 0.0563380), wk = 0.0031646 k( 153) = ( 0.0633803 0.0633803 0.0633803), wk = 0.0031646 k( 154) = ( 0.0704225 0.0704225 0.0704225), wk = 0.0031646 k( 155) = ( 0.0774648 0.0774648 0.0774648), wk = 0.0031646 k( 156) = ( 0.0845070 0.0845070 0.0845070), wk = 0.0031646 k( 157) = ( 0.0915493 0.0915493 0.0915493), wk = 0.0031646 k( 158) = ( 0.0985916 0.0985915 0.0985915), wk = 0.0031646 k( 159) = ( 0.1056338 0.1056338 0.1056338), wk = 0.0031646 k( 160) = ( 0.1126761 0.1126761 0.1126761), wk = 0.0031646 k( 161) = ( 0.1197183 0.1197183 0.1197183), wk = 0.0031646 k( 162) = ( 0.1267606 0.1267606 0.1267606), wk = 0.0031646 k( 163) = ( 0.1338028 0.1338028 0.1338028), wk = 0.0031646 k( 164) = ( 0.1408451 0.1408451 0.1408451), wk = 0.0031646 k( 165) = ( 0.1478873 0.1478873 0.1478873), wk = 0.0031646 k( 166) = ( 0.1549296 0.1549296 0.1549296), wk = 0.0031646 k( 167) = ( 0.1619718 0.1619718 0.1619718), wk = 0.0031646 k( 168) = ( 0.1690141 0.1690141 0.1690141), wk = 0.0031646 k( 169) = ( 0.1760563 0.1760563 0.1760563), wk = 0.0031646 k( 170) = ( 0.1830986 0.1830986 0.1830986), wk = 0.0031646 k( 171) = ( 0.1901409 0.1901408 0.1901408), wk = 0.0031646 k( 172) = ( 0.1971831 0.1971831 0.1971831), wk = 0.0031646 k( 173) = ( 0.2042253 0.2042253 0.2042253), wk = 0.0031646 k( 174) = ( 0.2112676 0.2112676 0.2112676), wk = 0.0031646 k( 175) = ( 0.2183099 0.2183099 0.2183099), wk = 0.0031646 k( 176) = ( 0.2253521 0.2253521 0.2253521), wk = 0.0031646 k( 177) = ( 0.2323944 0.2323944 0.2323944), wk = 0.0031646 k( 178) = ( 0.2394366 0.2394366 0.2394366), wk = 0.0031646 k( 179) = ( 0.2464789 0.2464789 0.2464789), wk = 0.0031646 k( 180) = ( 0.2535211 0.2535211 0.2535211), wk = 0.0031646 k( 181) = ( 0.2605634 0.2605634 0.2605634), wk = 0.0031646 k( 182) = ( 0.2676056 0.2676056 0.2676056), wk = 0.0031646 k( 183) = ( 0.2746479 0.2746479 0.2746479), wk = 0.0031646 k( 184) = ( 0.2816901 0.2816901 0.2816901), wk = 0.0031646 k( 185) = ( 0.2887324 0.2887324 0.2887324), wk = 0.0031646 k( 186) = ( 0.2957746 0.2957746 0.2957746), wk = 0.0031646 k( 187) = ( 0.3028169 0.3028169 0.3028169), wk = 0.0031646 k( 188) = ( 0.3098592 0.3098591 0.3098591), wk = 0.0031646 k( 189) = ( 0.3169014 0.3169014 0.3169014), wk = 0.0031646 k( 190) = ( 0.3239437 0.3239437 0.3239437), wk = 0.0031646 k( 191) = ( 0.3309859 0.3309859 0.3309859), wk = 0.0031646 k( 192) = ( 0.3380282 0.3380282 0.3380282), wk = 0.0031646 k( 193) = ( 0.3450704 0.3450704 0.3450704), wk = 0.0031646 k( 194) = ( 0.3521127 0.3521127 0.3521127), wk = 0.0031646 k( 195) = ( 0.3591549 0.3591549 0.3591549), wk = 0.0031646 k( 196) = ( 0.3661972 0.3661972 0.3661972), wk = 0.0031646 k( 197) = ( 0.3732394 0.3732394 0.3732394), wk = 0.0031646 k( 198) = ( 0.3802817 0.3802817 0.3802817), wk = 0.0031646 k( 199) = ( 0.3873239 0.3873239 0.3873239), wk = 0.0031646 k( 200) = ( 0.3943662 0.3943662 0.3943662), wk = 0.0031646 k( 201) = ( 0.4014085 0.4014084 0.4014084), wk = 0.0031646 k( 202) = ( 0.4084507 0.4084507 0.4084507), wk = 0.0031646 k( 203) = ( 0.4154930 0.4154930 0.4154930), wk = 0.0031646 k( 204) = ( 0.4225352 0.4225352 0.4225352), wk = 0.0031646 k( 205) = ( 0.4295775 0.4295775 0.4295775), wk = 0.0031646 k( 206) = ( 0.4366197 0.4366197 0.4366197), wk = 0.0031646 k( 207) = ( 0.4436620 0.4436620 0.4436620), wk = 0.0031646 k( 208) = ( 0.4507042 0.4507042 0.4507042), wk = 0.0031646 k( 209) = ( 0.4577465 0.4577465 0.4577465), wk = 0.0031646 k( 210) = ( 0.4647887 0.4647887 0.4647887), wk = 0.0031646 k( 211) = ( 0.4718310 0.4718310 0.4718310), wk = 0.0031646 k( 212) = ( 0.4788732 0.4788732 0.4788732), wk = 0.0031646 k( 213) = ( 0.4859155 0.4859155 0.4859155), wk = 0.0031646 k( 214) = ( 0.4929577 0.4929577 0.4929577), wk = 0.0031646 k( 215) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031646 k( 216) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031646 k( 217) = ( 0.4913793 0.5000000 0.4913793), wk = 0.0031646 k( 218) = ( 0.4827586 0.5000000 0.4827586), wk = 0.0031646 k( 219) = ( 0.4741379 0.5000000 0.4741379), wk = 0.0031646 k( 220) = ( 0.4655172 0.5000000 0.4655172), wk = 0.0031646 k( 221) = ( 0.4568966 0.5000000 0.4568965), wk = 0.0031646 k( 222) = ( 0.4482759 0.5000000 0.4482759), wk = 0.0031646 k( 223) = ( 0.4396552 0.5000000 0.4396552), wk = 0.0031646 k( 224) = ( 0.4310345 0.5000000 0.4310345), wk = 0.0031646 k( 225) = ( 0.4224138 0.5000000 0.4224138), wk = 0.0031646 k( 226) = ( 0.4137931 0.5000000 0.4137931), wk = 0.0031646 k( 227) = ( 0.4051724 0.5000000 0.4051724), wk = 0.0031646 k( 228) = ( 0.3965517 0.5000000 0.3965517), wk = 0.0031646 k( 229) = ( 0.3879310 0.5000000 0.3879310), wk = 0.0031646 k( 230) = ( 0.3793103 0.5000000 0.3793103), wk = 0.0031646 k( 231) = ( 0.3706897 0.5000000 0.3706897), wk = 0.0031646 k( 232) = ( 0.3620690 0.5000000 0.3620690), wk = 0.0031646 k( 233) = ( 0.3534483 0.5000000 0.3534483), wk = 0.0031646 k( 234) = ( 0.3448276 0.5000000 0.3448276), wk = 0.0031646 k( 235) = ( 0.3362069 0.5000000 0.3362069), wk = 0.0031646 k( 236) = ( 0.3275862 0.5000000 0.3275862), wk = 0.0031646 k( 237) = ( 0.3189655 0.5000000 0.3189655), wk = 0.0031646 k( 238) = ( 0.3103448 0.5000000 0.3103448), wk = 0.0031646 k( 239) = ( 0.3017241 0.5000000 0.3017241), wk = 0.0031646 k( 240) = ( 0.2931034 0.5000000 0.2931034), wk = 0.0031646 k( 241) = ( 0.2844828 0.5000000 0.2844828), wk = 0.0031646 k( 242) = ( 0.2758621 0.5000000 0.2758621), wk = 0.0031646 k( 243) = ( 0.2672414 0.5000000 0.2672414), wk = 0.0031646 k( 244) = ( 0.2586207 0.5000000 0.2586207), wk = 0.0031646 k( 245) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0031646 k( 246) = ( 0.2413793 0.5000000 0.2413793), wk = 0.0031646 k( 247) = ( 0.2327586 0.5000000 0.2327586), wk = 0.0031646 k( 248) = ( 0.2241379 0.5000000 0.2241379), wk = 0.0031646 k( 249) = ( 0.2155172 0.5000000 0.2155172), wk = 0.0031646 k( 250) = ( 0.2068966 0.5000000 0.2068965), wk = 0.0031646 k( 251) = ( 0.1982759 0.5000000 0.1982759), wk = 0.0031646 k( 252) = ( 0.1896552 0.5000000 0.1896552), wk = 0.0031646 k( 253) = ( 0.1810345 0.5000000 0.1810345), wk = 0.0031646 k( 254) = ( 0.1724138 0.5000000 0.1724138), wk = 0.0031646 k( 255) = ( 0.1637931 0.5000000 0.1637931), wk = 0.0031646 k( 256) = ( 0.1551724 0.5000000 0.1551724), wk = 0.0031646 k( 257) = ( 0.1465517 0.5000000 0.1465517), wk = 0.0031646 k( 258) = ( 0.1379310 0.5000000 0.1379310), wk = 0.0031646 k( 259) = ( 0.1293103 0.5000000 0.1293103), wk = 0.0031646 k( 260) = ( 0.1206897 0.5000000 0.1206897), wk = 0.0031646 k( 261) = ( 0.1120690 0.5000000 0.1120690), wk = 0.0031646 k( 262) = ( 0.1034483 0.5000000 0.1034483), wk = 0.0031646 k( 263) = ( 0.0948276 0.5000000 0.0948276), wk = 0.0031646 k( 264) = ( 0.0862069 0.5000000 0.0862069), wk = 0.0031646 k( 265) = ( 0.0775862 0.5000000 0.0775862), wk = 0.0031646 k( 266) = ( 0.0689655 0.5000000 0.0689655), wk = 0.0031646 k( 267) = ( 0.0603448 0.5000000 0.0603448), wk = 0.0031646 k( 268) = ( 0.0517241 0.5000000 0.0517241), wk = 0.0031646 k( 269) = ( 0.0431035 0.5000000 0.0431034), wk = 0.0031646 k( 270) = ( 0.0344828 0.5000000 0.0344828), wk = 0.0031646 k( 271) = ( 0.0258621 0.5000000 0.0258621), wk = 0.0031646 k( 272) = ( 0.0172414 0.5000000 0.0172414), wk = 0.0031646 k( 273) = ( 0.0086207 0.5000000 0.0086207), wk = 0.0031646 k( 274) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031646 k( 275) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031646 k( 276) = ( 0.5000000 0.5000000 0.0121951), wk = 0.0031646 k( 277) = ( 0.5000000 0.5000000 0.0243902), wk = 0.0031646 k( 278) = ( 0.5000000 0.5000000 0.0365854), wk = 0.0031646 k( 279) = ( 0.5000000 0.5000000 0.0487805), wk = 0.0031646 k( 280) = ( 0.5000000 0.5000000 0.0609756), wk = 0.0031646 k( 281) = ( 0.5000000 0.5000000 0.0731707), wk = 0.0031646 k( 282) = ( 0.5000000 0.5000000 0.0853658), wk = 0.0031646 k( 283) = ( 0.5000000 0.5000000 0.0975610), wk = 0.0031646 k( 284) = ( 0.5000000 0.5000000 0.1097561), wk = 0.0031646 k( 285) = ( 0.5000000 0.5000000 0.1219512), wk = 0.0031646 k( 286) = ( 0.5000000 0.5000000 0.1341463), wk = 0.0031646 k( 287) = ( 0.5000000 0.5000000 0.1463415), wk = 0.0031646 k( 288) = ( 0.5000000 0.5000000 0.1585366), wk = 0.0031646 k( 289) = ( 0.5000000 0.5000000 0.1707317), wk = 0.0031646 k( 290) = ( 0.5000000 0.5000000 0.1829268), wk = 0.0031646 k( 291) = ( 0.5000000 0.5000000 0.1951219), wk = 0.0031646 k( 292) = ( 0.5000000 0.5000000 0.2073171), wk = 0.0031646 k( 293) = ( 0.5000000 0.5000000 0.2195122), wk = 0.0031646 k( 294) = ( 0.5000000 0.5000000 0.2317073), wk = 0.0031646 k( 295) = ( 0.5000000 0.5000000 0.2439024), wk = 0.0031646 k( 296) = ( 0.5000000 0.5000000 0.2560976), wk = 0.0031646 k( 297) = ( 0.5000000 0.5000000 0.2682927), wk = 0.0031646 k( 298) = ( 0.5000000 0.5000000 0.2804878), wk = 0.0031646 k( 299) = ( 0.5000000 0.5000000 0.2926829), wk = 0.0031646 k( 300) = ( 0.5000000 0.5000000 0.3048780), wk = 0.0031646 k( 301) = ( 0.5000000 0.5000000 0.3170732), wk = 0.0031646 k( 302) = ( 0.5000000 0.5000000 0.3292683), wk = 0.0031646 k( 303) = ( 0.5000000 0.5000000 0.3414634), wk = 0.0031646 k( 304) = ( 0.5000000 0.5000000 0.3536585), wk = 0.0031646 k( 305) = ( 0.5000000 0.5000000 0.3658537), wk = 0.0031646 k( 306) = ( 0.5000000 0.5000000 0.3780488), wk = 0.0031646 k( 307) = ( 0.5000000 0.5000000 0.3902439), wk = 0.0031646 k( 308) = ( 0.5000000 0.5000000 0.4024390), wk = 0.0031646 k( 309) = ( 0.5000000 0.5000000 0.4146341), wk = 0.0031646 k( 310) = ( 0.5000000 0.5000000 0.4268293), wk = 0.0031646 k( 311) = ( 0.5000000 0.5000000 0.4390244), wk = 0.0031646 k( 312) = ( 0.5000000 0.5000000 0.4512195), wk = 0.0031646 k( 313) = ( 0.5000000 0.5000000 0.4634146), wk = 0.0031646 k( 314) = ( 0.5000000 0.5000000 0.4756098), wk = 0.0031646 k( 315) = ( 0.5000000 0.5000000 0.4878049), wk = 0.0031646 k( 316) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031646 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031646 k( 2) = ( 0.0000000 0.0121951 0.0000000), wk = 0.0031646 k( 3) = ( 0.0000000 0.0243902 0.0000000), wk = 0.0031646 k( 4) = ( 0.0000000 0.0365854 0.0000000), wk = 0.0031646 k( 5) = ( 0.0000000 0.0487805 0.0000000), wk = 0.0031646 k( 6) = ( 0.0000000 0.0609756 0.0000000), wk = 0.0031646 k( 7) = ( 0.0000000 0.0731707 0.0000000), wk = 0.0031646 k( 8) = ( 0.0000000 0.0853658 0.0000000), wk = 0.0031646 k( 9) = ( 0.0000000 0.0975610 0.0000000), wk = 0.0031646 k( 10) = ( 0.0000000 0.1097561 0.0000000), wk = 0.0031646 k( 11) = ( 0.0000000 0.1219512 0.0000000), wk = 0.0031646 k( 12) = ( 0.0000000 0.1341463 0.0000000), wk = 0.0031646 k( 13) = ( 0.0000000 0.1463415 0.0000000), wk = 0.0031646 k( 14) = ( 0.0000000 0.1585366 0.0000000), wk = 0.0031646 k( 15) = ( 0.0000000 0.1707317 0.0000000), wk = 0.0031646 k( 16) = ( 0.0000000 0.1829268 0.0000000), wk = 0.0031646 k( 17) = ( 0.0000000 0.1951219 0.0000000), wk = 0.0031646 k( 18) = ( 0.0000000 0.2073171 0.0000000), wk = 0.0031646 k( 19) = ( 0.0000000 0.2195122 0.0000000), wk = 0.0031646 k( 20) = ( 0.0000000 0.2317073 0.0000000), wk = 0.0031646 k( 21) = ( 0.0000000 0.2439024 0.0000000), wk = 0.0031646 k( 22) = ( 0.0000000 0.2560976 0.0000000), wk = 0.0031646 k( 23) = ( 0.0000000 0.2682927 0.0000000), wk = 0.0031646 k( 24) = ( 0.0000000 0.2804878 0.0000000), wk = 0.0031646 k( 25) = ( 0.0000000 0.2926829 0.0000000), wk = 0.0031646 k( 26) = ( 0.0000000 0.3048781 0.0000000), wk = 0.0031646 k( 27) = ( 0.0000000 0.3170732 0.0000000), wk = 0.0031646 k( 28) = ( 0.0000000 0.3292683 0.0000000), wk = 0.0031646 k( 29) = ( 0.0000000 0.3414634 0.0000000), wk = 0.0031646 k( 30) = ( 0.0000000 0.3536585 0.0000000), wk = 0.0031646 k( 31) = ( 0.0000000 0.3658537 0.0000000), wk = 0.0031646 k( 32) = ( 0.0000000 0.3780488 0.0000000), wk = 0.0031646 k( 33) = ( 0.0000000 0.3902439 0.0000000), wk = 0.0031646 k( 34) = ( 0.0000000 0.4024390 0.0000000), wk = 0.0031646 k( 35) = ( 0.0000000 0.4146341 0.0000000), wk = 0.0031646 k( 36) = ( 0.0000000 0.4268293 0.0000000), wk = 0.0031646 k( 37) = ( 0.0000000 0.4390244 0.0000000), wk = 0.0031646 k( 38) = ( 0.0000000 0.4512195 0.0000000), wk = 0.0031646 k( 39) = ( 0.0000000 0.4634146 0.0000000), wk = 0.0031646 k( 40) = ( 0.0000000 0.4756098 0.0000000), wk = 0.0031646 k( 41) = ( 0.0000000 0.4878049 0.0000000), wk = 0.0031646 k( 42) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031646 k( 43) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031646 k( 44) = ( 0.0121951 0.5000000 0.0000000), wk = 0.0031646 k( 45) = ( 0.0243902 0.5000000 0.0000000), wk = 0.0031646 k( 46) = ( 0.0365854 0.5000000 0.0000000), wk = 0.0031646 k( 47) = ( 0.0487805 0.5000000 0.0000000), wk = 0.0031646 k( 48) = ( 0.0609756 0.5000000 0.0000000), wk = 0.0031646 k( 49) = ( 0.0731707 0.5000000 0.0000000), wk = 0.0031646 k( 50) = ( 0.0853658 0.5000000 0.0000000), wk = 0.0031646 k( 51) = ( 0.0975610 0.5000000 0.0000000), wk = 0.0031646 k( 52) = ( 0.1097561 0.5000000 0.0000000), wk = 0.0031646 k( 53) = ( 0.1219512 0.5000000 0.0000000), wk = 0.0031646 k( 54) = ( 0.1341463 0.5000000 0.0000000), wk = 0.0031646 k( 55) = ( 0.1463415 0.5000000 0.0000000), wk = 0.0031646 k( 56) = ( 0.1585366 0.5000000 0.0000000), wk = 0.0031646 k( 57) = ( 0.1707317 0.5000000 0.0000000), wk = 0.0031646 k( 58) = ( 0.1829268 0.5000000 0.0000000), wk = 0.0031646 k( 59) = ( 0.1951219 0.5000000 0.0000000), wk = 0.0031646 k( 60) = ( 0.2073171 0.5000000 0.0000000), wk = 0.0031646 k( 61) = ( 0.2195122 0.5000000 0.0000000), wk = 0.0031646 k( 62) = ( 0.2317073 0.5000000 0.0000000), wk = 0.0031646 k( 63) = ( 0.2439024 0.5000000 0.0000000), wk = 0.0031646 k( 64) = ( 0.2560976 0.5000000 0.0000000), wk = 0.0031646 k( 65) = ( 0.2682927 0.5000000 0.0000000), wk = 0.0031646 k( 66) = ( 0.2804878 0.5000000 0.0000000), wk = 0.0031646 k( 67) = ( 0.2926829 0.5000000 0.0000000), wk = 0.0031646 k( 68) = ( 0.3048781 0.5000000 0.0000000), wk = 0.0031646 k( 69) = ( 0.3170732 0.5000000 0.0000000), wk = 0.0031646 k( 70) = ( 0.3292683 0.5000000 -0.0000000), wk = 0.0031646 k( 71) = ( 0.3414634 0.5000000 0.0000000), wk = 0.0031646 k( 72) = ( 0.3536585 0.5000000 -0.0000000), wk = 0.0031646 k( 73) = ( 0.3658537 0.5000000 0.0000000), wk = 0.0031646 k( 74) = ( 0.3780488 0.5000000 0.0000000), wk = 0.0031646 k( 75) = ( 0.3902439 0.5000000 0.0000000), wk = 0.0031646 k( 76) = ( 0.4024390 0.5000000 -0.0000000), wk = 0.0031646 k( 77) = ( 0.4146341 0.5000000 0.0000000), wk = 0.0031646 k( 78) = ( 0.4268293 0.5000000 0.0000000), wk = 0.0031646 k( 79) = ( 0.4390244 0.5000000 0.0000000), wk = 0.0031646 k( 80) = ( 0.4512195 0.5000000 0.0000000), wk = 0.0031646 k( 81) = ( 0.4634146 0.5000000 0.0000000), wk = 0.0031646 k( 82) = ( 0.4756098 0.5000000 0.0000000), wk = 0.0031646 k( 83) = ( 0.4878049 0.5000000 0.0000000), wk = 0.0031646 k( 84) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031646 k( 85) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031646 k( 86) = ( 0.4913793 0.4913793 0.0000000), wk = 0.0031646 k( 87) = ( 0.4827586 0.4827586 0.0000000), wk = 0.0031646 k( 88) = ( 0.4741379 0.4741379 0.0000000), wk = 0.0031646 k( 89) = ( 0.4655172 0.4655172 0.0000000), wk = 0.0031646 k( 90) = ( 0.4568966 0.4568966 0.0000000), wk = 0.0031646 k( 91) = ( 0.4482759 0.4482759 0.0000000), wk = 0.0031646 k( 92) = ( 0.4396552 0.4396552 0.0000000), wk = 0.0031646 k( 93) = ( 0.4310345 0.4310345 0.0000000), wk = 0.0031646 k( 94) = ( 0.4224138 0.4224138 0.0000000), wk = 0.0031646 k( 95) = ( 0.4137931 0.4137931 0.0000000), wk = 0.0031646 k( 96) = ( 0.4051724 0.4051724 0.0000000), wk = 0.0031646 k( 97) = ( 0.3965517 0.3965517 0.0000000), wk = 0.0031646 k( 98) = ( 0.3879310 0.3879310 0.0000000), wk = 0.0031646 k( 99) = ( 0.3793103 0.3793103 0.0000000), wk = 0.0031646 k( 100) = ( 0.3706897 0.3706897 0.0000000), wk = 0.0031646 k( 101) = ( 0.3620690 0.3620690 0.0000000), wk = 0.0031646 k( 102) = ( 0.3534483 0.3534483 0.0000000), wk = 0.0031646 k( 103) = ( 0.3448276 0.3448276 0.0000000), wk = 0.0031646 k( 104) = ( 0.3362069 0.3362069 0.0000000), wk = 0.0031646 k( 105) = ( 0.3275862 0.3275862 0.0000000), wk = 0.0031646 k( 106) = ( 0.3189655 0.3189655 0.0000000), wk = 0.0031646 k( 107) = ( 0.3103448 0.3103448 0.0000000), wk = 0.0031646 k( 108) = ( 0.3017241 0.3017241 0.0000000), wk = 0.0031646 k( 109) = ( 0.2931034 0.2931034 0.0000000), wk = 0.0031646 k( 110) = ( 0.2844828 0.2844828 0.0000000), wk = 0.0031646 k( 111) = ( 0.2758621 0.2758621 0.0000000), wk = 0.0031646 k( 112) = ( 0.2672414 0.2672414 0.0000000), wk = 0.0031646 k( 113) = ( 0.2586207 0.2586207 0.0000000), wk = 0.0031646 k( 114) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0031646 k( 115) = ( 0.2413793 0.2413793 0.0000000), wk = 0.0031646 k( 116) = ( 0.2327586 0.2327586 0.0000000), wk = 0.0031646 k( 117) = ( 0.2241379 0.2241379 0.0000000), wk = 0.0031646 k( 118) = ( 0.2155172 0.2155172 0.0000000), wk = 0.0031646 k( 119) = ( 0.2068966 0.2068966 0.0000000), wk = 0.0031646 k( 120) = ( 0.1982759 0.1982759 0.0000000), wk = 0.0031646 k( 121) = ( 0.1896552 0.1896552 0.0000000), wk = 0.0031646 k( 122) = ( 0.1810345 0.1810345 0.0000000), wk = 0.0031646 k( 123) = ( 0.1724138 0.1724138 0.0000000), wk = 0.0031646 k( 124) = ( 0.1637931 0.1637931 0.0000000), wk = 0.0031646 k( 125) = ( 0.1551724 0.1551724 0.0000000), wk = 0.0031646 k( 126) = ( 0.1465517 0.1465517 0.0000000), wk = 0.0031646 k( 127) = ( 0.1379310 0.1379310 0.0000000), wk = 0.0031646 k( 128) = ( 0.1293103 0.1293103 0.0000000), wk = 0.0031646 k( 129) = ( 0.1206897 0.1206897 0.0000000), wk = 0.0031646 k( 130) = ( 0.1120690 0.1120690 0.0000000), wk = 0.0031646 k( 131) = ( 0.1034483 0.1034483 0.0000000), wk = 0.0031646 k( 132) = ( 0.0948276 0.0948276 0.0000000), wk = 0.0031646 k( 133) = ( 0.0862069 0.0862069 0.0000000), wk = 0.0031646 k( 134) = ( 0.0775862 0.0775862 0.0000000), wk = 0.0031646 k( 135) = ( 0.0689655 0.0689655 0.0000000), wk = 0.0031646 k( 136) = ( 0.0603448 0.0603448 0.0000000), wk = 0.0031646 k( 137) = ( 0.0517241 0.0517241 0.0000000), wk = 0.0031646 k( 138) = ( 0.0431035 0.0431035 0.0000000), wk = 0.0031646 k( 139) = ( 0.0344828 0.0344828 0.0000000), wk = 0.0031646 k( 140) = ( 0.0258621 0.0258621 0.0000000), wk = 0.0031646 k( 141) = ( 0.0172414 0.0172414 0.0000000), wk = 0.0031646 k( 142) = ( 0.0086207 0.0086207 0.0000000), wk = 0.0031646 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031646 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031646 k( 145) = ( 0.0070422 0.0070422 0.0070422), wk = 0.0031646 k( 146) = ( 0.0140845 0.0140845 0.0140845), wk = 0.0031646 k( 147) = ( 0.0211268 0.0211268 0.0211268), wk = 0.0031646 k( 148) = ( 0.0281690 0.0281690 0.0281690), wk = 0.0031646 k( 149) = ( 0.0352113 0.0352113 0.0352113), wk = 0.0031646 k( 150) = ( 0.0422535 0.0422535 0.0422535), wk = 0.0031646 k( 151) = ( 0.0492958 0.0492958 0.0492958), wk = 0.0031646 k( 152) = ( 0.0563380 0.0563380 0.0563380), wk = 0.0031646 k( 153) = ( 0.0633803 0.0633803 0.0633803), wk = 0.0031646 k( 154) = ( 0.0704225 0.0704225 0.0704225), wk = 0.0031646 k( 155) = ( 0.0774648 0.0774648 0.0774648), wk = 0.0031646 k( 156) = ( 0.0845070 0.0845070 0.0845070), wk = 0.0031646 k( 157) = ( 0.0915493 0.0915493 0.0915493), wk = 0.0031646 k( 158) = ( 0.0985916 0.0985916 0.0985916), wk = 0.0031646 k( 159) = ( 0.1056338 0.1056338 0.1056338), wk = 0.0031646 k( 160) = ( 0.1126761 0.1126761 0.1126761), wk = 0.0031646 k( 161) = ( 0.1197183 0.1197183 0.1197183), wk = 0.0031646 k( 162) = ( 0.1267606 0.1267606 0.1267606), wk = 0.0031646 k( 163) = ( 0.1338028 0.1338028 0.1338028), wk = 0.0031646 k( 164) = ( 0.1408451 0.1408451 0.1408451), wk = 0.0031646 k( 165) = ( 0.1478873 0.1478873 0.1478873), wk = 0.0031646 k( 166) = ( 0.1549296 0.1549296 0.1549296), wk = 0.0031646 k( 167) = ( 0.1619718 0.1619718 0.1619718), wk = 0.0031646 k( 168) = ( 0.1690141 0.1690141 0.1690141), wk = 0.0031646 k( 169) = ( 0.1760563 0.1760563 0.1760563), wk = 0.0031646 k( 170) = ( 0.1830986 0.1830986 0.1830986), wk = 0.0031646 k( 171) = ( 0.1901409 0.1901409 0.1901409), wk = 0.0031646 k( 172) = ( 0.1971831 0.1971831 0.1971831), wk = 0.0031646 k( 173) = ( 0.2042253 0.2042253 0.2042253), wk = 0.0031646 k( 174) = ( 0.2112676 0.2112676 0.2112676), wk = 0.0031646 k( 175) = ( 0.2183099 0.2183099 0.2183099), wk = 0.0031646 k( 176) = ( 0.2253521 0.2253521 0.2253521), wk = 0.0031646 k( 177) = ( 0.2323944 0.2323944 0.2323944), wk = 0.0031646 k( 178) = ( 0.2394366 0.2394366 0.2394366), wk = 0.0031646 k( 179) = ( 0.2464789 0.2464789 0.2464789), wk = 0.0031646 k( 180) = ( 0.2535211 0.2535211 0.2535211), wk = 0.0031646 k( 181) = ( 0.2605634 0.2605634 0.2605634), wk = 0.0031646 k( 182) = ( 0.2676056 0.2676056 0.2676056), wk = 0.0031646 k( 183) = ( 0.2746479 0.2746479 0.2746479), wk = 0.0031646 k( 184) = ( 0.2816901 0.2816901 0.2816901), wk = 0.0031646 k( 185) = ( 0.2887324 0.2887324 0.2887324), wk = 0.0031646 k( 186) = ( 0.2957746 0.2957746 0.2957746), wk = 0.0031646 k( 187) = ( 0.3028169 0.3028169 0.3028169), wk = 0.0031646 k( 188) = ( 0.3098592 0.3098592 0.3098592), wk = 0.0031646 k( 189) = ( 0.3169014 0.3169014 0.3169014), wk = 0.0031646 k( 190) = ( 0.3239437 0.3239437 0.3239437), wk = 0.0031646 k( 191) = ( 0.3309859 0.3309859 0.3309859), wk = 0.0031646 k( 192) = ( 0.3380282 0.3380282 0.3380282), wk = 0.0031646 k( 193) = ( 0.3450704 0.3450704 0.3450704), wk = 0.0031646 k( 194) = ( 0.3521127 0.3521127 0.3521127), wk = 0.0031646 k( 195) = ( 0.3591549 0.3591549 0.3591549), wk = 0.0031646 k( 196) = ( 0.3661972 0.3661972 0.3661972), wk = 0.0031646 k( 197) = ( 0.3732394 0.3732394 0.3732394), wk = 0.0031646 k( 198) = ( 0.3802817 0.3802817 0.3802817), wk = 0.0031646 k( 199) = ( 0.3873239 0.3873239 0.3873239), wk = 0.0031646 k( 200) = ( 0.3943662 0.3943662 0.3943662), wk = 0.0031646 k( 201) = ( 0.4014085 0.4014085 0.4014085), wk = 0.0031646 k( 202) = ( 0.4084507 0.4084507 0.4084507), wk = 0.0031646 k( 203) = ( 0.4154930 0.4154930 0.4154930), wk = 0.0031646 k( 204) = ( 0.4225352 0.4225352 0.4225352), wk = 0.0031646 k( 205) = ( 0.4295775 0.4295775 0.4295775), wk = 0.0031646 k( 206) = ( 0.4366197 0.4366197 0.4366197), wk = 0.0031646 k( 207) = ( 0.4436620 0.4436620 0.4436620), wk = 0.0031646 k( 208) = ( 0.4507042 0.4507042 0.4507042), wk = 0.0031646 k( 209) = ( 0.4577465 0.4577465 0.4577465), wk = 0.0031646 k( 210) = ( 0.4647887 0.4647887 0.4647887), wk = 0.0031646 k( 211) = ( 0.4718310 0.4718310 0.4718310), wk = 0.0031646 k( 212) = ( 0.4788732 0.4788732 0.4788732), wk = 0.0031646 k( 213) = ( 0.4859155 0.4859155 0.4859155), wk = 0.0031646 k( 214) = ( 0.4929577 0.4929577 0.4929577), wk = 0.0031646 k( 215) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031646 k( 216) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031646 k( 217) = ( 0.4913793 0.5000000 0.4913793), wk = 0.0031646 k( 218) = ( 0.4827586 0.5000000 0.4827586), wk = 0.0031646 k( 219) = ( 0.4741379 0.5000000 0.4741379), wk = 0.0031646 k( 220) = ( 0.4655172 0.5000000 0.4655172), wk = 0.0031646 k( 221) = ( 0.4568966 0.5000000 0.4568966), wk = 0.0031646 k( 222) = ( 0.4482759 0.5000000 0.4482759), wk = 0.0031646 k( 223) = ( 0.4396552 0.5000000 0.4396552), wk = 0.0031646 k( 224) = ( 0.4310345 0.5000000 0.4310345), wk = 0.0031646 k( 225) = ( 0.4224138 0.5000000 0.4224138), wk = 0.0031646 k( 226) = ( 0.4137931 0.5000000 0.4137931), wk = 0.0031646 k( 227) = ( 0.4051724 0.5000000 0.4051724), wk = 0.0031646 k( 228) = ( 0.3965517 0.5000000 0.3965517), wk = 0.0031646 k( 229) = ( 0.3879310 0.5000000 0.3879310), wk = 0.0031646 k( 230) = ( 0.3793103 0.5000000 0.3793103), wk = 0.0031646 k( 231) = ( 0.3706897 0.5000000 0.3706897), wk = 0.0031646 k( 232) = ( 0.3620690 0.5000000 0.3620690), wk = 0.0031646 k( 233) = ( 0.3534483 0.5000000 0.3534483), wk = 0.0031646 k( 234) = ( 0.3448276 0.5000000 0.3448276), wk = 0.0031646 k( 235) = ( 0.3362069 0.5000000 0.3362069), wk = 0.0031646 k( 236) = ( 0.3275862 0.5000000 0.3275862), wk = 0.0031646 k( 237) = ( 0.3189655 0.5000000 0.3189655), wk = 0.0031646 k( 238) = ( 0.3103448 0.5000000 0.3103448), wk = 0.0031646 k( 239) = ( 0.3017241 0.5000000 0.3017241), wk = 0.0031646 k( 240) = ( 0.2931034 0.5000000 0.2931034), wk = 0.0031646 k( 241) = ( 0.2844828 0.5000000 0.2844828), wk = 0.0031646 k( 242) = ( 0.2758621 0.5000000 0.2758621), wk = 0.0031646 k( 243) = ( 0.2672414 0.5000000 0.2672414), wk = 0.0031646 k( 244) = ( 0.2586207 0.5000000 0.2586207), wk = 0.0031646 k( 245) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0031646 k( 246) = ( 0.2413793 0.5000000 0.2413793), wk = 0.0031646 k( 247) = ( 0.2327586 0.5000000 0.2327586), wk = 0.0031646 k( 248) = ( 0.2241379 0.5000000 0.2241379), wk = 0.0031646 k( 249) = ( 0.2155172 0.5000000 0.2155172), wk = 0.0031646 k( 250) = ( 0.2068966 0.5000000 0.2068966), wk = 0.0031646 k( 251) = ( 0.1982759 0.5000000 0.1982759), wk = 0.0031646 k( 252) = ( 0.1896552 0.5000000 0.1896552), wk = 0.0031646 k( 253) = ( 0.1810345 0.5000000 0.1810345), wk = 0.0031646 k( 254) = ( 0.1724138 0.5000000 0.1724138), wk = 0.0031646 k( 255) = ( 0.1637931 0.5000000 0.1637931), wk = 0.0031646 k( 256) = ( 0.1551724 0.5000000 0.1551724), wk = 0.0031646 k( 257) = ( 0.1465517 0.5000000 0.1465517), wk = 0.0031646 k( 258) = ( 0.1379310 0.5000000 0.1379310), wk = 0.0031646 k( 259) = ( 0.1293103 0.5000000 0.1293103), wk = 0.0031646 k( 260) = ( 0.1206897 0.5000000 0.1206897), wk = 0.0031646 k( 261) = ( 0.1120690 0.5000000 0.1120690), wk = 0.0031646 k( 262) = ( 0.1034483 0.5000000 0.1034483), wk = 0.0031646 k( 263) = ( 0.0948276 0.5000000 0.0948276), wk = 0.0031646 k( 264) = ( 0.0862069 0.5000000 0.0862069), wk = 0.0031646 k( 265) = ( 0.0775862 0.5000000 0.0775862), wk = 0.0031646 k( 266) = ( 0.0689655 0.5000000 0.0689655), wk = 0.0031646 k( 267) = ( 0.0603448 0.5000000 0.0603448), wk = 0.0031646 k( 268) = ( 0.0517241 0.5000000 0.0517241), wk = 0.0031646 k( 269) = ( 0.0431035 0.5000000 0.0431035), wk = 0.0031646 k( 270) = ( 0.0344828 0.5000000 0.0344828), wk = 0.0031646 k( 271) = ( 0.0258621 0.5000000 0.0258621), wk = 0.0031646 k( 272) = ( 0.0172414 0.5000000 0.0172414), wk = 0.0031646 k( 273) = ( 0.0086207 0.5000000 0.0086207), wk = 0.0031646 k( 274) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031646 k( 275) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031646 k( 276) = ( 0.5000000 0.5000000 0.0121951), wk = 0.0031646 k( 277) = ( 0.5000000 0.5000000 0.0243902), wk = 0.0031646 k( 278) = ( 0.5000000 0.5000000 0.0365854), wk = 0.0031646 k( 279) = ( 0.5000000 0.5000000 0.0487805), wk = 0.0031646 k( 280) = ( 0.5000000 0.5000000 0.0609756), wk = 0.0031646 k( 281) = ( 0.5000000 0.5000000 0.0731707), wk = 0.0031646 k( 282) = ( 0.5000000 0.5000000 0.0853658), wk = 0.0031646 k( 283) = ( 0.5000000 0.5000000 0.0975610), wk = 0.0031646 k( 284) = ( 0.5000000 0.5000000 0.1097561), wk = 0.0031646 k( 285) = ( 0.5000000 0.5000000 0.1219512), wk = 0.0031646 k( 286) = ( 0.5000000 0.5000000 0.1341463), wk = 0.0031646 k( 287) = ( 0.5000000 0.5000000 0.1463415), wk = 0.0031646 k( 288) = ( 0.5000000 0.5000000 0.1585366), wk = 0.0031646 k( 289) = ( 0.5000000 0.5000000 0.1707317), wk = 0.0031646 k( 290) = ( 0.5000000 0.5000000 0.1829268), wk = 0.0031646 k( 291) = ( 0.5000000 0.5000000 0.1951219), wk = 0.0031646 k( 292) = ( 0.5000000 0.5000000 0.2073171), wk = 0.0031646 k( 293) = ( 0.5000000 0.5000000 0.2195122), wk = 0.0031646 k( 294) = ( 0.5000000 0.5000000 0.2317073), wk = 0.0031646 k( 295) = ( 0.5000000 0.5000000 0.2439024), wk = 0.0031646 k( 296) = ( 0.5000000 0.5000000 0.2560976), wk = 0.0031646 k( 297) = ( 0.5000000 0.5000000 0.2682927), wk = 0.0031646 k( 298) = ( 0.5000000 0.5000000 0.2804878), wk = 0.0031646 k( 299) = ( 0.5000000 0.5000000 0.2926829), wk = 0.0031646 k( 300) = ( 0.5000000 0.5000000 0.3048781), wk = 0.0031646 k( 301) = ( 0.5000000 0.5000000 0.3170732), wk = 0.0031646 k( 302) = ( 0.5000000 0.5000000 0.3292683), wk = 0.0031646 k( 303) = ( 0.5000000 0.5000000 0.3414634), wk = 0.0031646 k( 304) = ( 0.5000000 0.5000000 0.3536585), wk = 0.0031646 k( 305) = ( 0.5000000 0.5000000 0.3658537), wk = 0.0031646 k( 306) = ( 0.5000000 0.5000000 0.3780488), wk = 0.0031646 k( 307) = ( 0.5000000 0.5000000 0.3902439), wk = 0.0031646 k( 308) = ( 0.5000000 0.5000000 0.4024390), wk = 0.0031646 k( 309) = ( 0.5000000 0.5000000 0.4146341), wk = 0.0031646 k( 310) = ( 0.5000000 0.5000000 0.4268293), wk = 0.0031646 k( 311) = ( 0.5000000 0.5000000 0.4390244), wk = 0.0031646 k( 312) = ( 0.5000000 0.5000000 0.4512195), wk = 0.0031646 k( 313) = ( 0.5000000 0.5000000 0.4634146), wk = 0.0031646 k( 314) = ( 0.5000000 0.5000000 0.4756098), wk = 0.0031646 k( 315) = ( 0.5000000 0.5000000 0.4878049), wk = 0.0031646 k( 316) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031646 Dense grid: 59085 G-vectors FFT dimensions: ( 50, 50, 50) Smooth grid: 16375 G-vectors FFT dimensions: ( 32, 32, 32) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.08 Mb ( 110, 46) NL pseudopotentials 0.11 Mb ( 55, 136) Each V/rho on FFT grid 0.08 Mb ( 5000) Each G-vector array 0.01 Mb ( 1643) G-vector shells 0.00 Mb ( 380) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.31 Mb ( 110, 184) Each subspace H/S matrix 0.03 Mb ( 46, 46) Each matrix 0.19 Mb ( 136, 2, 46) The potential is recalculated from file : ./FePt3.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.7 secs Computing kpt #: 2 total cpu time spent up to now is 3.0 secs Computing kpt #: 3 total cpu time spent up to now is 3.2 secs Computing kpt #: 4 total cpu time spent up to now is 3.5 secs Computing kpt #: 5 total cpu time spent up to now is 3.8 secs Computing kpt #: 6 total cpu time spent up to now is 4.1 secs Computing kpt #: 7 total cpu time spent up to now is 4.4 secs Computing kpt #: 8 total cpu time spent up to now is 4.7 secs Computing kpt #: 9 total cpu time spent up to now is 5.0 secs Computing kpt #: 10 total cpu time spent up to now is 5.3 secs Computing kpt #: 11 total cpu time spent up to now is 5.5 secs Computing kpt #: 12 total cpu time spent up to now is 5.8 secs Computing kpt #: 13 total cpu time spent up to now is 6.2 secs Computing kpt #: 14 total cpu time spent up to now is 6.4 secs Computing kpt #: 15 total cpu time spent up to now is 6.7 secs Computing kpt #: 16 total cpu time spent up to now is 7.0 secs Computing kpt #: 17 total cpu time spent up to now is 7.3 secs Computing kpt #: 18 total cpu time spent up to now is 7.6 secs Computing kpt #: 19 total cpu time spent up to now is 7.9 secs Computing kpt #: 20 total cpu time spent up to now is 8.2 secs Computing kpt #: 21 total cpu time spent up to now is 8.5 secs Computing kpt #: 22 total cpu time spent up to now is 8.8 secs Computing kpt #: 23 total cpu time spent up to now is 9.1 secs Computing kpt #: 24 total cpu time spent up to now is 9.5 secs Computing kpt #: 25 total cpu time spent up to now is 9.8 secs Computing kpt #: 26 total cpu time spent up to now is 10.1 secs Computing kpt #: 27 total cpu time spent up to now is 10.4 secs Computing kpt #: 28 total cpu time spent up to now is 10.7 secs Computing kpt #: 29 total cpu time spent up to now is 11.0 secs Computing kpt #: 30 total cpu time spent up to now is 11.3 secs Computing kpt #: 31 total cpu time spent up to now is 11.6 secs Computing kpt #: 32 total cpu time spent up to now is 11.9 secs Computing kpt #: 33 total cpu time spent up to now is 12.3 secs Computing kpt #: 34 total cpu time spent up to now is 12.6 secs Computing kpt #: 35 total cpu time spent up to now is 12.9 secs Computing kpt #: 36 total cpu time spent up to now is 13.2 secs Computing kpt #: 37 total cpu time spent up to now is 13.6 secs Computing kpt #: 38 total cpu time spent up to now is 13.9 secs Computing kpt #: 39 total cpu time spent up to now is 14.2 secs Computing kpt #: 40 total cpu time spent up to now is 14.6 secs Computing kpt #: 41 total cpu time spent up to now is 14.9 secs Computing kpt #: 42 total cpu time spent up to now is 15.2 secs Computing kpt #: 43 total cpu time spent up to now is 15.5 secs Computing kpt #: 44 total cpu time spent up to now is 15.9 secs Computing kpt #: 45 total cpu time spent up to now is 16.2 secs Computing kpt #: 46 total cpu time spent up to now is 16.6 secs Computing kpt #: 47 total cpu time spent up to now is 16.9 secs Computing kpt #: 48 total cpu time spent up to now is 17.3 secs Computing kpt #: 49 total cpu time spent up to now is 17.6 secs Computing kpt #: 50 total cpu time spent up to now is 18.0 secs Computing kpt #: 51 total cpu time spent up to now is 18.3 secs Computing kpt #: 52 total cpu time spent up to now is 18.6 secs Computing kpt #: 53 total cpu time spent up to now is 19.0 secs Computing kpt #: 54 total cpu time spent up to now is 19.3 secs Computing kpt #: 55 total cpu time spent up to now is 19.6 secs Computing kpt #: 56 total cpu time spent up to now is 20.0 secs Computing kpt #: 57 total cpu time spent up to now is 20.3 secs Computing kpt #: 58 total cpu time spent up to now is 20.6 secs Computing kpt #: 59 total cpu time spent up to now is 21.0 secs Computing kpt #: 60 total cpu time spent up to now is 21.3 secs Computing kpt #: 61 total cpu time spent up to now is 21.6 secs Computing kpt #: 62 total cpu time spent up to now is 22.0 secs Computing kpt #: 63 total cpu time spent up to now is 22.3 secs Computing kpt #: 64 total cpu time spent up to now is 22.6 secs Computing kpt #: 65 total cpu time spent up to now is 22.9 secs Computing kpt #: 66 total cpu time spent up to now is 23.3 secs Computing kpt #: 67 total cpu time spent up to now is 23.6 secs Computing kpt #: 68 total cpu time spent up to now is 23.9 secs Computing kpt #: 69 total cpu time spent up to now is 24.2 secs Computing kpt #: 70 total cpu time spent up to now is 24.5 secs Computing kpt #: 71 total cpu time spent up to now is 24.8 secs Computing kpt #: 72 total cpu time spent up to now is 25.1 secs Computing kpt #: 73 total cpu time spent up to now is 25.4 secs Computing kpt #: 74 total cpu time spent up to now is 25.7 secs Computing kpt #: 75 total cpu time spent up to now is 26.0 secs Computing kpt #: 76 total cpu time spent up to now is 26.3 secs Computing kpt #: 77 total cpu time spent up to now is 26.6 secs Computing kpt #: 78 total cpu time spent up to now is 26.9 secs Computing kpt #: 79 total cpu time spent up to now is 27.3 secs Computing kpt #: 80 total cpu time spent up to now is 27.6 secs Computing kpt #: 81 total cpu time spent up to now is 27.9 secs Computing kpt #: 82 total cpu time spent up to now is 28.2 secs Computing kpt #: 83 total cpu time spent up to now is 28.6 secs Computing kpt #: 84 total cpu time spent up to now is 29.0 secs Computing kpt #: 85 total cpu time spent up to now is 29.4 secs Computing kpt #: 86 total cpu time spent up to now is 29.7 secs Computing kpt #: 87 total cpu time spent up to now is 30.1 secs Computing kpt #: 88 total cpu time spent up to now is 30.4 secs Computing kpt #: 89 total cpu time spent up to now is 30.7 secs Computing kpt #: 90 total cpu time spent up to now is 31.0 secs Computing kpt #: 91 total cpu time spent up to now is 31.3 secs Computing kpt #: 92 total cpu time spent up to now is 31.6 secs Computing kpt #: 93 total cpu time spent up to now is 31.9 secs Computing kpt #: 94 total cpu time spent up to now is 32.2 secs Computing kpt #: 95 total cpu time spent up to now is 32.5 secs Computing kpt #: 96 total cpu time spent up to now is 32.8 secs Computing kpt #: 97 total cpu time spent up to now is 33.1 secs Computing kpt #: 98 total cpu time spent up to now is 33.4 secs Computing kpt #: 99 total cpu time spent up to now is 33.6 secs Computing kpt #: 100 total cpu time spent up to now is 33.9 secs Computing kpt #: 101 total cpu time spent up to now is 34.2 secs Computing kpt #: 102 total cpu time spent up to now is 34.4 secs Computing kpt #: 103 total cpu time spent up to now is 34.7 secs Computing kpt #: 104 total cpu time spent up to now is 35.0 secs Computing kpt #: 105 total cpu time spent up to now is 35.2 secs Computing kpt #: 106 total cpu time spent up to now is 35.5 secs Computing kpt #: 107 total cpu time spent up to now is 35.7 secs Computing kpt #: 108 total cpu time spent up to now is 36.0 secs Computing kpt #: 109 total cpu time spent up to now is 36.2 secs Computing kpt #: 110 total cpu time spent up to now is 36.5 secs Computing kpt #: 111 total cpu time spent up to now is 36.7 secs Computing kpt #: 112 total cpu time spent up to now is 37.0 secs Computing kpt #: 113 total cpu time spent up to now is 37.2 secs Computing kpt #: 114 total cpu time spent up to now is 37.5 secs Computing kpt #: 115 total cpu time spent up to now is 37.7 secs Computing kpt #: 116 total cpu time spent up to now is 38.0 secs Computing kpt #: 117 total cpu time spent up to now is 38.2 secs Computing kpt #: 118 total cpu time spent up to now is 38.5 secs Computing kpt #: 119 total cpu time spent up to now is 38.7 secs Computing kpt #: 120 total cpu time spent up to now is 39.0 secs Computing kpt #: 121 total cpu time spent up to now is 39.2 secs Computing kpt #: 122 total cpu time spent up to now is 39.5 secs Computing kpt #: 123 total cpu time spent up to now is 39.8 secs Computing kpt #: 124 total cpu time spent up to now is 40.0 secs Computing kpt #: 125 total cpu time spent up to now is 40.3 secs Computing kpt #: 126 total cpu time spent up to now is 40.6 secs Computing kpt #: 127 total cpu time spent up to now is 40.8 secs Computing kpt #: 128 total cpu time spent up to now is 41.1 secs Computing kpt #: 129 total cpu time spent up to now is 41.4 secs Computing kpt #: 130 total cpu time spent up to now is 41.7 secs Computing kpt #: 131 total cpu time spent up to now is 42.0 secs Computing kpt #: 132 total cpu time spent up to now is 42.3 secs Computing kpt #: 133 total cpu time spent up to now is 42.6 secs Computing kpt #: 134 total cpu time spent up to now is 42.9 secs Computing kpt #: 135 total cpu time spent up to now is 43.2 secs Computing kpt #: 136 total cpu time spent up to now is 43.5 secs Computing kpt #: 137 total cpu time spent up to now is 43.8 secs Computing kpt #: 138 total cpu time spent up to now is 44.1 secs Computing kpt #: 139 total cpu time spent up to now is 44.4 secs Computing kpt #: 140 total cpu time spent up to now is 44.7 secs Computing kpt #: 141 total cpu time spent up to now is 44.9 secs Computing kpt #: 142 total cpu time spent up to now is 45.2 secs Computing kpt #: 143 total cpu time spent up to now is 45.5 secs Computing kpt #: 144 total cpu time spent up to now is 45.7 secs Computing kpt #: 145 total cpu time spent up to now is 46.0 secs Computing kpt #: 146 total cpu time spent up to now is 46.3 secs Computing kpt #: 147 total cpu time spent up to now is 46.5 secs Computing kpt #: 148 total cpu time spent up to now is 46.8 secs Computing kpt #: 149 total cpu time spent up to now is 47.1 secs Computing kpt #: 150 total cpu time spent up to now is 47.4 secs Computing kpt #: 151 total cpu time spent up to now is 47.7 secs Computing kpt #: 152 total cpu time spent up to now is 48.0 secs Computing kpt #: 153 total cpu time spent up to now is 48.3 secs Computing kpt #: 154 total cpu time spent up to now is 48.7 secs Computing kpt #: 155 total cpu time spent up to now is 49.0 secs Computing kpt #: 156 total cpu time spent up to now is 49.3 secs Computing kpt #: 157 total cpu time spent up to now is 49.6 secs Computing kpt #: 158 total cpu time spent up to now is 49.9 secs Computing kpt #: 159 total cpu time spent up to now is 50.2 secs Computing kpt #: 160 total cpu time spent up to now is 50.6 secs Computing kpt #: 161 total cpu time spent up to now is 50.9 secs Computing kpt #: 162 total cpu time spent up to now is 51.2 secs Computing kpt #: 163 total cpu time spent up to now is 51.5 secs Computing kpt #: 164 total cpu time spent up to now is 51.9 secs Computing kpt #: 165 total cpu time spent up to now is 52.2 secs Computing kpt #: 166 total cpu time spent up to now is 52.5 secs Computing kpt #: 167 total cpu time spent up to now is 52.9 secs Computing kpt #: 168 total cpu time spent up to now is 53.2 secs Computing kpt #: 169 total cpu time spent up to now is 53.5 secs Computing kpt #: 170 total cpu time spent up to now is 53.9 secs Computing kpt #: 171 total cpu time spent up to now is 54.3 secs Computing kpt #: 172 total cpu time spent up to now is 54.6 secs Computing kpt #: 173 total cpu time spent up to now is 55.0 secs Computing kpt #: 174 total cpu time spent up to now is 55.3 secs Computing kpt #: 175 total cpu time spent up to now is 55.7 secs Computing kpt #: 176 total cpu time spent up to now is 56.0 secs Computing kpt #: 177 total cpu time spent up to now is 56.4 secs Computing kpt #: 178 total cpu time spent up to now is 56.8 secs Computing kpt #: 179 total cpu time spent up to now is 57.1 secs Computing kpt #: 180 total cpu time spent up to now is 57.5 secs Computing kpt #: 181 total cpu time spent up to now is 57.8 secs Computing kpt #: 182 total cpu time spent up to now is 58.2 secs Computing kpt #: 183 total cpu time spent up to now is 58.5 secs Computing kpt #: 184 total cpu time spent up to now is 58.8 secs Computing kpt #: 185 total cpu time spent up to now is 59.2 secs Computing kpt #: 186 total cpu time spent up to now is 59.5 secs Computing kpt #: 187 total cpu time spent up to now is 59.8 secs Computing kpt #: 188 total cpu time spent up to now is 60.2 secs Computing kpt #: 189 total cpu time spent up to now is 60.5 secs Computing kpt #: 190 total cpu time spent up to now is 60.8 secs Computing kpt #: 191 total cpu time spent up to now is 61.2 secs Computing kpt #: 192 total cpu time spent up to now is 61.5 secs Computing kpt #: 193 total cpu time spent up to now is 61.8 secs Computing kpt #: 194 total cpu time spent up to now is 62.2 secs Computing kpt #: 195 total cpu time spent up to now is 62.5 secs Computing kpt #: 196 total cpu time spent up to now is 62.9 secs Computing kpt #: 197 total cpu time spent up to now is 63.3 secs Computing kpt #: 198 total cpu time spent up to now is 63.6 secs Computing kpt #: 199 total cpu time spent up to now is 64.0 secs Computing kpt #: 200 total cpu time spent up to now is 64.3 secs Computing kpt #: 201 total cpu time spent up to now is 64.6 secs Computing kpt #: 202 total cpu time spent up to now is 64.9 secs Computing kpt #: 203 total cpu time spent up to now is 65.3 secs Computing kpt #: 204 total cpu time spent up to now is 65.6 secs Computing kpt #: 205 total cpu time spent up to now is 65.9 secs Computing kpt #: 206 total cpu time spent up to now is 66.3 secs Computing kpt #: 207 total cpu time spent up to now is 66.6 secs Computing kpt #: 208 total cpu time spent up to now is 66.9 secs Computing kpt #: 209 total cpu time spent up to now is 67.3 secs Computing kpt #: 210 total cpu time spent up to now is 67.7 secs Computing kpt #: 211 total cpu time spent up to now is 68.1 secs Computing kpt #: 212 total cpu time spent up to now is 68.5 secs Computing kpt #: 213 total cpu time spent up to now is 69.0 secs Computing kpt #: 214 total cpu time spent up to now is 69.3 secs Computing kpt #: 215 total cpu time spent up to now is 69.7 secs Computing kpt #: 216 total cpu time spent up to now is 70.0 secs Computing kpt #: 217 total cpu time spent up to now is 70.4 secs Computing kpt #: 218 total cpu time spent up to now is 70.8 secs Computing kpt #: 219 total cpu time spent up to now is 71.2 secs Computing kpt #: 220 total cpu time spent up to now is 71.7 secs Computing kpt #: 221 total cpu time spent up to now is 72.1 secs Computing kpt #: 222 total cpu time spent up to now is 72.4 secs Computing kpt #: 223 total cpu time spent up to now is 72.8 secs Computing kpt #: 224 total cpu time spent up to now is 73.2 secs Computing kpt #: 225 total cpu time spent up to now is 73.6 secs Computing kpt #: 226 total cpu time spent up to now is 74.1 secs Computing kpt #: 227 total cpu time spent up to now is 74.5 secs Computing kpt #: 228 total cpu time spent up to now is 75.0 secs Computing kpt #: 229 total cpu time spent up to now is 75.4 secs Computing kpt #: 230 total cpu time spent up to now is 75.8 secs Computing kpt #: 231 total cpu time spent up to now is 76.2 secs Computing kpt #: 232 total cpu time spent up to now is 76.7 secs Computing kpt #: 233 total cpu time spent up to now is 77.1 secs Computing kpt #: 234 total cpu time spent up to now is 77.5 secs Computing kpt #: 235 total cpu time spent up to now is 77.8 secs Computing kpt #: 236 total cpu time spent up to now is 78.1 secs Computing kpt #: 237 total cpu time spent up to now is 78.5 secs Computing kpt #: 238 total cpu time spent up to now is 78.9 secs Computing kpt #: 239 total cpu time spent up to now is 79.2 secs Computing kpt #: 240 total cpu time spent up to now is 79.6 secs Computing kpt #: 241 total cpu time spent up to now is 80.0 secs Computing kpt #: 242 total cpu time spent up to now is 80.3 secs Computing kpt #: 243 total cpu time spent up to now is 80.7 secs Computing kpt #: 244 total cpu time spent up to now is 81.0 secs Computing kpt #: 245 total cpu time spent up to now is 81.4 secs Computing kpt #: 246 total cpu time spent up to now is 81.8 secs Computing kpt #: 247 total cpu time spent up to now is 82.2 secs Computing kpt #: 248 total cpu time spent up to now is 82.6 secs Computing kpt #: 249 total cpu time spent up to now is 83.1 secs Computing kpt #: 250 total cpu time spent up to now is 83.5 secs Computing kpt #: 251 total cpu time spent up to now is 83.9 secs Computing kpt #: 252 total cpu time spent up to now is 84.4 secs Computing kpt #: 253 total cpu time spent up to now is 84.8 secs Computing kpt #: 254 total cpu time spent up to now is 85.3 secs Computing kpt #: 255 total cpu time spent up to now is 85.7 secs Computing kpt #: 256 total cpu time spent up to now is 86.1 secs Computing kpt #: 257 total cpu time spent up to now is 86.5 secs Computing kpt #: 258 total cpu time spent up to now is 86.9 secs Computing kpt #: 259 total cpu time spent up to now is 87.3 secs Computing kpt #: 260 total cpu time spent up to now is 87.6 secs Computing kpt #: 261 total cpu time spent up to now is 87.9 secs Computing kpt #: 262 total cpu time spent up to now is 88.3 secs Computing kpt #: 263 total cpu time spent up to now is 88.6 secs Computing kpt #: 264 total cpu time spent up to now is 88.9 secs Computing kpt #: 265 total cpu time spent up to now is 89.3 secs Computing kpt #: 266 total cpu time spent up to now is 89.6 secs Computing kpt #: 267 total cpu time spent up to now is 89.9 secs Computing kpt #: 268 total cpu time spent up to now is 90.2 secs Computing kpt #: 269 total cpu time spent up to now is 90.6 secs Computing kpt #: 270 total cpu time spent up to now is 90.9 secs Computing kpt #: 271 total cpu time spent up to now is 91.3 secs Computing kpt #: 272 total cpu time spent up to now is 91.6 secs Computing kpt #: 273 total cpu time spent up to now is 91.9 secs Computing kpt #: 274 total cpu time spent up to now is 92.3 secs Computing kpt #: 275 total cpu time spent up to now is 92.7 secs Computing kpt #: 276 total cpu time spent up to now is 93.0 secs Computing kpt #: 277 total cpu time spent up to now is 93.4 secs Computing kpt #: 278 total cpu time spent up to now is 93.8 secs Computing kpt #: 279 total cpu time spent up to now is 94.1 secs Computing kpt #: 280 total cpu time spent up to now is 94.5 secs Computing kpt #: 281 total cpu time spent up to now is 94.9 secs Computing kpt #: 282 total cpu time spent up to now is 95.2 secs Computing kpt #: 283 total cpu time spent up to now is 95.6 secs Computing kpt #: 284 total cpu time spent up to now is 96.0 secs Computing kpt #: 285 total cpu time spent up to now is 96.4 secs Computing kpt #: 286 total cpu time spent up to now is 96.7 secs Computing kpt #: 287 total cpu time spent up to now is 97.1 secs Computing kpt #: 288 total cpu time spent up to now is 97.4 secs Computing kpt #: 289 total cpu time spent up to now is 97.8 secs Computing kpt #: 290 total cpu time spent up to now is 98.2 secs Computing kpt #: 291 total cpu time spent up to now is 98.6 secs Computing kpt #: 292 total cpu time spent up to now is 99.0 secs Computing kpt #: 293 total cpu time spent up to now is 99.4 secs Computing kpt #: 294 total cpu time spent up to now is 99.8 secs Computing kpt #: 295 total cpu time spent up to now is 100.2 secs Computing kpt #: 296 total cpu time spent up to now is 100.7 secs Computing kpt #: 297 total cpu time spent up to now is 101.1 secs Computing kpt #: 298 total cpu time spent up to now is 101.5 secs Computing kpt #: 299 total cpu time spent up to now is 102.0 secs Computing kpt #: 300 total cpu time spent up to now is 102.4 secs Computing kpt #: 301 total cpu time spent up to now is 102.8 secs Computing kpt #: 302 total cpu time spent up to now is 103.2 secs Computing kpt #: 303 total cpu time spent up to now is 103.5 secs Computing kpt #: 304 total cpu time spent up to now is 103.9 secs Computing kpt #: 305 total cpu time spent up to now is 104.3 secs Computing kpt #: 306 total cpu time spent up to now is 104.7 secs Computing kpt #: 307 total cpu time spent up to now is 105.0 secs Computing kpt #: 308 total cpu time spent up to now is 105.4 secs Computing kpt #: 309 total cpu time spent up to now is 105.8 secs Computing kpt #: 310 total cpu time spent up to now is 106.2 secs Computing kpt #: 311 total cpu time spent up to now is 106.6 secs Computing kpt #: 312 total cpu time spent up to now is 107.0 secs Computing kpt #: 313 total cpu time spent up to now is 107.5 secs Computing kpt #: 314 total cpu time spent up to now is 107.9 secs Computing kpt #: 315 total cpu time spent up to now is 108.3 secs Computing kpt #: 316 total cpu time spent up to now is 108.6 secs ethr = 2.63E-08, avg # of iterations = 21.9 total cpu time spent up to now is 108.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2103 PWs) bands (ev): 6.6292 6.6292 9.2460 9.2460 10.1136 10.1136 10.1136 10.1136 10.1586 10.1586 10.3405 10.3405 10.3405 10.3405 13.2430 13.2430 13.2430 13.2430 13.8838 13.8838 15.4520 15.4520 15.4520 15.4520 16.5797 16.5797 16.7764 16.7764 16.7764 16.7764 16.8115 16.8115 17.2366 17.2366 17.2366 17.2366 17.5446 17.5446 17.6819 17.6819 17.6819 17.6819 18.0706 18.0706 18.0706 18.0706 k = 0.0000 0.0122-0.0000 ( 2087 PWs) bands (ev): 6.6312 6.6312 9.2473 9.2473 10.1144 10.1144 10.1149 10.1149 10.1596 10.1596 10.3414 10.3414 10.3417 10.3417 13.2425 13.2425 13.2434 13.2434 13.8838 13.8838 15.4505 15.4505 15.4522 15.4522 16.5774 16.5774 16.7710 16.7710 16.7748 16.7748 16.8038 16.8038 17.2298 17.2298 17.2334 17.2334 17.5362 17.5362 17.6670 17.6670 17.6698 17.6698 18.0788 18.0788 18.1026 18.1026 k = 0.0000 0.0244-0.0000 ( 2071 PWs) bands (ev): 6.6371 6.6371 9.2512 9.2512 10.1168 10.1168 10.1186 10.1186 10.1626 10.1626 10.3441 10.3441 10.3452 10.3452 13.2411 13.2411 13.2444 13.2444 13.8837 13.8837 15.4460 15.4460 15.4528 15.4528 16.5701 16.5701 16.7543 16.7543 16.7650 16.7650 16.7851 16.7851 17.2094 17.2094 17.2234 17.2234 17.5136 17.5136 17.6300 17.6300 17.6461 17.6461 18.0942 18.0942 18.1838 18.1838 k = 0.0000 0.0366-0.0000 ( 2063 PWs) bands (ev): 6.6469 6.6469 9.2578 9.2578 10.1206 10.1206 10.1247 10.1247 10.1675 10.1675 10.3485 10.3485 10.3512 10.3512 13.2388 13.2388 13.2460 13.2460 13.8834 13.8834 15.4384 15.4384 15.4538 15.4538 16.5564 16.5564 16.7264 16.7264 16.7282 16.7282 16.7739 16.7739 17.1767 17.1767 17.2071 17.2071 17.4855 17.4855 17.5845 17.5845 17.6237 17.6237 18.0994 18.0994 18.2925 18.2925 k = 0.0000 0.0488-0.0000 ( 2063 PWs) bands (ev): 6.6606 6.6606 9.2669 9.2669 10.1259 10.1259 10.1331 10.1331 10.1744 10.1744 10.3548 10.3548 10.3595 10.3595 13.2354 13.2354 13.2482 13.2482 13.8831 13.8831 15.4278 15.4278 15.4551 15.4551 16.5336 16.5336 16.6688 16.6688 16.6886 16.6886 16.7661 16.7661 17.1363 17.1363 17.1851 17.1851 17.4606 17.4606 17.5400 17.5400 17.6032 17.6032 18.0828 18.0828 18.4165 18.4165 k = 0.0000 0.0610-0.0000 ( 2055 PWs) bands (ev): 6.6782 6.6782 9.2785 9.2785 10.1325 10.1325 10.1437 10.1437 10.1833 10.1833 10.3628 10.3628 10.3703 10.3703 13.2310 13.2310 13.2511 13.2511 13.8827 13.8827 15.4142 15.4142 15.4566 15.4566 16.4961 16.4961 16.5924 16.5924 16.6463 16.6463 16.7571 16.7571 17.0942 17.0942 17.1584 17.1584 17.4418 17.4418 17.5008 17.5008 17.5823 17.5823 18.0409 18.0409 18.5497 18.5497 k = 0.0000 0.0732-0.0000 ( 2055 PWs) bands (ev): 6.6997 6.6997 9.2927 9.2927 10.1405 10.1405 10.1562 10.1562 10.1944 10.1944 10.3728 10.3728 10.3836 10.3836 13.2254 13.2254 13.2544 13.2544 13.8824 13.8824 15.3977 15.3977 15.4583 15.4583 16.4380 16.4380 16.5018 16.5018 16.6068 16.6068 16.7461 16.7461 17.0546 17.0546 17.1280 17.1280 17.4279 17.4279 17.4674 17.4674 17.5597 17.5597 17.9762 17.9762 18.6891 18.6891 k = 0.0000 0.0854-0.0000 ( 2055 PWs) bands (ev): 6.7250 6.7250 9.3094 9.3094 10.1498 10.1498 10.1705 10.1705 10.2076 10.2076 10.3846 10.3846 10.3995 10.3995 13.2186 13.2186 13.2583 13.2583 13.8822 13.8822 15.3783 15.3783 15.4600 15.4600 16.3594 16.3594 16.3997 16.3997 16.5728 16.5728 16.7326 16.7326 17.0190 17.0190 17.0947 17.0947 17.4175 17.4175 17.4388 17.4388 17.5347 17.5347 17.8927 17.8927 18.8329 18.8329 k = 0.0000 0.0976-0.0000 ( 2043 PWs) bands (ev): 6.7541 6.7541 9.3285 9.3285 10.1601 10.1601 10.1862 10.1862 10.2233 10.2233 10.3985 10.3985 10.4181 10.4181 13.2106 13.2106 13.2626 13.2626 13.8821 13.8821 15.3560 15.3560 15.4615 15.4615 16.2665 16.2665 16.2887 16.2887 16.5418 16.5418 16.7164 16.7164 16.9870 16.9870 17.0588 17.0588 17.4091 17.4091 17.4135 17.4135 17.5073 17.5073 17.7951 17.7951 18.9801 18.9801 k = 0.0000 0.1098-0.0000 ( 2043 PWs) bands (ev): 6.7871 6.7871 9.3500 9.3500 10.1714 10.1714 10.2030 10.2030 10.2416 10.2416 10.4144 10.4144 10.4394 10.4394 13.2012 13.2012 13.2672 13.2672 13.8821 13.8821 15.3309 15.3309 15.4623 15.4623 16.1653 16.1653 16.1711 16.1711 16.5108 16.5108 16.6968 16.6968 16.9575 16.9575 17.0203 17.0203 17.3894 17.3894 17.4018 17.4018 17.4777 17.4777 17.6879 17.6879 19.1299 19.1299 k = 0.0000 0.1220-0.0000 ( 2040 PWs) bands (ev): 6.8237 6.8237 9.3738 9.3738 10.1836 10.1836 10.2207 10.2207 10.2626 10.2626 10.4324 10.4324 10.4636 10.4636 13.1905 13.1905 13.2722 13.2722 13.8824 13.8824 15.3031 15.3031 15.4616 15.4616 16.0488 16.0488 16.0605 16.0605 16.4781 16.4781 16.6730 16.6730 16.9297 16.9297 16.9793 16.9793 17.3631 17.3631 17.3943 17.3943 17.4468 17.4468 17.5772 17.5772 19.2818 19.2818 k = 0.0000 0.1341-0.0000 ( 2040 PWs) bands (ev): 6.8641 6.8641 9.3999 9.3999 10.1965 10.1965 10.2389 10.2389 10.2862 10.2862 10.4526 10.4526 10.4906 10.4906 13.1783 13.1783 13.2772 13.2772 13.8827 13.8827 15.2726 15.2726 15.4583 15.4583 15.9232 15.9232 15.9558 15.9558 16.4429 16.4429 16.6437 16.6437 16.9029 16.9029 16.9357 16.9357 17.3257 17.3257 17.3830 17.3830 17.4180 17.4180 17.4751 17.4751 19.4355 19.4355 k = 0.0000 0.1463-0.0000 ( 2032 PWs) bands (ev): 6.9081 6.9081 9.4281 9.4281 10.2099 10.2099 10.2577 10.2577 10.3125 10.3125 10.4750 10.4750 10.5205 10.5205 13.1647 13.1647 13.2823 13.2823 13.8832 13.8832 15.2397 15.2397 15.4498 15.4498 15.7954 15.7954 15.8556 15.8556 16.4046 16.4046 16.6068 16.6068 16.8765 16.8765 16.8896 16.8896 17.2572 17.2572 17.3591 17.3591 17.4005 17.4005 17.4051 17.4051 19.5906 19.5906 k = 0.0000 0.1585-0.0000 ( 2032 PWs) bands (ev): 6.9557 6.9557 9.4584 9.4584 10.2236 10.2236 10.2771 10.2771 10.3413 10.3413 10.4998 10.4998 10.5532 10.5532 13.1495 13.1495 13.2873 13.2873 13.8837 13.8837 15.2043 15.2043 15.4313 15.4313 15.6662 15.6662 15.7658 15.7658 16.3629 16.3629 16.5590 16.5590 16.8417 16.8417 16.8501 16.8501 17.1594 17.1594 17.3240 17.3240 17.3695 17.3695 17.3926 17.3926 19.7470 19.7470 k = 0.0000 0.1707-0.0000 ( 2032 PWs) bands (ev): 7.0068 7.0068 9.4907 9.4907 10.2376 10.2376 10.2971 10.2971 10.3724 10.3724 10.5269 10.5269 10.5888 10.5888 13.1329 13.1329 13.2919 13.2919 13.8839 13.8839 15.1666 15.1666 15.3952 15.3952 15.5362 15.5362 15.6948 15.6948 16.3177 16.3177 16.4962 16.4962 16.7932 16.7932 16.8235 16.8235 17.0568 17.0568 17.2848 17.2848 17.3480 17.3480 17.3877 17.3877 19.9043 19.9043 k = 0.0000 0.1829-0.0000 ( 2028 PWs) bands (ev): 7.0613 7.0613 9.5249 9.5249 10.2515 10.2515 10.3178 10.3178 10.4057 10.4057 10.5564 10.5564 10.6272 10.6272 13.1149 13.1149 13.2961 13.2961 13.8836 13.8836 15.1266 15.1266 15.3364 15.3364 15.4060 15.4060 15.6488 15.6488 16.2692 16.2692 16.4147 16.4147 16.7462 16.7462 16.7965 16.7965 16.9614 16.9614 17.2435 17.2435 17.3319 17.3319 17.3839 17.3839 20.0625 20.0625 k = 0.0000 0.1951-0.0000 ( 2028 PWs) bands (ev): 7.1192 7.1192 9.5607 9.5607 10.2654 10.2654 10.3390 10.3390 10.4410 10.4410 10.5883 10.5883 10.6683 10.6683 13.0954 13.0954 13.2995 13.2995 13.8823 13.8823 15.0845 15.0845 15.2586 15.2586 15.2762 15.2762 15.6248 15.6248 16.2173 16.2173 16.3137 16.3137 16.7021 16.7021 16.7688 16.7688 16.8766 16.8766 17.2012 17.2012 17.3185 17.3185 17.3807 17.3807 20.2214 20.2214 k = 0.0000 0.2073-0.0000 ( 2028 PWs) bands (ev): 7.1804 7.1804 9.5982 9.5982 10.2790 10.2790 10.3608 10.3608 10.4784 10.4784 10.6226 10.6226 10.7119 10.7119 13.0746 13.0746 13.3019 13.3019 13.8796 13.8796 15.0396 15.0396 15.1479 15.1479 15.1707 15.1707 15.6144 15.6144 16.1623 16.1623 16.1963 16.1963 16.6614 16.6614 16.7402 16.7402 16.8015 16.8015 17.1582 17.1582 17.3068 17.3068 17.3779 17.3779 20.3808 20.3808 k = 0.0000 0.2195-0.0000 ( 2032 PWs) bands (ev): 7.2447 7.2447 9.6370 9.6370 10.2921 10.2921 10.3832 10.3832 10.5178 10.5178 10.6595 10.6595 10.7580 10.7580 13.0526 13.0526 13.3029 13.3029 13.8748 13.8748 14.9842 14.9842 15.0294 15.0294 15.0799 15.0799 15.6114 15.6114 16.0672 16.0672 16.1047 16.1047 16.6233 16.6233 16.7105 16.7105 16.7335 16.7335 17.1152 17.1152 17.2963 17.2963 17.3754 17.3754 20.5406 20.5406 k = 0.0000 0.2317-0.0000 ( 2024 PWs) bands (ev): 7.3121 7.3121 9.6770 9.6770 10.3047 10.3047 10.4060 10.4060 10.5590 10.5590 10.6987 10.6987 10.8062 10.8062 13.0295 13.0295 13.3022 13.3022 13.8669 13.8669 14.8788 14.8788 14.9605 14.9605 14.9906 14.9906 15.6121 15.6121 15.9313 15.9313 16.0448 16.0448 16.5873 16.5873 16.6703 16.6703 16.6795 16.6795 17.0725 17.0725 17.2869 17.2869 17.3731 17.3731 20.7007 20.7007 k = 0.0000 0.2439-0.0000 ( 2024 PWs) bands (ev): 7.3823 7.3823 9.7180 9.7180 10.3166 10.3166 10.4293 10.4293 10.6021 10.6021 10.7404 10.7404 10.8565 10.8565 13.0054 13.0054 13.2993 13.2993 13.8549 13.8549 14.7541 14.7541 14.9057 14.9057 14.9113 14.9113 15.6143 15.6143 15.7923 15.7923 15.9835 15.9835 16.5524 16.5524 16.6103 16.6103 16.6471 16.6471 17.0306 17.0306 17.2784 17.2784 17.3710 17.3710 20.8608 20.8608 k = 0.0000 0.2561-0.0000 ( 2036 PWs) bands (ev): 7.4553 7.4553 9.7597 9.7597 10.3275 10.3275 10.4530 10.4530 10.6469 10.6469 10.7844 10.7844 10.9086 10.9086 12.9806 12.9806 13.2937 13.2937 13.8374 13.8374 14.6285 14.6285 14.8275 14.8275 14.8637 14.8637 15.6158 15.6158 15.6531 15.6531 15.9221 15.9221 16.5177 16.5177 16.5530 16.5530 16.6129 16.6129 16.9898 16.9898 17.2707 17.2707 17.3691 17.3691 21.0210 21.0210 k = 0.0000 0.2683-0.0000 ( 2036 PWs) bands (ev): 7.5308 7.5308 9.8019 9.8019 10.3375 10.3375 10.4770 10.4770 10.6934 10.6934 10.8307 10.8307 10.9622 10.9622 12.9551 12.9551 13.2850 13.2850 13.8133 13.8133 14.5039 14.5039 14.7578 14.7578 14.8166 14.8166 15.5159 15.5159 15.6140 15.6140 15.8632 15.8632 16.4810 16.4810 16.5001 16.5001 16.5771 16.5771 16.9506 16.9506 17.2637 17.2637 17.3674 17.3674 21.1809 21.1809 k = 0.0000 0.2805-0.0000 ( 2036 PWs) bands (ev): 7.6088 7.6088 9.8441 9.8441 10.3465 10.3465 10.5011 10.5011 10.7416 10.7416 10.8794 10.8794 11.0170 11.0170 12.9292 12.9292 13.2725 13.2725 13.7815 13.7815 14.3809 14.3809 14.6981 14.6981 14.7699 14.7699 15.3825 15.3825 15.6042 15.6042 15.8115 15.8115 16.4343 16.4343 16.4591 16.4591 16.5395 16.5395 16.9132 16.9132 17.2574 17.2574 17.3658 17.3658 21.3405 21.3405 k = 0.0000 0.2927-0.0000 ( 2040 PWs) bands (ev): 7.6889 7.6889 9.8860 9.8860 10.3543 10.3543 10.5254 10.5254 10.7914 10.7914 10.9303 10.9303 11.0727 11.0727 12.9030 12.9030 13.2557 13.2557 13.7413 13.7413 14.2600 14.2600 14.6494 14.6494 14.7236 14.7236 15.2546 15.2546 15.5792 15.5792 15.7742 15.7742 16.3819 16.3819 16.4257 16.4257 16.5004 16.5004 16.8776 16.8776 17.2517 17.2517 17.3644 17.3644 21.4996 21.4996 k = 0.0000 0.3049-0.0000 ( 2040 PWs) bands (ev): 7.7709 7.7709 9.9271 9.9271 10.3609 10.3609 10.5498 10.5498 10.8426 10.8426 10.9834 10.9834 11.1290 11.1290 12.8767 12.8767 13.2337 13.2337 13.6928 13.6928 14.1417 14.1417 14.6118 14.6118 14.6776 14.6776 15.1338 15.1338 15.5354 15.5354 15.7551 15.7551 16.3294 16.3294 16.3944 16.3944 16.4598 16.4598 16.8441 16.8441 17.2465 17.2465 17.3631 17.3631 21.6579 21.6579 k = 0.0000 0.3171-0.0000 ( 2040 PWs) bands (ev): 7.8545 7.8545 9.9667 9.9667 10.3666 10.3666 10.5740 10.5740 10.8952 10.8952 11.0387 11.0387 11.1854 11.1854 12.8506 12.8506 13.2062 13.2062 13.6366 13.6366 14.0267 14.0267 14.5849 14.5849 14.6315 14.6315 15.0217 15.0217 15.4773 15.4773 15.7502 15.7502 16.2779 16.2779 16.3643 16.3643 16.4181 16.4181 16.8127 16.8127 17.2419 17.2419 17.3619 17.3619 21.8153 21.8153 k = 0.0000 0.3293-0.0000 ( 2040 PWs) bands (ev): 7.9394 7.9394 10.0040 10.0040 10.3714 10.3714 10.5979 10.5979 10.9490 10.9490 11.0960 11.0960 11.2416 11.2416 12.8247 12.8247 13.1723 13.1723 13.5743 13.5743 13.9155 13.9155 14.5673 14.5673 14.5845 14.5845 14.9204 14.9204 15.4115 15.4115 15.7532 15.7532 16.2276 16.2276 16.3353 16.3353 16.3756 16.3756 16.7833 16.7833 17.2377 17.2377 17.3608 17.3608 21.9715 21.9715 k = 0.0000 0.3415-0.0000 ( 2040 PWs) bands (ev): 8.0253 8.0253 10.0381 10.0381 10.3760 10.3760 10.6214 10.6214 11.0039 11.0039 11.1554 11.1554 11.2969 11.2969 12.7992 12.7992 13.1317 13.1317 13.5073 13.5073 13.8092 13.8092 14.5350 14.5350 14.5578 14.5578 14.8321 14.8321 15.3419 15.3419 15.7604 15.7604 16.1790 16.1790 16.3076 16.3076 16.3328 16.3328 16.7559 16.7559 17.2340 17.2340 17.3598 17.3598 22.1261 22.1261 k = 0.0000 0.3537-0.0000 ( 2040 PWs) bands (ev): 8.1115 8.1115 10.0678 10.0678 10.3809 10.3809 10.6444 10.6444 11.0596 11.0596 11.2167 11.2167 11.3510 11.3510 12.7743 12.7743 13.0840 13.0840 13.4376 13.4376 13.7087 13.7087 14.4816 14.4816 14.5546 14.5546 14.7589 14.7589 15.2712 15.2712 15.7698 15.7698 16.1322 16.1322 16.2812 16.2812 16.2901 16.2901 16.7303 16.7303 17.2307 17.2307 17.3589 17.3589 22.2788 22.2788 k = 0.0000 0.3659-0.0000 ( 2040 PWs) bands (ev): 8.1977 8.1977 10.0916 10.0916 10.3870 10.3870 10.6666 10.6666 11.1159 11.1159 11.2798 11.2798 11.4033 11.4033 12.7498 12.7498 13.0291 13.0291 13.3670 13.3670 13.6148 13.6148 14.4238 14.4238 14.5565 14.5565 14.7015 14.7015 15.2006 15.2006 15.7806 15.7806 16.0874 16.0874 16.2479 16.2479 16.2563 16.2563 16.7066 16.7066 17.2277 17.2277 17.3581 17.3581 22.4291 22.4291 k = 0.0000 0.3780-0.0000 ( 2048 PWs) bands (ev): 8.2832 8.2832 10.1082 10.1082 10.3953 10.3953 10.6878 10.6878 11.1724 11.1724 11.3448 11.3448 11.4531 11.4531 12.7258 12.7258 12.9673 12.9673 13.2970 13.2970 13.5283 13.5283 14.3631 14.3631 14.5621 14.5621 14.6585 14.6585 15.1315 15.1315 15.7921 15.7921 16.0451 16.0451 16.2067 16.2067 16.2329 16.2329 16.6846 16.6846 17.2251 17.2251 17.3574 17.3574 22.5766 22.5766 k = 0.0000 0.3902-0.0000 ( 2048 PWs) bands (ev): 8.3672 8.3672 10.1167 10.1167 10.4065 10.4065 10.7080 10.7080 11.2288 11.2288 11.4113 11.4113 11.4999 11.4999 12.7021 12.7021 12.8992 12.8992 13.2295 13.2295 13.4499 13.4499 14.3022 14.3022 14.5703 14.5703 14.6271 14.6271 15.0648 15.0648 15.8040 15.8040 16.0054 16.0054 16.1668 16.1668 16.2113 16.2113 16.6645 16.6645 17.2228 17.2228 17.3567 17.3567 22.7204 22.7204 k = 0.0000 0.4024-0.0000 ( 2048 PWs) bands (ev): 8.4489 8.4489 10.1172 10.1172 10.4203 10.4203 10.7267 10.7267 11.2845 11.2845 11.4794 11.4794 11.5432 11.5432 12.6783 12.6783 12.8260 12.8260 13.1661 13.1661 13.3799 13.3799 14.2436 14.2436 14.5802 14.5802 14.6045 14.6045 15.0015 15.0015 15.8160 15.8160 15.9687 15.9687 16.1288 16.1288 16.1917 16.1917 16.6461 16.6461 17.2208 17.2208 17.3562 17.3562 22.8596 22.8596 k = 0.0000 0.4146-0.0000 ( 2056 PWs) bands (ev): 8.5271 8.5271 10.1104 10.1104 10.4361 10.4361 10.7440 10.7440 11.3389 11.3389 11.5486 11.5486 11.5823 11.5823 12.6540 12.6540 12.7488 12.7488 13.1083 13.1083 13.3183 13.3183 14.1892 14.1892 14.5884 14.5884 14.5909 14.5909 14.9425 14.9425 15.8281 15.8281 15.9352 15.9352 16.0929 16.0929 16.1740 16.1740 16.6296 16.6296 17.2190 17.2190 17.3556 17.3556 22.9932 22.9932 k = 0.0000 0.4268-0.0000 ( 2056 PWs) bands (ev): 8.6007 8.6007 10.0979 10.0979 10.4526 10.4526 10.7594 10.7594 11.3910 11.3910 11.6167 11.6167 11.6189 11.6189 12.6291 12.6291 12.6694 12.6694 13.0578 13.0578 13.2649 13.2649 14.1404 14.1404 14.5771 14.5771 14.6018 14.6018 14.8888 14.8888 15.8401 15.8401 15.9054 15.9054 16.0595 16.0595 16.1584 16.1584 16.6150 16.6150 17.2175 17.2175 17.3552 17.3552 23.1195 23.1195 k = 0.0000 0.4390-0.0000 ( 2056 PWs) bands (ev): 8.6679 8.6679 10.0817 10.0817 10.4685 10.4685 10.7729 10.7729 11.4397 11.4397 11.6461 11.6461 11.6894 11.6894 12.5893 12.5893 12.6036 12.6036 13.0155 13.0155 13.2199 13.2199 14.0979 14.0979 14.5693 14.5693 14.6121 14.6121 14.8413 14.8413 15.8520 15.8520 15.8795 15.8795 16.0289 16.0289 16.1451 16.1451 16.6025 16.6025 17.2163 17.2163 17.3549 17.3549 23.2365 23.2365 k = 0.0000 0.4512-0.0000 ( 2064 PWs) bands (ev): 8.7272 8.7272 10.0639 10.0639 10.4830 10.4830 10.7843 10.7843 11.4837 11.4837 11.6701 11.6701 11.7595 11.7595 12.5104 12.5104 12.5784 12.5784 12.9820 12.9820 13.1830 13.1830 14.0624 14.0624 14.5642 14.5642 14.6212 14.6212 14.8011 14.8011 15.8578 15.8578 15.8640 15.8640 16.0012 16.0012 16.1339 16.1339 16.5920 16.5920 17.2153 17.2153 17.3546 17.3546 23.3413 23.3413 k = 0.0000 0.4634-0.0000 ( 2064 PWs) bands (ev): 8.7764 8.7764 10.0468 10.0468 10.4950 10.4950 10.7933 10.7933 11.5212 11.5212 11.6886 11.6886 11.8271 11.8271 12.4351 12.4351 12.5551 12.5551 12.9573 12.9573 13.1542 13.1542 14.0343 14.0343 14.5610 14.5610 14.6287 14.6287 14.7689 14.7689 15.8407 15.8407 15.8763 15.8763 15.9765 15.9765 16.1252 16.1252 16.5838 16.5838 17.2146 17.2146 17.3544 17.3544 23.4305 23.4305 k = 0.0000 0.4756-0.0000 ( 2064 PWs) bands (ev): 8.8136 8.8136 10.0325 10.0325 10.5040 10.5040 10.7999 10.7999 11.5501 11.5501 11.7016 11.7016 11.8888 11.8888 12.3678 12.3678 12.5359 12.5359 12.9405 12.9405 13.1336 13.1336 14.0141 14.0141 14.5590 14.5590 14.6341 14.6341 14.7456 14.7456 15.8282 15.8282 15.8890 15.8890 15.9547 15.9547 16.1190 16.1190 16.5778 16.5778 17.2140 17.2140 17.3542 17.3542 23.4995 23.4995 k = 0.0000 0.4878-0.0000 ( 2052 PWs) bands (ev): 8.8367 8.8367 10.0230 10.0230 10.5095 10.5095 10.8039 10.8039 11.5686 11.5686 11.7093 11.7093 11.9362 11.9362 12.3169 12.3169 12.5232 12.5232 12.9309 12.9309 13.1213 13.1213 14.0018 14.0018 14.5580 14.5580 14.6373 14.6373 14.7315 14.7315 15.8208 15.8208 15.9024 15.9024 15.9358 15.9358 16.1153 16.1153 16.5743 16.5743 17.2137 17.2137 17.3542 17.3542 23.5435 23.5435 k = 0.0000 0.5000-0.0000 ( 2040 PWs) bands (ev): 8.8447 8.8447 10.0196 10.0196 10.5114 10.5114 10.8052 10.8052 11.5750 11.5750 11.7118 11.7118 11.9552 11.9552 12.2967 12.2967 12.5188 12.5188 12.9278 12.9278 13.1172 13.1172 13.9977 13.9977 14.5577 14.5577 14.6383 14.6383 14.7268 14.7268 15.8184 15.8184 15.9137 15.9137 15.9228 15.9228 16.1141 16.1141 16.5731 16.5731 17.2136 17.2136 17.3542 17.3542 23.5587 23.5587 k = 0.0000 0.5000-0.0000 ( 2040 PWs) bands (ev): 8.8447 8.8447 10.0196 10.0196 10.5114 10.5114 10.8052 10.8052 11.5750 11.5750 11.7118 11.7118 11.9552 11.9552 12.2967 12.2967 12.5188 12.5188 12.9278 12.9278 13.1172 13.1172 13.9977 13.9977 14.5577 14.5577 14.6383 14.6383 14.7268 14.7268 15.8184 15.8184 15.9137 15.9137 15.9228 15.9228 16.1141 16.1141 16.5731 16.5731 17.2136 17.2136 17.3542 17.3542 23.5587 23.5587 k = 0.0122 0.5000-0.0000 ( 2044 PWs) bands (ev): 8.8464 8.8464 10.0205 10.0205 10.5127 10.5127 10.8061 10.8061 11.5745 11.5745 11.7116 11.7116 11.9554 11.9554 12.2956 12.2956 12.5185 12.5185 12.9238 12.9238 13.1203 13.1203 13.9952 13.9952 14.5594 14.5594 14.6405 14.6405 14.7272 14.7272 15.8094 15.8094 15.8955 15.8955 15.9497 15.9497 16.1151 16.1151 16.5734 16.5734 17.2104 17.2104 17.3526 17.3526 23.5424 23.5424 k = 0.0244 0.5000-0.0000 ( 2056 PWs) bands (ev): 8.8515 8.8515 10.0233 10.0233 10.5166 10.5166 10.8086 10.8086 11.5730 11.5730 11.7112 11.7112 11.9559 11.9559 12.2921 12.2921 12.5178 12.5178 12.9126 12.9126 13.1290 13.1290 13.9877 13.9877 14.5639 14.5639 14.6473 14.6473 14.7286 14.7286 15.7854 15.7854 15.8832 15.8832 15.9851 15.9851 16.1181 16.1181 16.5744 16.5744 17.2010 17.2010 17.3478 17.3478 23.4929 23.4929 k = 0.0366 0.5000-0.0000 ( 2060 PWs) bands (ev): 8.8600 8.8600 10.0278 10.0278 10.5232 10.5232 10.8128 10.8128 11.5705 11.5705 11.7104 11.7104 11.9570 11.9570 12.2864 12.2864 12.5167 12.5167 12.8961 12.8961 13.1414 13.1414 13.9760 13.9760 14.5699 14.5699 14.6593 14.6593 14.7307 14.7307 15.7533 15.7533 15.8763 15.8763 16.0222 16.0222 16.1237 16.1237 16.5762 16.5762 17.1854 17.1854 17.3400 17.3400 23.4104 23.4104 k = 0.0488 0.5000-0.0000 ( 2060 PWs) bands (ev): 8.8719 8.8719 10.0341 10.0341 10.5324 10.5324 10.8187 10.8187 11.5670 11.5670 11.7093 11.7093 11.9585 11.9585 12.2783 12.2783 12.5153 12.5153 12.8763 12.8763 13.1556 13.1556 13.9610 13.9610 14.5762 14.5762 14.6767 14.6767 14.7336 14.7336 15.7176 15.7176 15.8713 15.8713 16.0583 16.0583 16.1336 16.1336 16.5788 16.5788 17.1639 17.1639 17.3290 17.3290 23.2978 23.2978 k = 0.0610 0.5000-0.0000 ( 2060 PWs) bands (ev): 8.8872 8.8872 10.0421 10.0421 10.5441 10.5441 10.8263 10.8263 11.5624 11.5624 11.7077 11.7077 11.9608 11.9608 12.2676 12.2676 12.5139 12.5139 12.8546 12.8546 13.1705 13.1705 13.9433 13.9433 14.5819 14.5819 14.6990 14.6990 14.7372 14.7372 15.6804 15.6804 15.8667 15.8667 16.0886 16.0886 16.1516 16.1516 16.5826 16.5826 17.1368 17.1368 17.3151 17.3151 23.1610 23.1610 k = 0.0732 0.5000-0.0000 ( 2058 PWs) bands (ev): 8.9058 8.9058 10.0518 10.0518 10.5585 10.5585 10.8356 10.8356 11.5568 11.5568 11.7058 11.7058 11.9639 11.9639 12.2544 12.2544 12.5125 12.5125 12.8320 12.8320 13.1850 13.1850 13.9240 13.9240 14.5870 14.5870 14.7249 14.7249 14.7417 14.7417 15.6425 15.6425 15.8616 15.8616 16.1090 16.1090 16.1819 16.1819 16.5876 16.5876 17.1044 17.1044 17.2983 17.2983 23.0065 23.0065 k = 0.0854 0.5000-0.0000 ( 2058 PWs) bands (ev): 8.9278 8.9278 10.0632 10.0632 10.5753 10.5753 10.8464 10.8464 11.5500 11.5500 11.7034 11.7034 11.9678 11.9678 12.2386 12.2386 12.5112 12.5112 12.8092 12.8092 13.1988 13.1988 13.9037 13.9037 14.5917 14.5917 14.7435 14.7435 14.7561 14.7561 15.6042 15.6042 15.8560 15.8560 16.1220 16.1220 16.2212 16.2212 16.5942 16.5942 17.0673 17.0673 17.2787 17.2787 22.8398 22.8398 k = 0.0976 0.5000-0.0000 ( 2054 PWs) bands (ev): 8.9529 8.9529 10.0760 10.0760 10.5947 10.5947 10.8589 10.8589 11.5420 11.5420 11.7006 11.7006 11.9725 11.9725 12.2205 12.2205 12.5103 12.5103 12.7865 12.7865 13.2116 13.2116 13.8828 13.8828 14.5962 14.5962 14.7484 14.7484 14.7854 14.7854 15.5660 15.5660 15.8496 15.8496 16.1319 16.1319 16.2654 16.2654 16.6027 16.6027 17.0258 17.0258 17.2564 17.2564 22.6654 22.6654 k = 0.1098 0.5000-0.0000 ( 2050 PWs) bands (ev): 8.9813 8.9813 10.0903 10.0903 10.6165 10.6165 10.8730 10.8730 11.5329 11.5329 11.6975 11.6975 11.9779 11.9779 12.2003 12.2003 12.5098 12.5098 12.7644 12.7644 13.2234 13.2234 13.8618 13.8618 14.6008 14.6008 14.7522 14.7522 14.8155 14.8155 15.5280 15.5280 15.8421 15.8421 16.1404 16.1404 16.3122 16.3122 16.6135 16.6135 16.9805 16.9805 17.2316 17.2316 22.4863 22.4863 k = 0.1220 0.5000-0.0000 ( 2054 PWs) bands (ev): 9.0129 9.0129 10.1060 10.1060 10.6407 10.6407 10.8886 10.8886 11.5226 11.5226 11.6942 11.6942 11.9835 11.9835 12.1787 12.1787 12.5098 12.5098 12.7429 12.7429 13.2340 13.2340 13.8410 13.8410 14.6057 14.6057 14.7550 14.7550 14.8446 14.8446 15.4904 15.4904 15.8334 15.8334 16.1480 16.1480 16.3610 16.3610 16.6269 16.6269 16.9320 16.9320 17.2044 17.2044 22.3048 22.3048 k = 0.1341 0.5000-0.0000 ( 2052 PWs) bands (ev): 9.0475 9.0475 10.1229 10.1229 10.6672 10.6672 10.9057 10.9057 11.5113 11.5113 11.6908 11.6908 11.9887 11.9887 12.1564 12.1564 12.5102 12.5102 12.7221 12.7221 13.2437 13.2437 13.8205 13.8205 14.6109 14.6109 14.7566 14.7566 14.8716 14.8716 15.4537 15.4537 15.8235 15.8235 16.1546 16.1546 16.4116 16.4116 16.6432 16.6432 16.8810 16.8810 17.1752 17.1752 22.1227 22.1227 k = 0.1463 0.5000-0.0000 ( 2052 PWs) bands (ev): 9.0851 9.0851 10.1409 10.1409 10.6960 10.6960 10.9243 10.9243 11.4991 11.4991 11.6873 11.6873 11.9921 11.9921 12.1353 12.1353 12.5112 12.5112 12.7021 12.7021 13.2526 13.2526 13.8004 13.8004 14.6166 14.6166 14.7566 14.7566 14.8951 14.8951 15.4183 15.4183 15.8120 15.8120 16.1602 16.1602 16.4636 16.4636 16.6628 16.6628 16.8279 16.8279 17.1442 17.1442 21.9413 21.9413 k = 0.1585 0.5000-0.0000 ( 2052 PWs) bands (ev): 9.1257 9.1257 10.1599 10.1599 10.7270 10.7270 10.9442 10.9442 11.4862 11.4862 11.6839 11.6839 11.9913 11.9913 12.1176 12.1176 12.5127 12.5127 12.6829 12.6829 13.2610 13.2610 13.7807 13.7807 14.6228 14.6228 14.7545 14.7545 14.9142 14.9142 15.3848 15.3848 15.7989 15.7989 16.1646 16.1646 16.5170 16.5170 16.6858 16.6858 16.7736 16.7736 17.1118 17.1118 21.7615 21.7615 k = 0.1707 0.5000-0.0000 ( 2052 PWs) bands (ev): 9.1690 9.1690 10.1797 10.1797 10.7600 10.7600 10.9655 10.9655 11.4727 11.4727 11.6807 11.6807 11.9834 11.9834 12.1067 12.1067 12.5145 12.5145 12.6645 12.6645 13.2691 13.2691 13.7615 13.7615 14.6295 14.6295 14.7498 14.7498 14.9275 14.9275 15.3538 15.3538 15.7838 15.7838 16.1676 16.1676 16.5718 16.5718 16.7113 16.7113 16.7197 16.7197 17.0785 17.0785 21.5841 21.5841 k = 0.1829 0.5000-0.0000 ( 2056 PWs) bands (ev): 9.2151 9.2151 10.2002 10.2002 10.7951 10.7951 10.9880 10.9880 11.4589 11.4589 11.6776 11.6776 11.9670 11.9670 12.1039 12.1039 12.5166 12.5166 12.6471 12.6471 13.2770 13.2770 13.7428 13.7428 14.6366 14.6366 14.7423 14.7423 14.9342 14.9342 15.3261 15.3261 15.7667 15.7667 16.1693 16.1693 16.6276 16.6276 16.6637 16.6637 16.7418 16.7418 17.0453 17.0453 21.4099 21.4099 k = 0.1951 0.5000-0.0000 ( 2056 PWs) bands (ev): 9.2637 9.2637 10.2211 10.2211 10.8320 10.8320 11.0117 11.0117 11.4452 11.4452 11.6748 11.6748 11.9437 11.9437 12.1077 12.1077 12.5188 12.5188 12.6309 12.6309 13.2852 13.2852 13.7244 13.7244 14.6440 14.6440 14.7317 14.7317 14.9333 14.9333 15.3021 15.3021 15.7472 15.7472 16.1695 16.1695 16.6098 16.6098 16.6843 16.6843 16.7728 16.7728 17.0141 17.0141 21.2394 21.2394 k = 0.2073 0.5000-0.0000 ( 2056 PWs) bands (ev): 9.3148 9.3148 10.2424 10.2424 10.8706 10.8706 11.0365 11.0365 11.4317 11.4317 11.6723 11.6723 11.9162 11.9162 12.1155 12.1155 12.5207 12.5207 12.6163 12.6163 13.2938 13.2938 13.7064 13.7064 14.6510 14.6510 14.7180 14.7180 14.9247 14.9247 15.2819 15.2819 15.7251 15.7251 16.1683 16.1683 16.5574 16.5574 16.7404 16.7404 16.8026 16.8026 16.9889 16.9889 21.0730 21.0730 k = 0.2195 0.5000-0.0000 ( 2056 PWs) bands (ev): 9.3682 9.3682 10.2637 10.2637 10.9107 10.9107 11.0623 11.0623 11.4190 11.4190 11.6700 11.6700 11.8864 11.8864 12.1254 12.1254 12.5216 12.5216 12.6040 12.6040 13.3030 13.3030 13.6888 13.6888 14.6558 14.6558 14.7027 14.7027 14.9091 14.9091 15.2650 15.2650 15.7002 15.7002 16.1659 16.1659 16.5072 16.5072 16.7880 16.7880 16.8303 16.8303 16.9789 16.9789 20.9113 20.9113 k = 0.2317 0.5000-0.0000 ( 2064 PWs) bands (ev): 9.4237 9.4237 10.2848 10.2848 10.9520 10.9520 11.0888 11.0888 11.4073 11.4073 11.6681 11.6681 11.8555 11.8555 12.1362 12.1362 12.5206 12.5206 12.5950 12.5950 13.3131 13.3131 13.6716 13.6716 14.6519 14.6519 14.6916 14.6916 14.8877 14.8877 15.2503 15.2503 15.6724 15.6724 16.1621 16.1621 16.4598 16.4598 16.7972 16.7972 16.8757 16.8757 16.9940 16.9940 20.7544 20.7544 k = 0.2439 0.5000-0.0000 ( 2064 PWs) bands (ev): 9.4812 9.4812 10.3057 10.3057 10.9944 10.9944 11.1160 11.1160 11.3972 11.3972 11.6666 11.6666 11.8242 11.8242 12.1470 12.1470 12.5166 12.5166 12.5904 12.5904 13.3244 13.3244 13.6546 13.6546 14.6324 14.6324 14.6906 14.6906 14.8626 14.8626 15.2365 15.2365 15.6417 15.6417 16.1572 16.1572 16.4157 16.4157 16.7757 16.7757 16.9343 16.9343 17.0310 17.0310 20.6027 20.6027 k = 0.2561 0.5000-0.0000 ( 2064 PWs) bands (ev): 9.5403 9.5403 10.3260 10.3260 11.0374 11.0374 11.1435 11.1435 11.3890 11.3890 11.6655 11.6655 11.7931 11.7931 12.1574 12.1574 12.5096 12.5096 12.5903 12.5903 13.3369 13.3369 13.6380 13.6380 14.6029 14.6029 14.6929 14.6929 14.8362 14.8362 15.2225 15.2225 15.6080 15.6080 16.1512 16.1512 16.3752 16.3752 16.7422 16.7422 16.9961 16.9961 17.0808 17.0808 20.4564 20.4564 k = 0.2683 0.5000-0.0000 ( 2070 PWs) bands (ev): 9.6009 9.6009 10.3455 10.3455 11.0804 11.0804 11.1713 11.1713 11.3835 11.3835 11.6648 11.6648 11.7627 11.7627 12.1670 12.1670 12.5002 12.5002 12.5940 12.5940 13.3507 13.3507 13.6218 13.6218 14.5675 14.5675 14.6909 14.6909 14.8128 14.8128 15.2075 15.2075 15.5716 15.5716 16.1443 16.1443 16.3385 16.3385 16.7036 16.7036 17.0596 17.0596 17.1382 17.1382 20.3156 20.3156 k = 0.2805 0.5000-0.0000 ( 2066 PWs) bands (ev): 9.6627 9.6627 10.3641 10.3641 11.1226 11.1226 11.1989 11.1989 11.3814 11.3814 11.6644 11.6644 11.7334 11.7334 12.1755 12.1755 12.4895 12.4895 12.6003 12.6003 13.3661 13.3661 13.6061 13.6061 14.5279 14.5279 14.6788 14.6788 14.7977 14.7977 15.1909 15.1909 15.5329 15.5329 16.1366 16.1366 16.3057 16.3057 16.6625 16.6625 17.1242 17.1242 17.2006 17.2006 20.1804 20.1804 k = 0.2927 0.5000-0.0000 ( 2066 PWs) bands (ev): 9.7254 9.7254 10.3817 10.3817 11.1627 11.1627 11.2264 11.2264 11.3837 11.3837 11.6639 11.6639 11.7062 11.7062 12.1829 12.1829 12.4783 12.4783 12.6085 12.6085 13.3828 13.3828 13.5910 13.5910 14.4848 14.4848 14.6538 14.6538 14.7932 14.7932 15.1726 15.1726 15.4922 15.4922 16.1282 16.1282 16.2767 16.2767 16.6202 16.6202 17.1898 17.1898 17.2670 17.2670 20.0509 20.0509 k = 0.3049 0.5000-0.0000 ( 2058 PWs) bands (ev): 9.7887 9.7887 10.3979 10.3979 11.1985 11.1985 11.2543 11.2543 11.3913 11.3913 11.6595 11.6595 11.6854 11.6854 12.1892 12.1892 12.4668 12.4668 12.6178 12.6178 13.4007 13.4007 13.5769 13.5769 14.4391 14.4391 14.6192 14.6192 14.7961 14.7961 15.1527 15.1527 15.4501 15.4501 16.1192 16.1192 16.2513 16.2513 16.5773 16.5773 17.2560 17.2560 17.3365 17.3365 19.9270 19.9270 k = 0.3171 0.5000-0.0000 ( 2054 PWs) bands (ev): 9.8522 9.8522 10.4129 10.4129 11.2273 11.2273 11.2837 11.2837 11.4049 11.4049 11.6427 11.6427 11.6802 11.6802 12.1943 12.1943 12.4553 12.4553 12.6278 12.6278 13.4189 13.4189 13.5647 13.5647 14.3914 14.3914 14.5787 14.5787 14.8019 14.8019 15.1320 15.1320 15.4071 15.4071 16.1097 16.1097 16.2291 16.2291 16.5344 16.5344 17.3228 17.3228 17.4089 17.4089 19.8087 19.8087 k = 0.3293 0.5000-0.0000 ( 2058 PWs) bands (ev): 9.9154 9.9154 10.4264 10.4264 11.2483 11.2483 11.3149 11.3149 11.4237 11.4237 11.6206 11.6206 11.6845 11.6845 12.1986 12.1986 12.4438 12.4438 12.6381 12.6381 13.4355 13.4355 13.5561 13.5561 14.3423 14.3423 14.5349 14.5349 14.8076 14.8076 15.1114 15.1114 15.3637 15.3637 16.0998 16.0998 16.2098 16.2098 16.4916 16.4916 17.3897 17.3897 17.4836 17.4836 19.6959 19.6959 k = 0.3415 0.5000-0.0000 ( 2058 PWs) bands (ev): 9.9780 9.9780 10.4385 10.4385 11.2634 11.2634 11.3462 11.3462 11.4455 11.4455 11.5994 11.5994 11.6935 11.6935 12.2022 12.2022 12.4322 12.4322 12.6484 12.6484 13.4473 13.4473 13.5546 13.5546 14.2927 14.2927 14.4891 14.4891 14.8109 14.8109 15.0924 15.0924 15.3204 15.3204 16.0897 16.0897 16.1931 16.1931 16.4495 16.4495 17.4568 17.4568 17.5606 17.5606 19.5884 19.5884 k = 0.3537 0.5000-0.0000 ( 2054 PWs) bands (ev): 10.0394 10.0394 10.4492 10.4492 11.2751 11.2751 11.3763 11.3763 11.4666 11.4666 11.5808 11.5808 11.7076 11.7076 12.2055 12.2055 12.4204 12.4204 12.6584 12.6584 13.4502 13.4502 13.5639 13.5639 14.2431 14.2431 14.4423 14.4423 14.8097 14.8097 15.0769 15.0769 15.2776 15.2776 16.0796 16.0796 16.1786 16.1786 16.4083 16.4083 17.5238 17.5238 17.6396 17.6396 19.4861 19.4861 k = 0.3659 0.5000-0.0000 ( 2056 PWs) bands (ev): 10.0989 10.0989 10.4586 10.4586 11.2850 11.2850 11.4046 11.4046 11.4826 11.4826 11.5671 11.5671 11.7275 11.7275 12.2087 12.2087 12.4083 12.4083 12.6679 12.6679 13.4441 13.4441 13.5839 13.5839 14.1942 14.1942 14.3952 14.3952 14.8024 14.8024 15.0664 15.0664 15.2357 15.2357 16.0696 16.0696 16.1660 16.1660 16.3684 16.3684 17.5904 17.5904 17.7204 17.7204 19.3887 19.3887 k = 0.3780 0.5000-0.0000 ( 2064 PWs) bands (ev): 10.1561 10.1561 10.4669 10.4669 11.2941 11.2941 11.4306 11.4306 11.4889 11.4889 11.5607 11.5607 11.7536 11.7536 12.2121 12.2121 12.3955 12.3955 12.6766 12.6766 13.4322 13.4322 13.6113 13.6113 14.1468 14.1468 14.3486 14.3486 14.7884 14.7884 15.0617 15.0617 15.1954 15.1954 16.0598 16.0598 16.1550 16.1550 16.3299 16.3299 17.6565 17.6565 17.8029 17.8029 19.2962 19.2962 k = 0.3902 0.5000-0.0000 ( 2064 PWs) bands (ev): 10.2102 10.2102 10.4743 10.4743 11.3028 11.3028 11.4544 11.4544 11.4853 11.4853 11.5613 11.5613 11.7854 11.7854 12.2160 12.2160 12.3821 12.3821 12.6845 12.6845 13.4171 13.4171 13.6432 13.6432 14.1015 14.1015 14.3031 14.3031 14.7683 14.7683 15.0620 15.0620 15.1573 15.1573 16.0504 16.0504 16.1455 16.1455 16.2935 16.2935 17.7218 17.7218 17.8869 17.8869 19.2085 19.2085 k = 0.4024 0.5000-0.0000 ( 2060 PWs) bands (ev): 10.2603 10.2603 10.4812 10.4812 11.3114 11.3114 11.4749 11.4749 11.4773 11.4773 11.5650 11.5650 11.8217 11.8217 12.2205 12.2205 12.3678 12.3678 12.6915 12.6915 13.4002 13.4002 13.6779 13.6779 14.0591 14.0591 14.2593 14.2593 14.7436 14.7436 15.0645 15.0645 15.1235 15.1235 16.0413 16.0413 16.1373 16.1373 16.2595 16.2595 17.7860 17.7860 17.9725 17.9725 19.1254 19.1254 k = 0.4146 0.5000-0.0000 ( 2060 PWs) bands (ev): 10.3056 10.3056 10.4878 10.4878 11.3196 11.3196 11.4657 11.4657 11.4949 11.4949 11.5687 11.5687 11.8606 11.8606 12.2255 12.2255 12.3525 12.3525 12.6975 12.6975 13.3824 13.3824 13.7141 13.7141 14.0204 14.0204 14.2177 14.2177 14.7161 14.7161 15.0608 15.0608 15.1015 15.1015 16.0328 16.0328 16.1301 16.1301 16.2283 16.2283 17.8486 17.8486 18.0594 18.0594 19.0470 19.0470 k = 0.4268 0.5000-0.0000 ( 2054 PWs) bands (ev): 10.3450 10.3450 10.4947 10.4947 11.3275 11.3275 11.4554 11.4554 11.5112 11.5112 11.5717 11.5717 11.9005 11.9005 12.2309 12.2309 12.3362 12.3362 12.7026 12.7026 13.3644 13.3644 13.7510 13.7510 13.9858 13.9858 14.1787 14.1787 14.6878 14.6878 15.0408 15.0408 15.1003 15.1003 16.0248 16.0248 16.1240 16.1240 16.2005 16.2005 17.9091 17.9091 18.1478 18.1478 18.9736 18.9736 k = 0.4390 0.5000-0.0000 ( 2054 PWs) bands (ev): 10.3776 10.3776 10.5025 10.5025 11.3348 11.3348 11.4462 11.4462 11.5249 11.5249 11.5738 11.5738 11.9401 11.9401 12.2364 12.2364 12.3190 12.3190 12.7068 12.7068 13.3469 13.3469 13.7874 13.7874 13.9563 13.9563 14.1426 14.1426 14.6601 14.6601 15.0159 15.0159 15.1079 15.1079 16.0176 16.0176 16.1186 16.1186 16.1765 16.1765 17.9666 17.9666 18.2374 18.2374 18.9057 18.9057 k = 0.4512 0.5000-0.0000 ( 2062 PWs) bands (ev): 10.4025 10.4025 10.5113 10.5113 11.3412 11.3412 11.4384 11.4384 11.5358 11.5358 11.5753 11.5753 11.9780 11.9780 12.2413 12.2413 12.3014 12.3014 12.7100 12.7100 13.3309 13.3309 13.8219 13.8219 13.9326 13.9326 14.1094 14.1094 14.6345 14.6345 14.9933 14.9933 15.1168 15.1168 16.0111 16.0111 16.1138 16.1138 16.1567 16.1567 18.0198 18.0198 18.3284 18.3284 18.8443 18.8443 k = 0.4634 0.5000-0.0000 ( 2056 PWs) bands (ev): 10.4198 10.4198 10.5207 10.5207 11.3465 11.3465 11.4323 11.4323 11.5441 11.5441 11.5765 11.5765 12.0125 12.0125 12.2445 12.2445 12.2849 12.2849 12.7124 12.7124 13.3172 13.3172 13.8518 13.8518 13.9169 13.9169 14.0794 14.0794 14.6125 14.6125 14.9747 14.9747 15.1249 15.1249 16.0057 16.0057 16.1094 16.1094 16.1420 16.1420 18.0668 18.0668 18.4208 18.4208 18.7912 18.7912 k = 0.4756 0.5000-0.0000 ( 2048 PWs) bands (ev): 10.4307 10.4307 10.5293 10.5293 11.3505 11.3505 11.4278 11.4278 11.5497 11.5497 11.5773 11.5773 12.0417 12.0417 12.2435 12.2435 12.2728 12.2728 12.7141 12.7141 13.3067 13.3067 13.8696 13.8696 13.9152 13.9152 14.0530 14.0530 14.5955 14.5955 14.9610 14.9610 15.1313 15.1313 16.0017 16.0017 16.1055 16.1055 16.1322 16.1322 18.1048 18.1048 18.5143 18.5143 18.7490 18.7490 k = 0.4878 0.5000-0.0000 ( 2048 PWs) bands (ev): 10.4365 10.4365 10.5353 10.5353 11.3530 11.3530 11.4251 11.4251 11.5530 11.5530 11.5779 11.5779 12.0623 12.0623 12.2380 12.2380 12.2679 12.2679 12.7151 12.7151 13.3000 13.3000 13.8721 13.8721 13.9277 13.9277 14.0322 14.0322 14.5847 14.5847 14.9526 14.9526 15.1354 15.1354 15.9990 15.9990 16.1026 16.1026 16.1268 16.1268 18.1300 18.1300 18.6080 18.6080 18.7210 18.7210 k = 0.5000 0.5000-0.0000 ( 2048 PWs) bands (ev): 10.4383 10.4383 10.5374 10.5374 11.3538 11.3538 11.4242 11.4242 11.5540 11.5540 11.5781 11.5781 12.0699 12.0699 12.2347 12.2347 12.2670 12.2670 12.7154 12.7154 13.2977 13.2977 13.8714 13.8714 13.9355 13.9355 14.0233 14.0233 14.5810 14.5810 14.9498 14.9498 15.1367 15.1367 15.9981 15.9981 16.1015 16.1015 16.1252 16.1252 18.1389 18.1389 18.6830 18.6830 18.7060 18.7060 k = 0.5000 0.5000-0.0000 ( 2048 PWs) bands (ev): 10.4383 10.4383 10.5374 10.5374 11.3538 11.3538 11.4242 11.4242 11.5540 11.5540 11.5781 11.5781 12.0699 12.0699 12.2347 12.2347 12.2670 12.2670 12.7154 12.7154 13.2977 13.2977 13.8714 13.8714 13.9355 13.9355 14.0233 14.0233 14.5810 14.5810 14.9498 14.9498 15.1367 15.1367 15.9981 15.9981 16.1015 16.1015 16.1252 16.1252 18.1389 18.1389 18.6830 18.6830 18.7060 18.7060 k = 0.4914 0.4914-0.0000 ( 2048 PWs) bands (ev): 10.4363 10.4363 10.5354 10.5354 11.3530 11.3530 11.4251 11.4251 11.5529 11.5529 11.5780 11.5780 12.0623 12.0623 12.2377 12.2377 12.2680 12.2680 12.7151 12.7151 13.3000 13.3000 13.8723 13.8723 13.9275 13.9275 14.0322 14.0322 14.5848 14.5848 14.9526 14.9526 15.1354 15.1354 15.9990 15.9990 16.1026 16.1026 16.1268 16.1268 18.1297 18.1297 18.6131 18.6131 18.7124 18.7124 k = 0.4828 0.4828-0.0000 ( 2050 PWs) bands (ev): 10.4285 10.4285 10.5316 10.5316 11.3504 11.3504 11.4276 11.4276 11.5488 11.5488 11.5784 11.5784 12.0426 12.0426 12.2403 12.2403 12.2747 12.2747 12.7144 12.7144 13.3069 13.3069 13.8738 13.8738 13.9103 13.9103 14.0534 14.0534 14.5958 14.5958 14.9606 14.9606 15.1316 15.1316 16.0017 16.0017 16.1057 16.1057 16.1319 16.1319 18.1013 18.1013 18.5387 18.5387 18.7138 18.7138 k = 0.4741 0.4741-0.0000 ( 2056 PWs) bands (ev): 10.4101 10.4101 10.5313 10.5313 11.3459 11.3459 11.4311 11.4311 11.5404 11.5404 11.5806 11.5806 12.0159 12.0159 12.2356 12.2356 12.2885 12.2885 12.7141 12.7141 13.3185 13.3185 13.8672 13.8672 13.8991 13.8991 14.0804 14.0804 14.6141 14.6141 14.9725 14.9725 15.1266 15.1266 16.0059 16.0059 16.1103 16.1103 16.1409 16.1409 18.0525 18.0525 18.4822 18.4822 18.7156 18.7156 k = 0.4655 0.4655-0.0000 ( 2062 PWs) bands (ev): 10.3781 10.3781 10.5383 10.5383 11.3392 11.3392 11.4351 11.4351 11.5275 11.5275 11.5852 11.5852 11.9857 11.9857 12.2258 12.2258 12.3028 12.3028 12.7154 12.7154 13.3347 13.3347 13.8455 13.8455 13.9036 13.9036 14.1109 14.1109 14.6390 14.6390 14.9856 14.9856 15.1229 15.1229 16.0116 16.0116 16.1160 16.1160 16.1539 16.1539 17.9850 17.9850 18.4443 18.4443 18.7179 18.7179 k = 0.4569 0.4569-0.0000 ( 2060 PWs) bands (ev): 10.3334 10.3334 10.5527 10.5527 11.3301 11.3301 11.4385 11.4385 11.5106 11.5106 11.5917 11.5917 11.9544 11.9544 12.2133 12.2133 12.3125 12.3125 12.7202 12.7202 13.3555 13.3555 13.8182 13.8182 13.9150 13.9150 14.1442 14.1442 14.6703 14.6703 14.9953 14.9953 15.1250 15.1250 16.0188 16.0188 16.1227 16.1227 16.1710 16.1710 17.9037 17.9037 18.4211 18.4211 18.7209 18.7209 k = 0.4483 0.4483-0.0000 ( 2060 PWs) bands (ev): 10.2780 10.2780 10.5730 10.5730 11.3181 11.3181 11.4406 11.4406 11.4904 11.4904 11.5999 11.5999 11.9231 11.9231 12.1996 12.1996 12.3145 12.3145 12.7301 12.7301 13.3803 13.3803 13.7895 13.7895 13.9300 13.9300 14.1803 14.1803 14.7070 14.7070 14.9965 14.9965 15.1377 15.1377 16.0272 16.0272 16.1303 16.1303 16.1917 16.1917 17.8140 17.8140 18.4080 18.4080 18.7246 18.7246 k = 0.4397 0.4397-0.0000 ( 2060 PWs) bands (ev): 10.2141 10.2141 10.5982 10.5982 11.3029 11.3029 11.4396 11.4396 11.4681 11.4681 11.6095 11.6095 11.8928 11.8928 12.1857 12.1857 12.3071 12.3071 12.7463 12.7463 13.4087 13.4087 13.7605 13.7605 13.9477 13.9477 14.2189 14.2189 14.7484 14.7484 14.9883 14.9883 15.1620 15.1620 16.0367 16.0367 16.1391 16.1391 16.2154 16.2154 17.7197 17.7197 18.4015 18.4015 18.7288 18.7288 k = 0.4310 0.4310-0.0000 ( 2062 PWs) bands (ev): 10.1430 10.1430 10.6273 10.6273 11.2841 11.2841 11.4301 11.4301 11.4492 11.4492 11.6202 11.6202 11.8640 11.8640 12.1726 12.1726 12.2906 12.2906 12.7691 12.7691 13.4396 13.4396 13.7324 13.7324 13.9678 13.9678 14.2600 14.2600 14.7930 14.7930 14.9741 14.9741 15.1954 15.1954 16.0474 16.0474 16.1491 16.1491 16.2418 16.2418 17.6236 17.6236 18.3993 18.3993 18.7336 18.7336 k = 0.4224 0.4224-0.0000 ( 2065 PWs) bands (ev): 10.0660 10.0660 10.6595 10.6595 11.2615 11.2615 11.4057 11.4057 11.4398 11.4398 11.6315 11.6315 11.8372 11.8372 12.1612 12.1612 12.2659 12.2659 12.7975 12.7975 13.4721 13.4721 13.7065 13.7065 13.9901 13.9901 14.3035 14.3035 14.8375 14.8375 14.9592 14.9592 15.2347 15.2347 16.0589 16.0589 16.1604 16.1604 16.2703 16.2703 17.5271 17.5271 18.4002 18.4002 18.7391 18.7391 k = 0.4138 0.4138-0.0000 ( 2065 PWs) bands (ev): 9.9839 9.9839 10.6941 10.6941 11.2347 11.2347 11.3757 11.3757 11.4311 11.4311 11.6432 11.6432 11.8127 11.8127 12.1522 12.1522 12.2351 12.2351 12.8304 12.8304 13.5040 13.5040 13.6848 13.6848 14.0144 14.0144 14.3492 14.3492 14.8709 14.8709 14.9562 14.9562 15.2780 15.2780 16.0716 16.0716 16.1730 16.1730 16.3006 16.3006 17.4316 17.4316 18.4034 18.4034 18.7451 18.7451 k = 0.4052 0.4052-0.0000 ( 2065 PWs) bands (ev): 9.8976 9.8976 10.7302 10.7302 11.2037 11.2037 11.3435 11.3435 11.4198 11.4198 11.6545 11.6545 11.7908 11.7908 12.1462 12.1462 12.2001 12.2001 12.8665 12.8665 13.5313 13.5313 13.6714 13.6714 14.0407 14.0407 14.3966 14.3966 14.8730 14.8730 14.9859 14.9859 15.3241 15.3241 16.0852 16.0852 16.1869 16.1869 16.3323 16.3323 17.3375 17.3375 18.4082 18.4082 18.7516 18.7516 k = 0.3966 0.3966-0.0000 ( 2055 PWs) bands (ev): 9.8077 9.8077 10.7665 10.7665 11.1684 11.1684 11.3101 11.3101 11.4055 11.4055 11.6647 11.6647 11.7718 11.7718 12.1430 12.1430 12.1637 12.1637 12.9047 12.9047 13.5476 13.5476 13.6731 13.6731 14.0688 14.0688 14.4453 14.4453 14.8562 14.8562 15.0366 15.0366 15.3723 15.3723 16.0999 16.0999 16.2023 16.2023 16.3651 16.3651 17.2456 17.2456 18.4145 18.4145 18.7586 18.7586 k = 0.3879 0.3879-0.0000 ( 2057 PWs) bands (ev): 9.7148 9.7148 10.8017 10.8017 11.1291 11.1291 11.2761 11.2761 11.3882 11.3882 11.6728 11.6728 11.7558 11.7558 12.1241 12.1241 12.1467 12.1467 12.9439 12.9439 13.5501 13.5501 13.6929 13.6929 14.0985 14.0985 14.4945 14.4945 14.8354 14.8354 15.0941 15.0941 15.4220 15.4220 16.1154 16.1154 16.2190 16.2190 16.3987 16.3987 17.1562 17.1562 18.4220 18.4220 18.7661 18.7661 k = 0.3793 0.3793-0.0000 ( 2051 PWs) bands (ev): 9.6195 9.6195 10.8342 10.8342 11.0860 11.0860 11.2420 11.2420 11.3681 11.3681 11.6782 11.6782 11.7423 11.7423 12.0908 12.0908 12.1510 12.1510 12.9831 12.9831 13.5454 13.5454 13.7251 13.7251 14.1297 14.1297 14.5425 14.5425 14.8160 14.8160 15.1544 15.1544 15.4728 15.4728 16.1318 16.1318 16.2372 16.2372 16.4329 16.4329 17.0697 17.0697 18.4305 18.4305 18.7741 18.7741 k = 0.3707 0.3707-0.0000 ( 2051 PWs) bands (ev): 9.5221 9.5221 10.8622 10.8622 11.0396 11.0396 11.2079 11.2079 11.3453 11.3453 11.6803 11.6803 11.7298 11.7298 12.0634 12.0634 12.1596 12.1596 13.0215 13.0215 13.5405 13.5405 13.7632 13.7632 14.1624 14.1624 14.5862 14.5862 14.8026 14.8026 15.2159 15.2159 15.5243 15.5243 16.1489 16.1489 16.2567 16.2567 16.4674 16.4674 16.9865 16.9865 18.4400 18.4400 18.7824 18.7824 k = 0.3621 0.3621-0.0000 ( 2051 PWs) bands (ev): 9.4232 9.4232 10.8834 10.8834 10.9909 10.9909 11.1741 11.1741 11.3201 11.3201 11.6791 11.6791 11.7157 11.7157 12.0466 12.0466 12.1719 12.1719 13.0580 13.0580 13.5393 13.5393 13.8040 13.8040 14.1963 14.1963 14.6193 14.6193 14.8019 14.8019 15.2780 15.2780 15.5764 15.5764 16.1668 16.1668 16.2776 16.2776 16.5019 16.5019 16.9072 16.9072 18.4503 18.4503 18.7911 18.7911 k = 0.3534 0.3534-0.0000 ( 2055 PWs) bands (ev): 9.3231 9.3231 10.8935 10.8935 10.9431 10.9431 11.1409 11.1409 11.2925 11.2925 11.6709 11.6709 11.7007 11.7007 12.0444 12.0444 12.1875 12.1875 13.0920 13.0920 13.5441 13.5441 13.8460 13.8460 14.2314 14.2314 14.6349 14.6349 14.8214 14.8214 15.3398 15.3398 15.6288 15.6288 16.1855 16.1855 16.2998 16.2998 16.5361 16.5361 16.8321 16.8321 18.4613 18.4613 18.8001 18.8001 k = 0.3448 0.3448-0.0000 ( 2055 PWs) bands (ev): 9.2221 9.2221 10.8710 10.8710 10.9175 10.9175 11.1082 11.1082 11.2628 11.2628 11.6476 11.6476 11.6915 11.6915 12.0591 12.0591 12.2065 12.2065 13.1227 13.1227 13.5562 13.5562 13.8884 13.8884 14.2676 14.2676 14.6344 14.6344 14.8602 14.8602 15.4007 15.4007 15.6813 15.6813 16.2050 16.2050 16.3235 16.3235 16.5692 16.5692 16.7624 16.7624 18.4730 18.4730 18.8094 18.8094 k = 0.3362 0.3362-0.0000 ( 2051 PWs) bands (ev): 9.1206 9.1206 10.8194 10.8194 10.9107 10.9107 11.0762 11.0762 11.2312 11.2312 11.6114 11.6114 11.6852 11.6852 12.0911 12.0911 12.2286 12.2286 13.1502 13.1502 13.5763 13.5763 13.9304 13.9304 14.3047 14.3047 14.6259 14.6259 14.9108 14.9108 15.4602 15.4602 15.7339 15.7339 16.2253 16.2253 16.3484 16.3484 16.5984 16.5984 16.7014 16.7014 18.4853 18.4853 18.8189 18.8189 k = 0.3276 0.3276-0.0000 ( 2051 PWs) bands (ev): 9.0188 9.0188 10.7627 10.7627 10.8999 10.8999 11.0446 11.0446 11.1978 11.1978 11.5678 11.5678 11.6767 11.6767 12.1391 12.1391 12.2538 12.2538 13.1745 13.1745 13.6040 13.6040 13.9713 13.9713 14.3427 14.3427 14.6157 14.6157 14.9677 14.9677 15.5173 15.5173 15.7865 15.7865 16.2462 16.2462 16.3744 16.3744 16.6031 16.6031 16.6700 16.6700 18.4981 18.4981 18.8286 18.8286 k = 0.3190 0.3190-0.0000 ( 2047 PWs) bands (ev): 8.9170 8.9170 10.7040 10.7040 10.8833 10.8833 11.0133 11.0133 11.1630 11.1630 11.5199 11.5199 11.6638 11.6638 12.2011 12.2011 12.2824 12.2824 13.1963 13.1963 13.6388 13.6388 14.0106 14.0106 14.3815 14.3815 14.6074 14.6074 15.0279 15.0279 15.5713 15.5713 15.8391 15.8391 16.2679 16.2679 16.4015 16.4015 16.5640 16.5640 16.6884 16.6884 18.5114 18.5114 18.8384 18.8384 k = 0.3103 0.3103-0.0000 ( 2047 PWs) bands (ev): 8.8154 8.8154 10.6443 10.6443 10.8617 10.8617 10.9819 10.9819 11.1268 11.1268 11.4692 11.4692 11.6454 11.6454 12.2728 12.2728 12.3168 12.3168 13.2163 13.2163 13.6795 13.6795 14.0472 14.0472 14.4210 14.4210 14.6035 14.6035 15.0903 15.0903 15.6211 15.6211 15.8916 15.8916 16.2901 16.2901 16.4287 16.4287 16.5203 16.5203 16.7187 16.7187 18.5250 18.5250 18.8482 18.8482 k = 0.3017 0.3017-0.0000 ( 2043 PWs) bands (ev): 8.7144 8.7144 10.5840 10.5840 10.8366 10.8366 10.9503 10.9503 11.0896 11.0896 11.4169 11.4169 11.6212 11.6212 12.3324 12.3324 12.3768 12.3768 13.2350 13.2350 13.7251 13.7251 14.0804 14.0804 14.4613 14.4613 14.6059 14.6059 15.1541 15.1541 15.6656 15.6656 15.9439 15.9439 16.3128 16.3128 16.4511 16.4511 16.4887 16.4887 16.7509 16.7509 18.5389 18.5389 18.8579 18.8579 k = 0.2931 0.2931-0.0000 ( 2047 PWs) bands (ev): 8.6140 8.6140 10.5233 10.5233 10.8088 10.8088 10.9182 10.9182 11.0516 11.0516 11.3637 11.3637 11.5914 11.5914 12.3715 12.3715 12.4691 12.4691 13.2529 13.2529 13.7740 13.7740 14.1096 14.1096 14.5025 14.5025 14.6162 14.6162 15.2187 15.2187 15.7037 15.7037 15.9959 15.9959 16.3350 16.3350 16.4421 16.4421 16.4984 16.4984 16.7832 16.7832 18.5529 18.5529 18.8676 18.8676 k = 0.2845 0.2845-0.0000 ( 2043 PWs) bands (ev): 8.5145 8.5145 10.4625 10.4625 10.7794 10.7794 10.8857 10.8857 11.0131 11.0131 11.3102 11.3102 11.5564 11.5564 12.4087 12.4087 12.5736 12.5736 13.2701 13.2701 13.8249 13.8249 14.1347 14.1347 14.5446 14.5446 14.6353 14.6353 15.2839 15.2839 15.7344 15.7344 16.0473 16.0473 16.3551 16.3551 16.4275 16.4275 16.5275 16.5275 16.8153 16.8153 18.5671 18.5671 18.8771 18.8771 k = 0.2759 0.2759-0.0000 ( 2055 PWs) bands (ev): 8.4161 8.4161 10.4017 10.4017 10.7488 10.7488 10.8527 10.8527 10.9741 10.9741 11.2568 11.2568 11.5166 11.5166 12.4466 12.4466 12.6863 12.6863 13.2865 13.2865 13.8759 13.8759 14.1572 14.1572 14.5874 14.5874 14.6638 14.6638 15.3494 15.3494 15.7569 15.7569 16.0975 16.0975 16.3695 16.3695 16.4282 16.4282 16.5593 16.5593 16.8469 16.8469 18.5811 18.5811 18.8863 18.8863 k = 0.2672 0.2672-0.0000 ( 2055 PWs) bands (ev): 8.3191 8.3191 10.3413 10.3413 10.7177 10.7177 10.8196 10.8196 10.9349 10.9349 11.2038 11.2038 11.4726 11.4726 12.4855 12.4855 12.8058 12.8058 13.3018 13.3018 13.9241 13.9241 14.1801 14.1801 14.6304 14.6304 14.7018 14.7018 15.4149 15.4149 15.7714 15.7714 16.1458 16.1458 16.3796 16.3796 16.4452 16.4452 16.5925 16.5925 16.8779 16.8779 18.5950 18.5950 18.8951 18.8951 k = 0.2586 0.2586-0.0000 ( 2055 PWs) bands (ev): 8.2234 8.2234 10.2814 10.2814 10.6862 10.6862 10.7863 10.7863 10.8957 10.8957 11.1514 11.1514 11.4251 11.4251 12.5251 12.5251 12.9311 12.9311 13.3159 13.3159 13.9655 13.9655 14.2082 14.2082 14.6729 14.6729 14.7490 14.7490 15.4802 15.4802 15.7788 15.7788 16.1915 16.1915 16.3927 16.3927 16.4713 16.4713 16.6266 16.6266 16.9083 16.9083 18.6087 18.6087 18.9035 18.9035 k = 0.2500 0.2500-0.0000 ( 2063 PWs) bands (ev): 8.1294 8.1294 10.2222 10.2222 10.6548 10.6548 10.7531 10.7531 10.8565 10.8565 11.0999 11.0999 11.3747 11.3747 12.5654 12.5654 13.0616 13.0616 13.3284 13.3284 13.9962 13.9962 14.2466 14.2466 14.7145 14.7145 14.8044 14.8044 15.5449 15.5449 15.7805 15.7805 16.2337 16.2337 16.4124 16.4124 16.5022 16.5022 16.6614 16.6614 16.9380 16.9380 18.6218 18.6218 18.9113 18.9113 k = 0.2414 0.2414-0.0000 ( 2055 PWs) bands (ev): 8.0372 8.0372 10.1637 10.1637 10.6235 10.6235 10.7202 10.7202 10.8176 10.8176 11.0494 11.0494 11.3220 11.3220 12.6061 12.6061 13.1964 13.1964 13.3391 13.3391 14.0151 14.0151 14.2975 14.2975 14.7554 14.7554 14.8664 14.8664 15.6085 15.6085 15.7792 15.7792 16.2724 16.2724 16.4385 16.4385 16.5368 16.5368 16.6968 16.6968 16.9671 16.9671 18.6344 18.6344 18.9185 18.9185 k = 0.2328 0.2328-0.0000 ( 2055 PWs) bands (ev): 7.9469 7.9469 10.1062 10.1062 10.5924 10.5924 10.6875 10.6875 10.7789 10.7789 11.0001 11.0001 11.2674 11.2674 12.6469 12.6469 13.3347 13.3347 13.3478 13.3478 14.0246 14.0246 14.3596 14.3596 14.7961 14.7961 14.9333 14.9333 15.6691 15.6691 15.7783 15.7783 16.3076 16.3076 16.4690 16.4690 16.5746 16.5746 16.7327 16.7327 16.9954 16.9954 18.6463 18.6463 18.9249 18.9249 k = 0.2241 0.2241-0.0000 ( 2055 PWs) bands (ev): 7.8587 7.8587 10.0498 10.0498 10.5618 10.5618 10.6553 10.6553 10.7405 10.7405 10.9522 10.9522 11.2117 11.2117 12.6876 12.6876 13.3545 13.3545 13.4756 13.4756 14.0283 14.0283 14.4302 14.4302 14.8365 14.8365 15.0037 15.0037 15.7195 15.7195 15.7869 15.7869 16.3402 16.3402 16.5020 16.5020 16.6154 16.6154 16.7690 16.7690 17.0229 17.0229 18.6571 18.6571 18.9304 18.9304 k = 0.2155 0.2155-0.0000 ( 2047 PWs) bands (ev): 7.7727 7.7727 9.9946 9.9946 10.5317 10.5317 10.6237 10.6237 10.7026 10.7026 10.9057 10.9057 11.1553 11.1553 12.7281 12.7281 13.3591 13.3591 13.6171 13.6171 14.0305 14.0305 14.5071 14.5071 14.8767 14.8767 15.0761 15.0761 15.7427 15.7427 15.8238 15.8238 16.3707 16.3707 16.5358 16.5358 16.6591 16.6591 16.8056 16.8056 17.0496 17.0496 18.6669 18.6669 18.9348 18.9348 k = 0.2069 0.2069-0.0000 ( 2037 PWs) bands (ev): 7.6890 7.6890 9.9407 9.9407 10.5022 10.5022 10.5927 10.5927 10.6652 10.6652 10.8609 10.8609 11.0986 11.0986 12.7681 12.7681 13.3616 13.3616 13.7541 13.7541 14.0375 14.0375 14.5886 14.5886 14.9167 14.9167 15.1489 15.1489 15.7505 15.7505 15.8790 15.8790 16.3997 16.3997 16.5694 16.5694 16.7048 16.7048 16.8424 16.8424 17.0756 17.0756 18.6753 18.6753 18.9381 18.9381 k = 0.1983 0.1983-0.0000 ( 2039 PWs) bands (ev): 7.6078 7.6078 9.8882 9.8882 10.4733 10.4733 10.5625 10.5625 10.6284 10.6284 10.8177 10.8177 11.0420 11.0420 12.8074 12.8074 13.3623 13.3623 13.8692 13.8692 14.0672 14.0672 14.6736 14.6736 14.9565 14.9565 15.2200 15.2200 15.7593 15.7593 15.9380 15.9380 16.4273 16.4273 16.6023 16.6023 16.7519 16.7519 16.8792 16.8792 17.1007 17.1007 18.6821 18.6821 18.9401 18.9401 k = 0.1897 0.1897-0.0000 ( 2045 PWs) bands (ev): 7.5291 7.5291 9.8373 9.8373 10.4452 10.4452 10.5329 10.5329 10.5921 10.5921 10.7763 10.7763 10.9861 10.9861 12.8457 12.8457 13.3611 13.3611 13.9279 13.9279 14.1546 14.1546 14.7609 14.7609 14.9965 14.9965 15.2872 15.2872 15.7751 15.7751 15.9974 15.9974 16.4539 16.4539 16.6344 16.6344 16.7997 16.7997 16.9159 16.9159 17.1251 17.1251 18.6871 18.6871 18.9406 18.9406 k = 0.1810 0.1810-0.0000 ( 2037 PWs) bands (ev): 7.4532 7.4532 9.7880 9.7880 10.4179 10.4179 10.5043 10.5043 10.5565 10.5565 10.7368 10.7368 10.9311 10.9311 12.8830 12.8830 13.3585 13.3585 13.9422 13.9422 14.2876 14.2876 14.8494 14.8494 15.0371 15.0371 15.3476 15.3476 15.8014 15.8014 16.0562 16.0563 16.4796 16.4796 16.6658 16.6658 16.8477 16.8477 16.9526 16.9526 17.1486 17.1486 18.6901 18.6901 18.9395 18.9395 k = 0.1724 0.1724-0.0000 ( 2037 PWs) bands (ev): 7.3801 7.3801 9.7404 9.7404 10.3915 10.3915 10.4764 10.4764 10.5217 10.5217 10.6991 10.6991 10.8774 10.8774 12.9189 12.9189 13.3544 13.3544 13.9420 13.9420 14.4362 14.4362 14.9367 14.9367 15.0798 15.0798 15.3994 15.3994 15.8405 15.8405 16.1143 16.1143 16.5045 16.5045 16.6963 16.6963 16.8955 16.8955 16.9890 16.9890 17.1712 17.1712 18.6907 18.6907 18.9366 18.9366 k = 0.1638 0.1638-0.0000 ( 2037 PWs) bands (ev): 7.3098 7.3098 9.6945 9.6945 10.3660 10.3660 10.4495 10.4495 10.4877 10.4877 10.6634 10.6634 10.8253 10.8253 12.9533 12.9533 13.3492 13.3492 13.9371 13.9371 14.5898 14.5898 15.0181 15.0181 15.1281 15.1281 15.4424 15.4424 15.8927 15.8927 16.1715 16.1715 16.5285 16.5285 16.7260 16.7260 16.9427 16.9427 17.0252 17.0252 17.1931 17.1931 18.6888 18.6888 18.9317 18.9317 k = 0.1552 0.1552-0.0000 ( 2035 PWs) bands (ev): 7.2426 7.2426 9.6506 9.6506 10.3415 10.3415 10.4234 10.4234 10.4546 10.4546 10.6296 10.6296 10.7751 10.7751 12.9861 12.9861 13.3430 13.3430 13.9306 13.9306 14.7449 14.7449 15.0855 15.0855 15.1887 15.1887 15.4797 15.4797 15.9563 15.9563 16.2280 16.2280 16.5518 16.5518 16.7550 16.7550 16.9890 16.9890 17.0610 17.0610 17.2142 17.2142 18.6840 18.6840 18.9246 18.9246 k = 0.1466 0.1466-0.0000 ( 2041 PWs) bands (ev): 7.1785 7.1785 9.6086 9.6086 10.3180 10.3180 10.3983 10.3983 10.4224 10.4224 10.5978 10.5978 10.7270 10.7270 13.0171 13.0171 13.3361 13.3361 13.9235 13.9235 14.8989 14.8989 15.1362 15.1362 15.2615 15.2615 15.5166 15.5166 16.0277 16.0277 16.2842 16.2842 16.5744 16.5744 16.7832 16.7832 17.0341 17.0341 17.0963 17.0963 17.2346 17.2346 18.6761 18.6761 18.9151 18.9151 k = 0.1379 0.1379-0.0000 ( 2041 PWs) bands (ev): 7.1176 7.1176 9.5687 9.5687 10.2956 10.2956 10.3741 10.3741 10.3913 10.3913 10.5679 10.5679 10.6813 10.6813 13.0462 13.0462 13.3287 13.3287 13.9166 13.9166 15.0477 15.0477 15.1776 15.1776 15.3365 15.3365 15.5611 15.5611 16.1033 16.1033 16.3409 16.3409 16.5963 16.5963 16.8108 16.8108 17.0780 17.0780 17.1313 17.1313 17.2541 17.2541 18.6648 18.6648 18.9029 18.9029 k = 0.1293 0.1293-0.0000 ( 2035 PWs) bands (ev): 7.0599 7.0599 9.5308 9.5308 10.2744 10.2744 10.3508 10.3508 10.3614 10.3614 10.5399 10.5399 10.6382 10.6382 13.0733 13.0733 13.3209 13.3209 13.9100 13.9100 15.1774 15.1774 15.2212 15.2212 15.4085 15.4085 15.6214 15.6214 16.1790 16.1790 16.3991 16.3991 16.6179 16.6179 16.8377 16.8377 17.1203 17.1203 17.1660 17.1660 17.2730 17.2730 18.6498 18.6498 18.8879 18.8879 k = 0.1207 0.1207-0.0000 ( 2035 PWs) bands (ev): 7.0056 7.0056 9.4951 9.4951 10.2543 10.2543 10.3284 10.3284 10.3329 10.3329 10.5139 10.5139 10.5979 10.5979 13.0982 13.0982 13.3130 13.3130 13.9040 13.9040 15.2351 15.2351 15.3037 15.3037 15.4915 15.4915 15.6997 15.6997 16.2509 16.2509 16.4603 16.4603 16.6393 16.6393 16.8642 16.8642 17.1609 17.1609 17.2005 17.2005 17.2913 17.2913 18.6309 18.6309 18.8695 18.8695 k = 0.1121 0.1121-0.0000 ( 2033 PWs) bands (ev): 6.9547 6.9547 9.4616 9.4616 10.2355 10.2355 10.3046 10.3046 10.3080 10.3080 10.4898 10.4898 10.5605 10.5605 13.1209 13.1209 13.3050 13.3050 13.8988 13.8988 15.2665 15.2665 15.3640 15.3640 15.6050 15.6050 15.7917 15.7917 16.3160 16.3160 16.5247 16.5247 16.6615 16.6615 16.8904 16.8904 17.1995 17.1995 17.2352 17.2352 17.3091 17.3091 18.6080 18.6080 18.8475 18.8475 k = 0.1034 0.1034-0.0000 ( 2037 PWs) bands (ev): 6.9074 6.9074 9.4303 9.4303 10.2178 10.2178 10.2789 10.2789 10.2875 10.2875 10.4675 10.4675 10.5261 10.5261 13.1415 13.1415 13.2971 13.2971 13.8943 13.8943 15.2939 15.2939 15.3949 15.3949 15.7380 15.7380 15.8918 15.8918 16.3728 16.3728 16.5899 16.5899 16.6872 16.6872 16.9163 16.9163 17.2357 17.2357 17.2703 17.2703 17.3267 17.3267 18.5807 18.5807 18.8214 18.8214 k = 0.0948 0.0948-0.0000 ( 2037 PWs) bands (ev): 6.8635 6.8635 9.4014 9.4014 10.2015 10.2015 10.2545 10.2545 10.2685 10.2685 10.4471 10.4471 10.4948 10.4948 13.1599 13.1599 13.2894 13.2894 13.8907 13.8907 15.3189 15.3189 15.4124 15.4124 15.8755 15.8755 15.9965 15.9965 16.4215 16.4215 16.6455 16.6455 16.7250 16.7250 16.9425 16.9425 17.2695 17.2695 17.3056 17.3056 17.3447 17.3447 18.5490 18.5490 18.7906 18.7906 k = 0.0862 0.0862-0.0000 ( 2041 PWs) bands (ev): 6.8233 6.8233 9.3748 9.3748 10.1865 10.1865 10.2316 10.2316 10.2506 10.2506 10.4285 10.4285 10.4667 10.4667 13.1761 13.1761 13.2821 13.2821 13.8879 13.8879 15.3417 15.3417 15.4235 15.4235 16.0099 16.0099 16.1037 16.1037 16.4635 16.4635 16.6806 16.6806 16.7834 16.7834 16.9694 16.9694 17.3012 17.3012 17.3395 17.3395 17.3652 17.3652 18.5129 18.5129 18.7542 18.7542 k = 0.0776 0.0776-0.0000 ( 2045 PWs) bands (ev): 6.7868 6.7868 9.3506 9.3506 10.1728 10.1728 10.2103 10.2103 10.2340 10.2340 10.4117 10.4117 10.4416 10.4416 13.1902 13.1902 13.2752 13.2752 13.8858 13.8858 15.3624 15.3624 15.4312 15.4312 16.1367 16.1367 16.2120 16.2120 16.5006 16.5006 16.7026 16.7026 16.8523 16.8523 16.9975 16.9975 17.3310 17.3310 17.3670 17.3670 17.3937 17.3937 18.4722 18.4722 18.7111 18.7111 k = 0.0690 0.0690-0.0000 ( 2045 PWs) bands (ev): 6.7539 6.7539 9.3288 9.3288 10.1606 10.1606 10.1909 10.1909 10.2189 10.2189 10.3967 10.3967 10.4195 10.4195 13.2024 13.2024 13.2688 13.2688 13.8844 13.8844 15.3810 15.3810 15.4368 15.4368 16.2519 16.2519 16.3200 16.3200 16.5344 16.5344 16.7194 16.7194 16.9213 16.9213 17.0277 17.0277 17.3591 17.3591 17.3894 17.3894 17.4299 17.4299 18.4274 18.4274 18.6599 18.6599 k = 0.0603 0.0603-0.0000 ( 2049 PWs) bands (ev): 6.7249 6.7249 9.3096 9.3096 10.1497 10.1497 10.1734 10.1734 10.2052 10.2052 10.3835 10.3835 10.4004 10.4004 13.2127 13.2127 13.2630 13.2630 13.8836 13.8836 15.3975 15.3975 15.4410 15.4410 16.3526 16.3526 16.4242 16.4242 16.5675 16.5675 16.7334 16.7334 16.9860 16.9860 17.0609 17.0609 17.3848 17.3848 17.4134 17.4134 17.4692 17.4692 18.3785 18.3785 18.5989 18.5989 k = 0.0517 0.0517-0.0000 ( 2061 PWs) bands (ev): 6.6996 6.6996 9.2928 9.2928 10.1402 10.1402 10.1580 10.1580 10.1931 10.1931 10.3721 10.3721 10.3841 10.3841 13.2213 13.2213 13.2579 13.2579 13.8831 13.8831 15.4119 15.4119 15.4443 15.4443 16.4352 16.4352 16.5198 16.5198 16.6036 16.6036 16.7453 16.7453 17.0445 17.0445 17.0972 17.0972 17.4082 17.4082 17.4425 17.4425 17.5096 17.5096 18.3263 18.3263 18.5268 18.5268 k = 0.0431 0.0431-0.0000 ( 2063 PWs) bands (ev): 6.6781 6.6781 9.2786 9.2786 10.1321 10.1321 10.1447 10.1447 10.1828 10.1828 10.3625 10.3625 10.3705 10.3705 13.2282 13.2282 13.2534 13.2534 13.8831 13.8831 15.4241 15.4241 15.4468 15.4468 16.4953 16.4953 16.6026 16.6026 16.6464 16.6464 16.7554 16.7554 17.0966 17.0966 17.1348 17.1348 17.4317 17.4317 17.4775 17.4775 17.5499 17.5499 18.2717 18.2717 18.4437 18.4437 k = 0.0345 0.0345-0.0000 ( 2063 PWs) bands (ev): 6.6606 6.6606 9.2669 9.2669 10.1255 10.1255 10.1337 10.1337 10.1742 10.1742 10.3546 10.3546 10.3596 10.3596 13.2338 13.2338 13.2497 13.2497 13.8832 13.8832 15.4341 15.4341 15.4488 15.4488 16.5335 16.5335 16.6700 16.6700 16.6941 16.6941 16.7639 16.7639 17.1431 17.1431 17.1699 17.1699 17.4575 17.4575 17.5186 17.5186 17.5887 17.5887 18.2164 18.2164 18.3523 18.3523 k = 0.0259 0.0259-0.0000 ( 2063 PWs) bands (ev): 6.6469 6.6469 9.2578 9.2578 10.1203 10.1203 10.1250 10.1250 10.1674 10.1674 10.3484 10.3484 10.3512 10.3512 13.2379 13.2379 13.2468 13.2468 13.8835 13.8835 15.4420 15.4420 15.4502 15.4502 16.5564 16.5564 16.7198 16.7198 16.7392 16.7392 16.7712 16.7712 17.1827 17.1827 17.1989 17.1989 17.4861 17.4861 17.5659 17.5659 17.6241 17.6241 18.1632 18.1632 18.2579 18.2579 k = 0.0172 0.0172-0.0000 ( 2063 PWs) bands (ev): 6.6371 6.6371 9.2513 9.2513 10.1167 10.1167 10.1188 10.1188 10.1626 10.1626 10.3441 10.3441 10.3453 10.3453 13.2408 13.2408 13.2447 13.2447 13.8837 13.8837 15.4476 15.4476 15.4513 15.4513 16.5701 16.5701 16.7524 16.7524 16.7692 16.7692 16.7833 16.7833 17.2126 17.2126 17.2200 17.2200 17.5146 17.5146 17.6168 17.6168 17.6537 17.6537 18.1165 18.1165 18.1688 18.1688 k = 0.0086 0.0086-0.0000 ( 2091 PWs) bands (ev): 6.6312 6.6312 9.2473 9.2473 10.1144 10.1144 10.1149 10.1149 10.1596 10.1596 10.3414 10.3414 10.3417 10.3417 13.2424 13.2424 13.2434 13.2434 13.8838 13.8838 15.4509 15.4509 15.4518 15.4518 16.5774 16.5774 16.7706 16.7706 16.7752 16.7752 16.8037 16.8037 17.2306 17.2306 17.2325 17.2325 17.5363 17.5363 17.6620 17.6620 17.6743 17.6743 18.0830 18.0830 18.0989 18.0989 k = 0.0000 0.0000 0.0000 ( 2103 PWs) bands (ev): 6.6292 6.6292 9.2460 9.2460 10.1136 10.1136 10.1136 10.1136 10.1586 10.1586 10.3405 10.3405 10.3405 10.3405 13.2430 13.2430 13.2430 13.2430 13.8838 13.8838 15.4520 15.4520 15.4520 15.4520 16.5797 16.5797 16.7764 16.7764 16.7764 16.7764 16.8115 16.8115 17.2366 17.2366 17.2366 17.2366 17.5446 17.5446 17.6819 17.6819 17.6819 17.6819 18.0706 18.0706 18.0706 18.0706 k = 0.0000 0.0000 0.0000 ( 2103 PWs) bands (ev): 6.6292 6.6292 9.2460 9.2460 10.1136 10.1136 10.1136 10.1136 10.1586 10.1586 10.3405 10.3405 10.3405 10.3405 13.2430 13.2430 13.2430 13.2430 13.8838 13.8838 15.4520 15.4520 15.4520 15.4520 16.5797 16.5797 16.7764 16.7764 16.7764 16.7764 16.8115 16.8115 17.2366 17.2366 17.2366 17.2366 17.5446 17.5446 17.6819 17.6819 17.6819 17.6819 18.0706 18.0706 18.0706 18.0706 k = 0.0070 0.0070 0.0070 ( 2085 PWs) bands (ev): 6.6312 6.6312 9.2473 9.2473 10.1144 10.1144 10.1150 10.1150 10.1596 10.1596 10.3414 10.3414 10.3417 10.3417 13.2424 13.2424 13.2435 13.2435 13.8838 13.8838 15.4511 15.4511 15.4516 15.4516 16.5774 16.5774 16.7705 16.7705 16.7753 16.7753 16.8037 16.8037 17.2313 17.2313 17.2319 17.2319 17.5364 17.5364 17.6610 17.6610 17.6752 17.6752 18.0847 18.0847 18.0974 18.0974 k = 0.0141 0.0141 0.0141 ( 2073 PWs) bands (ev): 6.6371 6.6371 9.2512 9.2512 10.1166 10.1166 10.1188 10.1188 10.1625 10.1625 10.3441 10.3441 10.3453 10.3453 13.2407 13.2407 13.2448 13.2448 13.8837 13.8837 15.4486 15.4486 15.4502 15.4502 16.5701 16.5701 16.7520 16.7520 16.7701 16.7701 16.7827 16.7827 17.2148 17.2148 17.2175 17.2175 17.5148 17.5148 17.6127 17.6127 17.6559 17.6559 18.1238 18.1238 18.1639 18.1639 k = 0.0211 0.0211 0.0211 ( 2073 PWs) bands (ev): 6.6469 6.6469 9.2578 9.2578 10.1202 10.1202 10.1251 10.1251 10.1674 10.1674 10.3484 10.3484 10.3512 10.3512 13.2376 13.2376 13.2471 13.2471 13.8835 13.8835 15.4443 15.4443 15.4479 15.4479 16.5564 16.5564 16.7197 16.7197 16.7404 16.7404 16.7704 16.7704 17.1873 17.1873 17.1933 17.1933 17.4863 17.4863 17.5587 17.5587 17.6264 17.6264 18.1806 18.1806 18.2500 18.2500 k = 0.0282 0.0282 0.0282 ( 2073 PWs) bands (ev): 6.6606 6.6606 9.2669 9.2669 10.1253 10.1253 10.1340 10.1340 10.1741 10.1741 10.3546 10.3546 10.3596 10.3596 13.2332 13.2332 13.2502 13.2502 13.8833 13.8833 15.4382 15.4382 15.4447 15.4447 16.5336 16.5336 16.6719 16.6719 16.6938 16.6938 16.7630 16.7630 17.1493 17.1493 17.1605 17.1605 17.4558 17.4558 17.5107 17.5107 17.5899 17.5899 18.2488 18.2488 18.3443 18.3443 k = 0.0352 0.0352 0.0352 ( 2061 PWs) bands (ev): 6.6782 6.6782 9.2786 9.2786 10.1318 10.1318 10.1452 10.1452 10.1826 10.1826 10.3625 10.3625 10.3705 10.3705 13.2274 13.2274 13.2542 13.2542 13.8832 13.8832 15.4305 15.4305 15.4404 15.4404 16.4959 16.4959 16.6076 16.6076 16.6440 16.6440 16.7538 16.7538 17.1018 17.1018 17.1223 17.1223 17.4260 17.4260 17.4724 17.4724 17.5494 17.5494 18.3235 18.3235 18.4417 18.4417 k = 0.0423 0.0423 0.0423 ( 2061 PWs) bands (ev): 6.6996 6.6996 9.2929 9.2929 10.1397 10.1397 10.1589 10.1589 10.1929 10.1929 10.3723 10.3723 10.3840 10.3840 13.2199 13.2199 13.2589 13.2589 13.8834 13.8834 15.4211 15.4211 15.4351 15.4351 16.4370 16.4370 16.5269 16.5269 16.5993 16.5993 16.7419 16.7419 17.0464 17.0464 17.0821 17.0821 17.3972 17.3972 17.4430 17.4430 17.5074 17.5074 18.4016 18.4016 18.5393 18.5393 k = 0.0493 0.0493 0.0493 ( 2055 PWs) bands (ev): 6.7249 6.7249 9.3097 9.3097 10.1489 10.1489 10.1749 10.1749 10.2047 10.2047 10.3839 10.3839 10.4001 10.4001 13.2107 13.2107 13.2645 13.2645 13.8840 13.8840 15.4100 15.4100 15.4286 15.4286 16.3569 16.3569 16.4315 16.4315 16.5612 16.5612 16.7265 16.7265 16.9853 16.9853 17.0424 17.0424 17.3692 17.3692 17.4203 17.4203 17.4659 17.4659 18.4813 18.4813 18.6356 18.6356 k = 0.0563 0.0563 0.0563 ( 2049 PWs) bands (ev): 6.7540 6.7540 9.3290 9.3290 10.1595 10.1595 10.1931 10.1931 10.2181 10.2181 10.3975 10.3975 10.4190 10.4190 13.1996 13.1996 13.2708 13.2708 13.8852 13.8852 15.3973 15.3973 15.4208 15.4208 16.2614 16.2614 16.3244 16.3244 16.5256 16.5256 16.7059 16.7059 16.9215 16.9215 17.0041 17.0041 17.3416 17.3416 17.4022 17.4022 17.4262 17.4262 18.5611 18.5611 18.7296 18.7296 k = 0.0634 0.0634 0.0634 ( 2049 PWs) bands (ev): 6.7868 6.7868 9.3509 9.3509 10.1714 10.1714 10.2134 10.2134 10.2329 10.2329 10.4130 10.4130 10.4406 10.4406 13.1864 13.1864 13.2778 13.2778 13.8870 13.8870 15.3829 15.3829 15.4113 15.4113 16.1554 16.1554 16.2086 16.2086 16.4886 16.4886 16.6775 16.6775 16.8590 16.8590 16.9668 16.9668 17.3141 17.3141 17.3871 17.3871 17.3887 17.3887 18.6400 18.6400 18.8205 18.8205 k = 0.0704 0.0704 0.0704 ( 2049 PWs) bands (ev): 6.8233 6.8233 9.3751 9.3751 10.1845 10.1845 10.2356 10.2356 10.2489 10.2489 10.4306 10.4306 10.4652 10.4652 13.1710 13.1710 13.2855 13.2855 13.8897 13.8897 15.3668 15.3668 15.3995 15.3995 16.0420 16.0420 16.0871 16.0871 16.4479 16.4479 16.6372 16.6372 16.8033 16.8033 16.9299 16.9299 17.2868 17.2868 17.3536 17.3536 17.3741 17.3741 18.7173 18.7173 18.9078 18.9078 k = 0.0775 0.0775 0.0775 ( 2049 PWs) bands (ev): 6.8635 6.8635 9.4018 9.4018 10.1989 10.1989 10.2595 10.2595 10.2662 10.2662 10.4504 10.4504 10.4927 10.4927 13.1532 13.1532 13.2937 13.2937 13.8933 13.8933 15.3491 15.3491 15.3845 15.3845 15.9234 15.9234 15.9630 15.9630 16.4022 16.4022 16.5826 16.5826 16.7582 16.7582 16.8928 16.8928 17.2602 17.2602 17.3207 17.3207 17.3627 17.3627 18.7926 18.7926 18.9913 18.9913 k = 0.0845 0.0845 0.0845 ( 2043 PWs) bands (ev): 6.9072 6.9072 9.4309 9.4309 10.2145 10.2145 10.2846 10.2846 10.2850 10.2850 10.4725 10.4725 10.5231 10.5231 13.1330 13.1330 13.3024 13.3024 13.8979 13.8979 15.3297 15.3297 15.3641 15.3641 15.8009 15.8009 15.8397 15.8397 16.3504 16.3504 16.5165 16.5165 16.7223 16.7223 16.8551 16.8551 17.2346 17.2346 17.2898 17.2898 17.3525 17.3525 18.8654 18.8654 19.0707 19.0707 k = 0.0915 0.0915 0.0915 ( 2043 PWs) bands (ev): 6.9544 6.9544 9.4623 9.4623 10.2313 10.2313 10.3041 10.3041 10.3117 10.3117 10.4972 10.4972 10.5566 10.5566 13.1102 13.1102 13.3116 13.3116 13.9035 13.9035 15.3084 15.3084 15.3345 15.3345 15.6759 15.6759 15.7224 15.7224 16.2921 16.2921 16.4442 16.4442 16.6914 16.6914 16.8166 16.8166 17.2104 17.2104 17.2605 17.2605 17.3431 17.3431 18.9354 18.9354 19.1457 19.1457 k = 0.0986 0.0986 0.0986 ( 2043 PWs) bands (ev): 7.0051 7.0051 9.4959 9.4959 10.2492 10.2492 10.3246 10.3246 10.3395 10.3395 10.5245 10.5245 10.5930 10.5930 13.0849 13.0849 13.3211 13.3211 13.9099 13.9099 15.2847 15.2847 15.2882 15.2882 15.5499 15.5499 15.6195 15.6195 16.2274 16.2274 16.3694 16.3694 16.6624 16.6624 16.7772 16.7772 17.1877 17.1877 17.2328 17.2328 17.3345 17.3345 19.0024 19.0024 19.2163 19.2163 k = 0.1056 0.1056 0.1056 ( 2043 PWs) bands (ev): 7.0590 7.0590 9.5317 9.5317 10.2681 10.2681 10.3461 10.3461 10.3679 10.3679 10.5548 10.5548 10.6323 10.6323 13.0571 13.0571 13.3309 13.3309 13.9172 13.9172 15.2162 15.2162 15.2566 15.2566 15.4254 15.4254 15.5406 15.5406 16.1568 16.1568 16.2939 16.2939 16.6338 16.6338 16.7370 16.7370 17.1668 17.1668 17.2065 17.2065 17.3266 17.3266 19.0663 19.0663 19.2824 19.2824 k = 0.1127 0.1127 0.1127 ( 2043 PWs) bands (ev): 7.1162 7.1162 9.5696 9.5696 10.2880 10.2880 10.3686 10.3686 10.3967 10.3967 10.5880 10.5880 10.6746 10.6746 13.0269 13.0269 13.3409 13.3409 13.9252 13.9252 15.1173 15.1173 15.2147 15.2147 15.3129 15.3129 15.4877 15.4877 16.0817 16.0817 16.2181 16.2181 16.6046 16.6046 16.6959 16.6959 17.1475 17.1475 17.1817 17.1817 17.3191 17.3191 19.1267 19.1267 19.3438 19.3438 k = 0.1197 0.1197 0.1197 ( 2040 PWs) bands (ev): 7.1765 7.1765 9.6095 9.6095 10.3089 10.3089 10.3920 10.3920 10.4257 10.4257 10.6244 10.6244 10.7198 10.7198 12.9943 12.9943 13.3509 13.3509 13.9333 13.9333 14.9997 14.9997 15.1282 15.1282 15.2438 15.2438 15.4530 15.4530 16.0038 16.0038 16.1419 16.1419 16.5746 16.5746 16.6544 16.6544 17.1296 17.1296 17.1585 17.1585 17.3121 17.3121 19.1837 19.1837 19.4007 19.4007 k = 0.1268 0.1268 0.1268 ( 2043 PWs) bands (ev): 7.2398 7.2398 9.6513 9.6513 10.3306 10.3306 10.4165 10.4165 10.4546 10.4546 10.6640 10.6640 10.7677 10.7677 12.9596 12.9596 13.3609 13.3609 13.9413 13.9413 14.8720 14.8720 15.0097 15.0097 15.2063 15.2063 15.4284 15.4284 15.9242 15.9242 16.0649 16.0649 16.5436 16.5436 16.6125 16.6125 17.1128 17.1128 17.1372 17.1372 17.3055 17.3055 19.2370 19.2370 19.4529 19.4529 k = 0.1338 0.1338 0.1338 ( 2049 PWs) bands (ev): 7.3059 7.3059 9.6948 9.6948 10.3532 10.3532 10.4419 10.4419 10.4834 10.4834 10.7067 10.7067 10.8183 10.8183 12.9230 12.9230 13.3707 13.3707 13.9483 13.9483 14.7397 14.7397 14.8857 14.8857 15.1751 15.1751 15.4088 15.4088 15.8441 15.8441 15.9870 15.9870 16.5116 16.5116 16.5707 16.5707 17.0967 17.0967 17.1178 17.1178 17.2992 17.2992 19.2867 19.2867 19.5005 19.5005 k = 0.1408 0.1408 0.1408 ( 2046 PWs) bands (ev): 7.3747 7.3747 9.7399 9.7399 10.3764 10.3764 10.4684 10.4684 10.5119 10.5119 10.7526 10.7526 10.8716 10.8716 12.8846 12.8846 13.3801 13.3801 13.9533 13.9533 14.6054 14.6054 14.7629 14.7629 15.1450 15.1450 15.3919 15.3919 15.7641 15.7641 15.9084 15.9084 16.4789 16.4789 16.5293 16.5293 17.0808 17.0808 17.1009 17.1009 17.2932 17.2932 19.3325 19.3325 19.5436 19.5436 k = 0.1479 0.1479 0.1479 ( 2046 PWs) bands (ev): 7.4460 7.4460 9.7865 9.7865 10.4003 10.4003 10.4960 10.4960 10.5401 10.5401 10.8013 10.8013 10.9274 10.9274 12.8449 12.8449 13.3890 13.3890 13.9545 13.9545 14.4711 14.4711 14.6442 14.6442 15.1148 15.1148 15.3762 15.3762 15.6846 15.6846 15.8297 15.8297 16.4456 16.4456 16.4887 16.4887 17.0649 17.0649 17.0863 17.0863 17.2875 17.2875 19.3745 19.3745 19.5822 19.5822 k = 0.1549 0.1549 0.1549 ( 2046 PWs) bands (ev): 7.5197 7.5197 9.8342 9.8342 10.4246 10.4246 10.5247 10.5247 10.5679 10.5679 10.8528 10.8528 10.9856 10.9856 12.8040 12.8040 13.3971 13.3971 13.9492 13.9492 14.3378 14.3378 14.5332 14.5332 15.0841 15.0841 15.3610 15.3610 15.6056 15.6056 15.7514 15.7514 16.4120 16.4120 16.4492 16.4492 17.0490 17.0490 17.0737 17.0737 17.2819 17.2819 19.4125 19.4125 19.6163 19.6163 k = 0.1620 0.1620 0.1620 ( 2046 PWs) bands (ev): 7.5955 7.5955 9.8829 9.8829 10.4492 10.4492 10.5547 10.5547 10.5952 10.5952 10.9068 10.9068 11.0461 11.0461 12.7625 12.7625 13.4041 13.4041 13.9328 13.9328 14.2067 14.2067 14.4345 14.4345 15.0530 15.0530 15.3457 15.3457 15.5269 15.5269 15.6746 15.6746 16.3784 16.3784 16.4114 16.4114 17.0337 17.0337 17.0627 17.0627 17.2766 17.2766 19.4465 19.4465 19.6460 19.6460 k = 0.1690 0.1690 0.1690 ( 2058 PWs) bands (ev): 7.6732 7.6732 9.9323 9.9323 10.4740 10.4740 10.5861 10.5861 10.6219 10.6219 10.9632 10.9632 11.1088 11.1088 12.7206 12.7206 13.4093 13.4093 13.8995 13.8995 14.0788 14.0788 14.3542 14.3542 15.0214 15.0214 15.3299 15.3299 15.4479 15.4479 15.6001 15.6001 16.3452 16.3452 16.3754 16.3754 17.0189 17.0189 17.0527 17.0527 17.2714 17.2714 19.4764 19.4764 19.6712 19.6712 k = 0.1761 0.1761 0.1761 ( 2058 PWs) bands (ev): 7.7526 7.7526 9.9820 9.9820 10.4986 10.4986 10.6190 10.6190 10.6480 10.6480 11.0218 11.0218 11.1736 11.1736 12.6791 12.6791 13.4119 13.4119 13.8448 13.8448 13.9557 13.9557 14.2969 14.2969 14.9895 14.9895 15.3133 15.3133 15.3682 15.3682 15.5292 15.5292 16.3128 16.3128 16.3420 16.3420 17.0049 17.0049 17.0436 17.0436 17.2663 17.2663 19.5019 19.5019 19.6922 19.6922 k = 0.1831 0.1831 0.1831 ( 2058 PWs) bands (ev): 7.8334 7.8334 10.0315 10.0315 10.5230 10.5230 10.6537 10.6537 10.6732 10.6732 11.0822 11.0822 11.2402 11.2402 12.6383 12.6383 13.4099 13.4099 13.7696 13.7696 13.8396 13.8396 14.2617 14.2617 14.9572 14.9572 15.2874 15.2874 15.2955 15.2955 15.4627 15.4627 16.2816 16.2816 16.3116 16.3116 16.9916 16.9916 17.0352 17.0352 17.2614 17.2614 19.5231 19.5231 19.7088 19.7088 k = 0.1901 0.1901 0.1901 ( 2058 PWs) bands (ev): 7.9153 7.9153 10.0806 10.0806 10.5468 10.5468 10.6904 10.6904 10.6973 10.6973 11.1443 11.1443 11.3085 11.3085 12.5989 12.5989 13.3995 13.3995 13.6800 13.6800 13.7349 13.7349 14.2427 14.2427 14.9248 14.9248 15.2056 15.2056 15.2764 15.2764 15.4011 15.4011 16.2518 16.2518 16.2845 16.2845 16.9789 16.9789 17.0273 17.0273 17.2566 17.2566 19.5396 19.5396 19.7212 19.7212 k = 0.1972 0.1972 0.1972 ( 2058 PWs) bands (ev): 7.9980 7.9980 10.1285 10.1285 10.5696 10.5696 10.7201 10.7201 10.7293 10.7293 11.2079 11.2079 11.3783 11.3783 12.5617 12.5617 13.3734 13.3734 13.5825 13.5825 13.6494 13.6494 14.2334 14.2334 14.8923 14.8923 15.1230 15.1230 15.2557 15.2557 15.3446 15.3446 16.2238 16.2238 16.2611 16.2611 16.9669 16.9669 17.0199 17.0199 17.2518 17.2518 19.5514 19.5514 19.7293 19.7293 k = 0.2042 0.2042 0.2042 ( 2061 PWs) bands (ev): 8.0813 8.0813 10.1747 10.1747 10.5912 10.5912 10.7413 10.7413 10.7708 10.7708 11.2725 11.2725 11.4492 11.4492 12.5273 12.5273 13.3232 13.3232 13.4821 13.4821 13.5921 13.5921 14.2289 14.2289 14.8597 14.8597 15.0402 15.0402 15.2332 15.2332 15.2932 15.2932 16.1981 16.1981 16.2417 16.2417 16.9554 16.9554 17.0129 17.0129 17.2472 17.2472 19.5581 19.5581 19.7332 19.7332 k = 0.2113 0.2113 0.2113 ( 2049 PWs) bands (ev): 8.1647 8.1647 10.2187 10.2187 10.6111 10.6111 10.7605 10.7605 10.8150 10.8150 11.3378 11.3378 11.5211 11.5211 12.4967 12.4967 13.2509 13.2509 13.3819 13.3819 13.5619 13.5619 14.2263 14.2263 14.8270 14.8270 14.9582 14.9582 15.2090 15.2090 15.2468 15.2468 16.1748 16.1748 16.2266 16.2266 16.9445 16.9445 17.0064 17.0064 17.2428 17.2428 19.5598 19.5598 19.7328 19.7328 k = 0.2183 0.2183 0.2183 ( 2055 PWs) bands (ev): 8.2479 8.2479 10.2596 10.2596 10.6289 10.6289 10.7773 10.7773 10.8621 10.8621 11.4035 11.4035 11.5936 11.5936 12.4707 12.4707 13.1675 13.1675 13.2840 13.2840 13.5482 13.5482 14.2232 14.2232 14.7933 14.7933 14.8787 14.8787 15.1829 15.1829 15.2051 15.2051 16.1544 16.1544 16.2159 16.2159 16.9340 16.9340 17.0001 17.0001 17.2383 17.2383 19.5561 19.5561 19.7280 19.7280 k = 0.2254 0.2254 0.2254 ( 2055 PWs) bands (ev): 8.3304 8.3304 10.2968 10.2968 10.6443 10.6443 10.7914 10.7914 10.9124 10.9124 11.4690 11.4690 11.6662 11.6662 12.4503 12.4503 13.0824 13.0824 13.1903 13.1903 13.5428 13.5428 14.2181 14.2181 14.7538 14.7538 14.8074 14.8074 15.1550 15.1550 15.1680 15.1680 16.1371 16.1371 16.2096 16.2096 16.9241 16.9241 16.9940 16.9940 17.2340 17.2340 19.5470 19.5470 19.7190 19.7190 k = 0.2324 0.2324 0.2324 ( 2052 PWs) bands (ev): 8.4120 8.4120 10.3296 10.3296 10.6567 10.6567 10.8021 10.8021 10.9659 10.9659 11.5336 11.5336 11.7385 11.7385 12.4363 12.4363 13.0008 13.0008 13.1023 13.1023 13.5415 13.5415 14.2098 14.2098 14.6962 14.6962 14.7578 14.7578 15.1256 15.1256 15.1355 15.1355 16.1231 16.1231 16.2079 16.2079 16.9145 16.9145 16.9882 16.9882 17.2297 17.2297 19.5327 19.5327 19.7056 19.7056 k = 0.2394 0.2394 0.2394 ( 2052 PWs) bands (ev): 8.4923 8.4923 10.3574 10.3574 10.6658 10.6658 10.8090 10.8090 11.0225 11.0225 11.5966 11.5966 11.8101 11.8101 12.4293 12.4293 12.9261 12.9261 13.0215 13.0215 13.5424 13.5424 14.1971 14.1971 14.6264 14.6264 14.7249 14.7249 15.0947 15.0947 15.1072 15.1072 16.1126 16.1126 16.2104 16.2104 16.9053 16.9053 16.9826 16.9826 17.2255 17.2255 19.5132 19.5132 19.6878 19.6878 k = 0.2465 0.2465 0.2465 ( 2052 PWs) bands (ev): 8.5707 8.5707 10.3797 10.3797 10.6709 10.6709 10.8114 10.8114 11.0821 11.0821 11.6570 11.6570 11.8806 11.8806 12.4293 12.4293 12.8604 12.8604 12.9498 12.9498 13.5445 13.5445 14.1789 14.1789 14.5566 14.5566 14.6979 14.6979 15.0627 15.0627 15.0832 15.0832 16.1057 16.1057 16.2170 16.2170 16.8964 16.8964 16.9772 16.9772 17.2214 17.2214 19.4885 19.4885 19.6656 19.6656 k = 0.2535 0.2535 0.2535 ( 2046 PWs) bands (ev): 8.6470 8.6470 10.3962 10.3962 10.6718 10.6718 10.8090 10.8090 11.1445 11.1445 11.7138 11.7138 11.9496 11.9496 12.4357 12.4357 12.8058 12.8058 12.8898 12.8898 13.5476 13.5476 14.1541 14.1541 14.4907 14.4907 14.6741 14.6741 15.0299 15.0299 15.0634 15.0634 16.1026 16.1026 16.2276 16.2276 16.8879 16.8879 16.9720 16.9720 17.2173 17.2173 19.4590 19.4590 19.6389 19.6389 k = 0.2606 0.2606 0.2606 ( 2052 PWs) bands (ev): 8.7207 8.7207 10.4065 10.4065 10.6680 10.6680 10.8011 10.8011 11.2094 11.2094 11.7656 11.7656 12.0170 12.0170 12.4463 12.4463 12.7641 12.7641 12.8448 12.8448 13.5513 13.5513 14.1221 14.1221 14.4303 14.4303 14.6528 14.6528 14.9964 14.9964 15.0475 15.0475 16.1031 16.1031 16.2417 16.2417 16.8797 16.8797 16.9670 16.9670 17.2134 17.2134 19.4248 19.4248 19.6075 19.6075 k = 0.2676 0.2676 0.2676 ( 2052 PWs) bands (ev): 8.7916 8.7916 10.4105 10.4105 10.6591 10.6591 10.7873 10.7873 11.2765 11.2765 11.8114 11.8114 12.0827 12.0827 12.4583 12.4583 12.7368 12.7368 12.8187 12.8187 13.5558 13.5558 14.0829 14.0829 14.3762 14.3762 14.6338 14.6338 14.9628 14.9628 15.0355 15.0355 16.1074 16.1074 16.2593 16.2593 16.8718 16.8718 16.9621 16.9621 17.2095 17.2095 19.3861 19.3861 19.5716 19.5716 k = 0.2746 0.2746 0.2746 ( 2058 PWs) bands (ev): 8.8594 8.8594 10.4084 10.4084 10.6450 10.6450 10.7676 10.7676 11.3453 11.3453 11.8502 11.8502 12.1458 12.1458 12.4691 12.4691 12.7248 12.7248 12.8151 12.8151 13.5611 13.5611 14.0372 14.0372 14.3283 14.3283 14.6169 14.6169 14.9293 14.9293 15.0271 15.0271 16.1153 16.1153 16.2799 16.2799 16.8641 16.8641 16.9574 16.9574 17.2058 17.2058 19.3429 19.3429 19.5311 19.5311 k = 0.2817 0.2817 0.2817 ( 2058 PWs) bands (ev): 8.9237 8.9237 10.4004 10.4004 10.6254 10.6254 10.7417 10.7417 11.4156 11.4156 11.8818 11.8818 12.2044 12.2044 12.4808 12.4808 12.7283 12.7283 12.8341 12.8341 13.5673 13.5673 13.9868 13.9868 14.2859 14.2859 14.6019 14.6019 14.8963 14.8963 15.0225 15.0225 16.1267 16.1267 16.3034 16.3034 16.8568 16.8568 16.9528 16.9528 17.2021 17.2021 19.2955 19.2955 19.4859 19.4859 k = 0.2887 0.2887 0.2887 ( 2052 PWs) bands (ev): 8.9844 8.9844 10.3869 10.3869 10.6005 10.6005 10.7099 10.7099 11.4869 11.4869 11.9065 11.9065 12.2536 12.2536 12.5015 12.5015 12.7462 12.7462 12.8719 12.8719 13.5748 13.5748 13.9338 13.9338 14.2477 14.2477 14.5887 14.5887 14.8640 14.8640 15.0216 15.0216 16.1414 16.1414 16.3293 16.3293 16.8497 16.8497 16.9484 16.9484 17.1986 17.1986 19.2440 19.2440 19.4360 19.4360 k = 0.2958 0.2958 0.2958 ( 2058 PWs) bands (ev): 9.0414 9.0414 10.3684 10.3684 10.5704 10.5704 10.6726 10.6726 11.5586 11.5586 11.9256 11.9256 12.2877 12.2877 12.5411 12.5411 12.7766 12.7766 12.9229 12.9229 13.5838 13.5838 13.8804 13.8804 14.2130 14.2130 14.5772 14.5772 14.8328 14.8328 15.0240 15.0240 16.1591 16.1591 16.3574 16.3574 16.8429 16.8429 16.9441 16.9441 17.1951 17.1951 19.1884 19.1884 19.3815 19.3815 k = 0.3028 0.3028 0.3028 ( 2058 PWs) bands (ev): 9.0946 9.0946 10.3455 10.3455 10.5356 10.5356 10.6303 10.6303 11.6303 11.6303 11.9405 11.9405 12.3072 12.3072 12.6032 12.6032 12.8169 12.8169 12.9818 12.9818 13.5948 13.5948 13.8285 13.8285 14.1812 14.1812 14.5673 14.5673 14.8030 14.8030 15.0300 15.0300 16.1796 16.1796 16.3874 16.3874 16.8363 16.8363 16.9399 16.9399 17.1918 17.1918 19.1291 19.1291 19.3224 19.3224 k = 0.3099 0.3099 0.3099 ( 2064 PWs) bands (ev): 9.1440 9.1440 10.3189 10.3189 10.4964 10.4964 10.5837 10.5837 11.7011 11.7011 11.9526 11.9526 12.3188 12.3188 12.6833 12.6833 12.8643 12.8643 13.0440 13.0440 13.6082 13.6082 13.7801 13.7801 14.1521 14.1521 14.5592 14.5592 14.7750 14.7750 15.0395 15.0395 16.2026 16.2026 16.4190 16.4190 16.8300 16.8300 16.9358 16.9358 17.1886 17.1886 19.0660 19.0660 19.2587 19.2587 k = 0.3169 0.3169 0.3169 ( 2064 PWs) bands (ev): 9.1896 9.1896 10.2892 10.2892 10.4535 10.4535 10.5336 10.5336 11.7700 11.7700 11.9630 11.9630 12.3290 12.3290 12.7760 12.7760 12.9161 12.9161 13.1052 13.1052 13.6246 13.6246 13.7375 13.7375 14.1261 14.1261 14.5530 14.5530 14.7491 14.7491 15.0524 15.0524 16.2278 16.2278 16.4520 16.4520 16.8239 16.8239 16.9318 16.9318 17.1856 17.1856 18.9993 18.9993 19.1905 19.1905 k = 0.3239 0.3239 0.3239 ( 2064 PWs) bands (ev): 9.2314 9.2314 10.2569 10.2569 10.4075 10.4075 10.4808 10.4808 11.8359 11.8359 11.9725 11.9725 12.3422 12.3422 12.8776 12.8776 12.9697 12.9697 13.1612 13.1612 13.6447 13.6447 13.7034 13.7034 14.1037 14.1037 14.5492 14.5492 14.7258 14.7258 15.0686 15.0686 16.2548 16.2548 16.4860 16.4860 16.8181 16.8181 16.9280 16.9280 17.1827 17.1827 18.9293 18.9293 19.1181 19.1181 k = 0.3310 0.3310 0.3310 ( 2064 PWs) bands (ev): 9.2696 9.2696 10.2227 10.2227 10.3591 10.3591 10.4260 10.4260 11.8971 11.8971 11.9815 11.9815 12.3610 12.3610 12.9855 12.9855 13.0229 13.0229 13.2073 13.2073 13.6691 13.6691 13.6810 13.6810 14.0860 14.0860 14.5484 14.5484 14.7053 14.7053 15.0883 15.0883 16.2835 16.2835 16.5209 16.5209 16.8125 16.8125 16.9242 16.9242 17.1800 17.1800 18.8559 18.8559 19.0414 19.0414 k = 0.3380 0.3380 0.3380 ( 2064 PWs) bands (ev): 9.3044 9.3044 10.1872 10.1872 10.3089 10.3089 10.3700 10.3700 11.9520 11.9520 11.9904 11.9904 12.3872 12.3872 13.0737 13.0737 13.0958 13.0958 13.2406 13.2406 13.6733 13.6733 13.6986 13.6986 14.0741 14.0741 14.5512 14.5512 14.6884 14.6884 15.1113 15.1113 16.3133 16.3133 16.5563 16.5563 16.8072 16.8072 16.9205 16.9205 17.1775 17.1775 18.7795 18.7795 18.9608 18.9608 k = 0.3451 0.3451 0.3451 ( 2058 PWs) bands (ev): 9.3359 9.3359 10.1507 10.1507 10.2576 10.2576 10.3134 10.3134 11.9991 11.9991 11.9992 11.9992 12.4219 12.4219 13.1205 13.1205 13.1938 13.1938 13.2715 13.2715 13.6809 13.6809 13.7335 13.7335 14.0695 14.0695 14.5588 14.5588 14.6754 14.6754 15.1377 15.1377 16.3442 16.3442 16.5921 16.5921 16.8021 16.8021 16.9168 16.9168 17.1751 17.1751 18.7002 18.7002 18.8765 18.8765 k = 0.3521 0.3521 0.3521 ( 2058 PWs) bands (ev): 9.3643 9.3643 10.1138 10.1138 10.2057 10.2057 10.2567 10.2567 12.0079 12.0079 12.0378 12.0378 12.4654 12.4654 13.1620 13.1620 13.2267 13.2267 13.3509 13.3509 13.7022 13.7022 13.7736 13.7736 14.0734 14.0734 14.5725 14.5725 14.6671 14.6671 15.1676 15.1676 16.3756 16.3756 16.6279 16.6279 16.7973 16.7973 16.9133 16.9133 17.1730 17.1730 18.6182 18.6182 18.7886 18.7886 k = 0.3592 0.3592 0.3592 ( 2058 PWs) bands (ev): 9.3898 9.3898 10.0768 10.0768 10.1537 10.1537 10.2006 10.2006 12.0164 12.0164 12.0681 12.0681 12.5167 12.5167 13.1978 13.1978 13.2200 13.2200 13.4500 13.4500 13.7383 13.7383 13.8182 13.8182 14.0855 14.0855 14.5941 14.5941 14.6644 14.6644 15.2011 15.2011 16.4073 16.4073 16.6635 16.6635 16.7927 16.7927 16.9097 16.9097 17.1711 17.1711 18.5337 18.5337 18.6974 18.6974 k = 0.3662 0.3662 0.3662 ( 2046 PWs) bands (ev): 9.4126 9.4126 10.0401 10.0401 10.1022 10.1022 10.1454 10.1454 12.0247 12.0247 12.0913 12.0913 12.5742 12.5742 13.2032 13.2032 13.2279 13.2279 13.5291 13.5291 13.7986 13.7986 13.8659 13.8659 14.1040 14.1040 14.6251 14.6251 14.6682 14.6682 15.2384 15.2384 16.4389 16.4389 16.6986 16.6986 16.7884 16.7884 16.9063 16.9063 17.1695 17.1695 18.4471 18.4471 18.6033 18.6033 k = 0.3732 0.3732 0.3732 ( 2046 PWs) bands (ev): 9.4329 9.4329 10.0039 10.0039 10.0516 10.0516 10.0914 10.0914 12.0326 12.0326 12.1083 12.1083 12.6358 12.6358 13.1830 13.1830 13.2526 13.2526 13.5745 13.5745 13.8912 13.8912 13.9148 13.9148 14.1255 14.1255 14.6669 14.6669 14.6796 14.6797 15.2794 15.2794 16.4702 16.4702 16.7330 16.7330 16.7844 16.7844 16.9027 16.9027 17.1682 17.1682 18.3584 18.3584 18.5065 18.5065 k = 0.3803 0.3803 0.3803 ( 2052 PWs) bands (ev): 9.4509 9.4509 9.9686 9.9686 10.0021 10.0021 10.0391 10.0391 12.0402 12.0402 12.1206 12.1206 12.6997 12.6997 13.1621 13.1621 13.2726 13.2726 13.5930 13.5930 13.9628 13.9628 14.0083 14.0083 14.1468 14.1468 14.6999 14.6999 14.7199 14.7199 15.3245 15.3245 16.5008 16.5008 16.7664 16.7664 16.7807 16.7807 16.8991 16.8991 17.1672 17.1672 18.2681 18.2681 18.4073 18.4073 k = 0.3873 0.3873 0.3873 ( 2046 PWs) bands (ev): 9.4669 9.4669 9.9342 9.9342 9.9543 9.9543 9.9888 9.9888 12.0472 12.0472 12.1289 12.1289 12.7643 12.7643 13.1421 13.1421 13.2887 13.2887 13.5969 13.5969 14.0079 14.0079 14.1350 14.1350 14.1689 14.1689 14.7300 14.7300 14.7835 14.7835 15.3739 15.3739 16.5305 16.5305 16.7773 16.7773 16.7987 16.7987 16.8954 16.8954 17.1666 17.1666 18.1765 18.1765 18.3061 18.3061 k = 0.3944 0.3944 0.3944 ( 2040 PWs) bands (ev): 9.4809 9.4809 9.9009 9.9009 9.9085 9.9085 9.9405 9.9405 12.0538 12.0538 12.1341 12.1341 12.8280 12.8280 13.1241 13.1241 13.3014 13.3014 13.5931 13.5931 14.0482 14.0482 14.1777 14.1777 14.2776 14.2776 14.7707 14.7707 14.8561 14.8561 15.4279 15.4279 16.5589 16.5589 16.7743 16.7743 16.8294 16.8294 16.8916 16.8916 17.1664 17.1664 18.0839 18.0839 18.2032 18.2032 k = 0.4014 0.4014 0.4014 ( 2040 PWs) bands (ev): 9.4932 9.4932 9.8635 9.8635 9.8704 9.8704 9.8947 9.8947 12.0598 12.0598 12.1366 12.1366 12.8895 12.8895 13.1089 13.1089 13.3115 13.3115 13.5855 13.5855 14.0831 14.0831 14.1900 14.1900 14.4162 14.4162 14.8218 14.8218 14.9355 14.9355 15.4865 15.4865 16.5855 16.5855 16.7718 16.7718 16.8583 16.8583 16.8875 16.8875 17.1666 17.1666 17.9906 17.9906 18.0990 18.0990 k = 0.4085 0.4085 0.4085 ( 2040 PWs) bands (ev): 9.5039 9.5039 9.8222 9.8222 9.8401 9.8401 9.8514 9.8514 12.0652 12.0652 12.1370 12.1370 12.9467 12.9467 13.0979 13.0979 13.3194 13.3194 13.5760 13.5760 14.1121 14.1121 14.1988 14.1988 14.5559 14.5559 14.8827 14.8827 15.0196 15.0196 15.5500 15.5500 16.6099 16.6099 16.7699 16.7699 16.8831 16.8831 16.8851 16.8851 17.1674 17.1674 17.8972 17.8972 17.9941 17.9941 k = 0.4155 0.4155 0.4155 ( 2052 PWs) bands (ev): 9.5132 9.5132 9.7831 9.7831 9.8108 9.8108 9.8119 9.8119 12.0701 12.0701 12.1356 12.1356 12.9950 12.9950 13.0949 13.0949 13.3254 13.3254 13.5660 13.5660 14.1358 14.1358 14.2053 14.2053 14.6950 14.6950 14.9523 14.9523 15.1064 15.1064 15.6186 15.6186 16.6317 16.6317 16.7687 16.7687 16.8782 16.8782 16.9094 16.9094 17.1687 17.1687 17.8043 17.8043 17.8888 17.8888 k = 0.4225 0.4225 0.4225 ( 2052 PWs) bands (ev): 9.5212 9.5212 9.7466 9.7466 9.7731 9.7731 9.7855 9.7855 12.0745 12.0745 12.1329 12.1329 13.0242 13.0242 13.1093 13.1093 13.3301 13.3301 13.5563 13.5563 14.1549 14.1549 14.2101 14.2101 14.8321 14.8321 15.0289 15.0289 15.1943 15.1943 15.6919 15.6919 16.6504 16.6504 16.7685 16.7685 16.8727 16.8727 16.9309 16.9309 17.1706 17.1706 17.7123 17.7123 17.7839 17.7839 k = 0.4296 0.4296 0.4296 ( 2040 PWs) bands (ev): 9.5279 9.5279 9.7130 9.7130 9.7383 9.7383 9.7612 9.7612 12.0784 12.0784 12.1291 12.1291 13.0318 13.0318 13.1428 13.1428 13.3336 13.3336 13.5476 13.5476 14.1702 14.1702 14.2136 14.2136 14.9663 14.9663 15.1111 15.1111 15.2819 15.2819 15.7697 15.7697 16.6653 16.6653 16.7696 16.7696 16.8664 16.8664 16.9493 16.9493 17.1731 17.1731 17.6222 17.6222 17.6801 17.6801 k = 0.4366 0.4366 0.4366 ( 2046 PWs) bands (ev): 9.5335 9.5335 9.6824 9.6824 9.7066 9.7066 9.7389 9.7389 12.0817 12.0817 12.1247 12.1247 13.0306 13.0306 13.1819 13.1819 13.3361 13.3361 13.5403 13.5403 14.1826 14.1826 14.2162 14.2162 15.0963 15.0963 15.1970 15.1970 15.3683 15.3683 15.8510 15.8510 16.6758 16.6758 16.7719 16.7719 16.8589 16.8589 16.9639 16.9639 17.1757 17.1757 17.5349 17.5349 17.5787 17.5787 k = 0.4437 0.4437 0.4437 ( 2043 PWs) bands (ev): 9.5381 9.5381 9.6550 9.6550 9.6780 9.6780 9.7189 9.7189 12.0846 12.0846 12.1199 12.1199 13.0274 13.0274 13.2191 13.2191 13.3379 13.3379 13.5348 13.5348 14.1926 14.1926 14.2183 14.2183 15.2211 15.2211 15.2852 15.2852 15.4529 15.4529 15.9346 15.9346 16.6819 16.6819 16.7751 16.7751 16.8500 16.8500 16.9741 16.9741 17.1783 17.1783 17.4516 17.4516 17.4814 17.4814 k = 0.4507 0.4507 0.4507 ( 2050 PWs) bands (ev): 9.5415 9.5415 9.6309 9.6309 9.6526 9.6526 9.7010 9.7010 12.0870 12.0870 12.1149 12.1149 13.0241 13.0241 13.2517 13.2517 13.3391 13.3391 13.5314 13.5314 14.2008 14.2008 14.2198 14.2198 15.3391 15.3391 15.3741 15.3741 15.5354 15.5354 16.0189 16.0189 16.6838 16.6838 16.7782 16.7782 16.8396 16.8396 16.9786 16.9786 17.1795 17.1795 17.3738 17.3738 17.3914 17.3914 k = 0.4577 0.4577 0.4577 ( 2044 PWs) bands (ev): 9.5438 9.5438 9.6104 9.6104 9.6305 9.6305 9.6854 9.6854 12.0891 12.0891 12.1101 12.1101 13.0213 13.0213 13.2790 13.2790 13.3399 13.3399 13.5303 13.5303 14.2074 14.2074 14.2211 14.2211 15.4485 15.4485 15.4618 15.4618 15.6153 15.6153 16.1021 16.1021 16.6819 16.6819 16.7792 16.7792 16.8283 16.8283 16.9752 16.9752 17.1768 17.1768 17.3035 17.3035 17.3147 17.3147 k = 0.4648 0.4648 0.4648 ( 2044 PWs) bands (ev): 9.5446 9.5446 9.5940 9.5940 9.6117 9.6117 9.6722 9.6722 12.0907 12.0907 12.1057 12.1057 13.0189 13.0189 13.3005 13.3005 13.3404 13.3404 13.5313 13.5313 14.2128 14.2128 14.2221 14.2221 15.5464 15.5464 15.5472 15.5472 15.6919 15.6919 16.1821 16.1821 16.6767 16.6767 16.7746 16.7746 16.8186 16.8186 16.9604 16.9604 17.1645 17.1645 17.2424 17.2424 17.2621 17.2621 k = 0.4718 0.4718 0.4718 ( 2023 PWs) bands (ev): 9.5437 9.5437 9.5820 9.5820 9.5963 9.5963 9.6613 9.6613 12.0921 12.0921 12.1018 12.1018 13.0172 13.0172 13.3167 13.3167 13.3406 13.3406 13.5338 13.5338 14.2171 14.2171 14.2229 14.2229 15.6251 15.6251 15.6327 15.6327 15.7638 15.7638 16.2566 16.2566 16.6684 16.6684 16.7617 16.7617 16.8135 16.8135 16.9314 16.9314 17.1424 17.1424 17.1922 17.1922 17.2393 17.2393 k = 0.4789 0.4789 0.4789 ( 2008 PWs) bands (ev): 9.5409 9.5409 9.5746 9.5746 9.5843 9.5843 9.6529 9.6529 12.0931 12.0931 12.0987 12.0987 13.0158 13.0158 13.3281 13.3281 13.3408 13.3408 13.5372 13.5372 14.2203 14.2203 14.2236 14.2236 15.6944 15.6944 15.7027 15.7027 15.8279 15.8279 16.3229 16.3229 16.6573 16.6573 16.7433 16.7433 16.8119 16.8119 16.8915 16.8915 17.1233 17.1233 17.1538 17.1538 17.2328 17.2328 k = 0.4859 0.4859 0.4859 ( 2008 PWs) bands (ev): 9.5374 9.5374 9.5708 9.5708 9.5756 9.5756 9.6469 9.6469 12.0938 12.0938 12.0963 12.0963 13.0149 13.0149 13.3354 13.3354 13.3408 13.3408 13.5403 13.5403 14.2226 14.2226 14.2240 14.2240 15.7497 15.7497 15.7550 15.7550 15.8795 15.8795 16.3772 16.3772 16.6449 16.6449 16.7249 16.7249 16.8115 16.8115 16.8513 16.8513 17.1121 17.1121 17.1267 17.1267 17.2315 17.2315 k = 0.4930 0.4930 0.4930 ( 2008 PWs) bands (ev): 9.5346 9.5346 9.5692 9.5692 9.5705 9.5705 9.6432 9.6432 12.0942 12.0942 12.0949 12.0949 13.0144 13.0144 13.3395 13.3395 13.3408 13.3408 13.5426 13.5426 14.2239 14.2239 14.2243 14.2243 15.7860 15.7860 15.7876 15.7876 15.9134 15.9134 16.4143 16.4143 16.6342 16.6342 16.7115 16.7115 16.8114 16.8114 16.8221 16.8221 17.1067 17.1067 17.1106 17.1106 17.2315 17.2315 k = 0.5000 0.5000 0.5000 ( 2008 PWs) bands (ev): 9.5335 9.5335 9.5687 9.5687 9.5687 9.5687 9.6420 9.6420 12.0944 12.0944 12.0944 12.0944 13.0142 13.0142 13.3408 13.3408 13.3408 13.3408 13.5434 13.5434 14.2244 14.2244 14.2244 14.2244 15.7987 15.7987 15.7987 15.7987 15.9252 15.9252 16.4278 16.4278 16.6297 16.6297 16.7065 16.7065 16.8114 16.8114 16.8114 16.8114 17.1051 17.1051 17.1051 17.1051 17.2316 17.2316 k = 0.5000 0.5000 0.5000 ( 2008 PWs) bands (ev): 9.5335 9.5335 9.5687 9.5687 9.5687 9.5687 9.6420 9.6420 12.0944 12.0944 12.0944 12.0944 13.0142 13.0142 13.3408 13.3408 13.3408 13.3408 13.5434 13.5434 14.2244 14.2244 14.2244 14.2244 15.7987 15.7987 15.7987 15.7987 15.9252 15.9252 16.4278 16.4278 16.6297 16.6297 16.7065 16.7065 16.8114 16.8114 16.8114 16.8114 17.1051 17.1051 17.1051 17.1051 17.2316 17.2316 k = 0.4914 0.5000 0.4914 ( 2008 PWs) bands (ev): 9.5346 9.5346 9.5693 9.5693 9.5704 9.5704 9.6432 9.6432 12.0942 12.0942 12.0948 12.0948 13.0144 13.0144 13.3395 13.3395 13.3408 13.3408 13.5426 13.5426 14.2236 14.2236 14.2246 14.2246 15.7861 15.7861 15.7876 15.7876 15.9134 15.9134 16.4143 16.4143 16.6342 16.6342 16.7115 16.7115 16.8118 16.8118 16.8217 16.8217 17.1069 17.1069 17.1103 17.1103 17.2320 17.2320 k = 0.4828 0.5000 0.4828 ( 2008 PWs) bands (ev): 9.5375 9.5375 9.5709 9.5709 9.5755 9.5755 9.6469 9.6469 12.0939 12.0939 12.0962 12.0962 13.0149 13.0149 13.3356 13.3356 13.3407 13.3407 13.5403 13.5403 14.2214 14.2214 14.2252 14.2252 15.7500 15.7500 15.7551 15.7551 15.8795 15.8795 16.3767 16.3767 16.6454 16.6454 16.7247 16.7247 16.8131 16.8131 16.8501 16.8501 17.1119 17.1119 17.1263 17.1263 17.2330 17.2330 k = 0.4741 0.5000 0.4741 ( 2008 PWs) bands (ev): 9.5417 9.5417 9.5738 9.5738 9.5843 9.5843 9.6529 9.6529 12.0933 12.0933 12.0984 12.0984 13.0158 13.0158 13.3288 13.3288 13.3404 13.3404 13.5369 13.5369 14.2177 14.2177 14.2262 14.2262 15.6943 15.6943 15.7039 15.7039 15.8277 15.8277 16.3211 16.3211 16.6590 16.6590 16.7425 16.7425 16.8153 16.8153 16.8895 16.8895 17.1196 17.1196 17.1552 17.1552 17.2347 17.2347 k = 0.4655 0.5000 0.4655 ( 2022 PWs) bands (ev): 9.5464 9.5464 9.5784 9.5784 9.5972 9.5972 9.6613 9.6613 12.0925 12.0925 12.1015 12.1015 13.0171 13.0171 13.3186 13.3186 13.3396 13.3396 13.5330 13.5330 14.2124 14.2124 14.2276 14.2276 15.6229 15.6229 15.6375 15.6375 15.7636 15.7636 16.2528 16.2528 16.6719 16.6719 16.7608 16.7608 16.8185 16.8185 16.9307 16.9307 17.1294 17.1294 17.2006 17.2006 17.2373 17.2373 k = 0.4569 0.5000 0.4569 ( 2034 PWs) bands (ev): 9.5509 9.5509 9.5850 9.5850 9.6143 9.6143 9.6722 9.6722 12.0914 12.0914 12.1052 12.1052 13.0188 13.0188 13.3047 13.3047 13.3383 13.3383 13.5294 13.5294 14.2056 14.2056 14.2293 14.2293 15.5380 15.5380 15.5599 15.5599 15.6925 15.6925 16.1757 16.1757 16.6822 16.6822 16.7767 16.7767 16.8227 16.8227 16.9662 16.9662 17.1410 17.1410 17.2375 17.2375 17.2683 17.2683 k = 0.4483 0.5000 0.4483 ( 2046 PWs) bands (ev): 9.5550 9.5550 9.5939 9.5939 9.6359 9.6359 9.6855 9.6855 12.0900 12.0900 12.1094 12.1094 13.0211 13.0211 13.2865 13.2865 13.3361 13.3361 13.5269 13.5269 14.1972 14.1972 14.2313 14.2313 15.4402 15.4402 15.4756 15.4756 15.6185 15.6185 16.0925 16.0925 16.6893 16.6893 16.7884 16.7884 16.8276 16.8276 16.9931 16.9931 17.1536 17.1536 17.2408 17.2408 17.3515 17.3515 k = 0.4397 0.5000 0.4397 ( 2050 PWs) bands (ev): 9.5586 9.5586 9.6049 9.6049 9.6616 9.6616 9.7012 9.7012 12.0883 12.0883 12.1139 12.1139 13.0239 13.0239 13.2638 13.2638 13.3327 13.3327 13.5260 13.5260 14.1871 14.1871 14.2336 14.2336 15.3306 15.3306 15.3879 15.3879 15.5444 15.5444 16.0052 16.0052 16.6931 16.6931 16.7958 16.7958 16.8325 16.8325 17.0123 17.0123 17.1664 17.1664 17.2432 17.2432 17.4503 17.4503 k = 0.4310 0.5000 0.4310 ( 2052 PWs) bands (ev): 9.5619 9.5619 9.6180 9.6180 9.6915 9.6915 9.7193 9.7193 12.0862 12.0862 12.1186 12.1186 13.0273 13.0273 13.2367 13.2367 13.3279 13.3279 13.5270 13.5270 14.1751 14.1751 14.2359 14.2359 15.2113 15.2113 15.2992 15.2992 15.4715 15.4715 15.9154 15.9154 16.6940 16.6940 16.7995 16.7995 16.8365 16.8365 17.0255 17.0255 17.1783 17.1783 17.2447 17.2447 17.5600 17.5600 k = 0.4224 0.5000 0.4224 ( 2042 PWs) bands (ev): 9.5650 9.5650 9.6328 9.6328 9.7254 9.7254 9.7398 9.7398 12.0837 12.0837 12.1231 12.1231 13.0314 13.0314 13.2056 13.2056 13.3216 13.3216 13.5300 13.5300 14.1613 14.1613 14.2380 14.2380 15.0843 15.0843 15.2108 15.2108 15.4005 15.4005 15.8242 15.8242 16.6924 16.6924 16.8006 16.8006 16.8388 16.8388 17.0343 17.0343 17.1884 17.1884 17.2451 17.2451 17.6779 17.6779 k = 0.4138 0.5000 0.4138 ( 2050 PWs) bands (ev): 9.5679 9.5679 9.6493 9.6493 9.7620 9.7620 9.7636 9.7636 12.0808 12.0808 12.1270 12.1270 13.0358 13.0358 13.1711 13.1711 13.3135 13.3135 13.5347 13.5347 14.1452 14.1452 14.2398 14.2398 14.9517 14.9517 15.1240 15.1240 15.3319 15.3319 15.7328 15.7328 16.6888 16.6888 16.7995 16.7995 16.8392 16.8392 17.0395 17.0395 17.1961 17.1961 17.2440 17.2440 17.8020 17.8020 k = 0.4052 0.5000 0.4052 ( 2050 PWs) bands (ev): 9.5707 9.5707 9.6674 9.6674 9.7875 9.7875 9.8044 9.8044 12.0773 12.0773 12.1302 12.1302 13.0400 13.0400 13.1348 13.1348 13.3037 13.3037 13.5405 13.5405 14.1266 14.1266 14.2408 14.2408 14.8152 14.8152 15.0401 15.0401 15.2659 15.2659 15.6422 15.6422 16.6834 16.6834 16.7966 16.7966 16.8379 16.8379 17.0419 17.0419 17.2009 17.2009 17.2412 17.2412 17.9311 17.9311 k = 0.3966 0.5000 0.3966 ( 2050 PWs) bands (ev): 9.5735 9.5735 9.6869 9.6869 9.8149 9.8149 9.8493 9.8493 12.0732 12.0732 12.1321 12.1321 13.0404 13.0404 13.1005 13.1005 13.2921 13.2921 13.5466 13.5466 14.1053 14.1053 14.2407 14.2407 14.6766 14.6766 14.9601 14.9601 15.2028 15.2028 15.5535 15.5535 16.6765 16.6765 16.7921 16.7921 16.8350 16.8350 17.0419 17.0419 17.2024 17.2024 17.2364 17.2364 18.0644 18.0644 k = 0.3879 0.5000 0.3879 ( 2054 PWs) bands (ev): 9.5761 9.5761 9.7078 9.7078 9.8444 9.8444 9.8976 9.8976 12.0682 12.0682 12.1324 12.1324 13.0247 13.0247 13.0813 13.0813 13.2789 13.2789 13.5519 13.5519 14.0809 14.0809 14.2390 14.2390 14.5377 14.5377 14.8850 14.8850 15.1427 15.1427 15.4679 15.4679 16.6683 16.6683 16.7862 16.7862 16.8306 16.8306 17.0399 17.0399 17.2004 17.2004 17.2298 17.2298 18.2011 18.2011 k = 0.3793 0.5000 0.3793 ( 2046 PWs) bands (ev): 9.5785 9.5785 9.7299 9.7299 9.8761 9.8761 9.9490 9.9490 12.0621 12.0621 12.1308 12.1308 12.9894 12.9894 13.0811 13.0811 13.2646 13.2646 13.5546 13.5546 14.0532 14.0532 14.2350 14.2350 14.4012 14.4012 14.8155 14.8155 15.0855 15.0855 15.3866 15.3866 16.6589 16.6589 16.7790 16.7790 16.8249 16.8249 17.0362 17.0362 17.1949 17.1949 17.2214 17.2214 18.3409 18.3409 k = 0.3707 0.5000 0.3707 ( 2046 PWs) bands (ev): 9.5807 9.5807 9.7532 9.7532 9.9098 9.9098 10.0036 10.0036 12.0547 12.0547 12.1270 12.1270 12.9476 12.9476 13.0864 13.0864 13.2501 13.2501 13.5519 13.5519 14.0216 14.0216 14.2262 14.2262 14.2726 14.2726 14.7522 14.7522 15.0311 15.0311 15.3111 15.3111 16.6484 16.6484 16.7706 16.7706 16.8179 16.8179 17.0310 17.0310 17.1861 17.1861 17.2112 17.2112 18.4832 18.4832 k = 0.3621 0.5000 0.3621 ( 2046 PWs) bands (ev): 9.5826 9.5826 9.7774 9.7774 9.9455 9.9455 10.0610 10.0610 12.0454 12.0454 12.1209 12.1209 12.9047 12.9047 13.0905 13.0905 13.2371 13.2371 13.5396 13.5396 13.9845 13.9845 14.1477 14.1477 14.2232 14.2232 14.6953 14.6953 14.9790 14.9790 15.2434 15.2434 16.6369 16.6369 16.7609 16.7609 16.8098 16.8098 17.0243 17.0243 17.1741 17.1741 17.1993 17.1993 18.6280 18.6280 k = 0.3534 0.5000 0.3534 ( 2046 PWs) bands (ev): 9.5842 9.5842 9.8026 9.8026 9.9831 9.9831 10.1211 10.1211 12.0334 12.0334 12.1127 12.1127 12.8623 12.8623 13.0888 13.0888 13.2290 13.2290 13.5116 13.5116 13.9354 13.9354 14.0557 14.0557 14.2103 14.2103 14.6444 14.6444 14.9284 14.9284 15.1853 15.1853 16.6244 16.6244 16.7501 16.7501 16.8006 16.8006 17.0163 17.0163 17.1595 17.1595 17.1857 17.1857 18.7749 18.7749 k = 0.3448 0.5000 0.3448 ( 2050 PWs) bands (ev): 9.5852 9.5852 9.8286 9.8286 10.0225 10.0225 10.1837 10.1837 12.0177 12.0177 12.1029 12.1029 12.8215 12.8215 13.0770 13.0770 13.2286 13.2286 13.4617 13.4617 13.8688 13.8688 14.0024 14.0024 14.1952 14.1952 14.5988 14.5988 14.8783 14.8783 15.1386 15.1386 16.6111 16.6111 16.7382 16.7382 16.7904 16.7904 17.0070 17.0070 17.1426 17.1426 17.1707 17.1707 18.9237 18.9237 k = 0.3362 0.5000 0.3362 ( 2050 PWs) bands (ev): 9.5858 9.5858 9.8552 9.8552 10.0635 10.0635 10.2485 10.2485 11.9975 11.9975 12.0922 12.0922 12.7829 12.7829 13.0532 13.0532 13.2359 13.2359 13.3878 13.3878 13.7998 13.7998 13.9784 13.9784 14.1775 14.1775 14.5579 14.5579 14.8284 14.8284 15.1044 15.1044 16.5968 16.5968 16.7251 16.7251 16.7791 16.7791 16.9964 16.9964 17.1238 17.1238 17.1544 17.1544 19.0743 19.0743 k = 0.3276 0.5000 0.3276 ( 2062 PWs) bands (ev): 9.5857 9.5857 9.8823 9.8823 10.1062 10.1062 10.3155 10.3155 11.9718 11.9718 12.0813 12.0813 12.7470 12.7470 13.0171 13.0171 13.2468 13.2468 13.2967 13.2967 13.7395 13.7395 13.9710 13.9710 14.1575 14.1575 14.5208 14.5208 14.7791 14.7791 15.0824 15.0824 16.5818 16.5818 16.7109 16.7109 16.7667 16.7667 16.9845 16.9845 17.1032 17.1032 17.1373 17.1373 19.2264 19.2264 k = 0.3190 0.5000 0.3190 ( 2062 PWs) bands (ev): 9.5848 9.5848 9.9097 9.9097 10.1503 10.1503 10.3842 10.3842 11.9404 11.9404 12.0705 12.0705 12.7138 12.7138 12.9670 12.9670 13.1955 13.1955 13.2613 13.2613 13.6895 13.6895 13.9742 13.9742 14.1361 14.1361 14.4867 14.4867 14.7313 14.7313 15.0716 15.0716 16.5659 16.5659 16.6955 16.6955 16.7533 16.7533 16.9713 16.9713 17.0812 17.0812 17.1199 17.1199 19.3800 19.3800 k = 0.3103 0.5000 0.3103 ( 2058 PWs) bands (ev): 9.5831 9.5831 9.9373 9.9373 10.1958 10.1958 10.4546 10.4546 11.9035 11.9035 12.0600 12.0600 12.6835 12.6835 12.8978 12.8978 13.1046 13.1046 13.2672 13.2672 13.6510 13.6510 13.9838 13.9838 14.1149 14.1149 14.4551 14.4551 14.6865 14.6865 15.0702 15.0702 16.5494 16.5494 16.6790 16.6790 16.7388 16.7388 16.9570 16.9570 17.0580 17.0580 17.1025 17.1025 19.5350 19.5350 k = 0.3017 0.5000 0.3017 ( 2058 PWs) bands (ev): 9.5803 9.5803 9.9647 9.9647 10.2425 10.2425 10.5264 10.5264 11.8619 11.8619 12.0495 12.0495 12.6558 12.6558 12.8065 12.8065 13.0290 13.0290 13.2626 13.2626 13.6273 13.6273 13.9951 13.9951 14.0972 14.0972 14.4249 14.4249 14.6460 14.6460 15.0764 15.0764 16.5321 16.5321 16.6614 16.6614 16.7232 16.7232 16.9414 16.9414 17.0337 17.0337 17.0856 17.0856 19.6912 19.6912 k = 0.2931 0.5000 0.2931 ( 2054 PWs) bands (ev): 9.5764 9.5764 9.9919 9.9919 10.2904 10.2904 10.5992 10.5992 11.8162 11.8162 12.0388 12.0388 12.6296 12.6296 12.6991 12.6991 12.9674 12.9674 13.2434 13.2434 13.6203 13.6203 14.0016 14.0016 14.0890 14.0890 14.3955 14.3955 14.6111 14.6111 15.0888 15.0888 16.5141 16.5141 16.6425 16.6425 16.7066 16.7066 16.9249 16.9249 17.0087 17.0087 17.0696 17.0696 19.8485 19.8485 k = 0.2845 0.5000 0.2845 ( 2050 PWs) bands (ev): 9.5713 9.5713 10.0186 10.0186 10.3392 10.3392 10.6729 10.6729 11.7672 11.7672 12.0278 12.0278 12.5754 12.5754 12.6133 12.6133 12.9138 12.9138 13.2101 13.2101 13.6279 13.6279 13.9986 13.9986 14.0956 14.0956 14.3660 14.3660 14.5828 14.5828 15.1057 15.1057 16.4956 16.4956 16.6224 16.6224 16.6889 16.6889 16.9076 16.9076 16.9833 16.9833 17.0545 17.0545 20.0068 20.0068 k = 0.2759 0.5000 0.2759 ( 2050 PWs) bands (ev): 9.5648 9.5648 10.0446 10.0446 10.3889 10.3889 10.7472 10.7472 11.7157 11.7157 12.0164 12.0164 12.4587 12.4587 12.5891 12.5891 12.8646 12.8646 13.1664 13.1664 13.6441 13.6441 13.9913 13.9913 14.1130 14.1130 14.3365 14.3365 14.5617 14.5617 15.1260 15.1260 16.4764 16.4764 16.6009 16.6009 16.6702 16.6702 16.8896 16.8896 16.9576 16.9576 17.0406 17.0406 20.1659 20.1659 k = 0.2672 0.5000 0.2672 ( 2058 PWs) bands (ev): 9.5567 9.5567 10.0694 10.0694 10.4392 10.4392 10.8217 10.8217 11.6625 11.6625 12.0043 12.0043 12.3397 12.3397 12.5692 12.5692 12.8182 12.8182 13.1162 13.1162 13.6616 13.6616 13.9888 13.9888 14.1336 14.1336 14.3085 14.3085 14.5478 14.5478 15.1486 15.1486 16.4568 16.4568 16.5781 16.5781 16.6508 16.6508 16.8714 16.8714 16.9321 16.9321 17.0278 17.0278 20.3258 20.3258 k = 0.2586 0.5000 0.2586 ( 2058 PWs) bands (ev): 9.5469 9.5469 10.0931 10.0931 10.4900 10.4900 10.8962 10.8962 11.6083 11.6083 11.9916 11.9916 12.2226 12.2226 12.5507 12.5507 12.7744 12.7744 13.0625 13.0625 13.6739 13.6739 13.9973 13.9973 14.1509 14.1509 14.2857 14.2857 14.5408 14.5408 15.1725 15.1725 16.4367 16.4367 16.5540 16.5540 16.6310 16.6310 16.8531 16.8531 16.9069 16.9069 17.0165 17.0165 20.4862 20.4862 k = 0.2500 0.5000 0.2500 ( 2058 PWs) bands (ev): 9.5353 9.5353 10.1151 10.1151 10.5412 10.5412 10.9703 10.9703 11.5539 11.5539 11.9780 11.9780 12.1088 12.1088 12.5329 12.5329 12.7335 12.7335 13.0074 13.0074 13.6770 13.6770 14.0198 14.0198 14.1561 14.1561 14.2758 14.2758 14.5401 14.5401 15.1967 15.1967 16.4163 16.4163 16.5284 16.5284 16.6111 16.6111 16.8351 16.8351 16.8824 16.8824 17.0065 17.0065 20.6472 20.6472 k = 0.2414 0.5000 0.2414 ( 2058 PWs) bands (ev): 9.5218 9.5218 10.1353 10.1353 10.5925 10.5925 11.0434 11.0434 11.5000 11.5000 11.9628 11.9628 12.0000 12.0000 12.5155 12.5155 12.6959 12.6959 12.9522 12.9522 13.6707 13.6707 14.0553 14.0553 14.1443 14.1443 14.2835 14.2835 14.5455 14.5455 15.2204 15.2204 16.3957 16.3957 16.5015 16.5015 16.5916 16.5916 16.8174 16.8174 16.8586 16.8586 16.9980 16.9980 20.8084 20.8084 k = 0.2328 0.5000 0.2328 ( 2050 PWs) bands (ev): 9.5062 9.5062 10.1535 10.1535 10.6436 10.6436 11.1146 11.1146 11.4480 11.4480 11.8918 11.8918 11.9511 11.9511 12.4978 12.4978 12.6623 12.6623 12.8979 12.8979 13.6573 13.6573 14.0963 14.0963 14.1254 14.1254 14.3027 14.3027 14.5569 14.5569 15.2427 15.2427 16.3751 16.3751 16.4732 16.4732 16.5729 16.5729 16.8002 16.8002 16.8357 16.8357 16.9912 16.9912 20.9696 20.9696 k = 0.2241 0.5000 0.2241 ( 2046 PWs) bands (ev): 9.4884 9.4884 10.1693 10.1693 10.6941 10.6941 11.1813 11.1813 11.4005 11.4005 11.7921 11.7921 11.9354 11.9354 12.4793 12.4793 12.6332 12.6332 12.8453 12.8453 13.6392 13.6392 14.0876 14.0876 14.1580 14.1580 14.3263 14.3263 14.5744 14.5744 15.2628 15.2628 16.3546 16.3546 16.4438 16.4438 16.5554 16.5554 16.7836 16.7836 16.8139 16.8139 16.9862 16.9862 21.1307 21.1307 k = 0.2155 0.5000 0.2155 ( 2054 PWs) bands (ev): 9.4685 9.4685 10.1825 10.1825 10.7437 10.7437 11.2344 11.2344 11.3669 11.3669 11.6977 11.6977 11.9199 11.9199 12.4594 12.4594 12.6090 12.6090 12.7953 12.7953 13.6184 13.6184 14.0589 14.0589 14.2122 14.2122 14.3510 14.3510 14.5979 14.5979 15.2799 15.2799 16.3345 16.3345 16.4133 16.4133 16.5394 16.5394 16.7676 16.7676 16.7931 16.7931 16.9831 16.9831 21.2911 21.2911 k = 0.2069 0.5000 0.2069 ( 2054 PWs) bands (ev): 9.4464 9.4464 10.1930 10.1930 10.7914 10.7914 11.2450 11.2450 11.3762 11.3762 11.6095 11.6095 11.9046 11.9046 12.4378 12.4378 12.5898 12.5898 12.7486 12.7486 13.5961 13.5961 14.0298 14.0298 14.2669 14.2669 14.3762 14.3762 14.6275 14.6275 15.2933 15.2933 16.3150 16.3150 16.3821 16.3821 16.5250 16.5250 16.7523 16.7523 16.7739 16.7739 16.9823 16.9823 21.4504 21.4504 k = 0.1983 0.5000 0.1983 ( 2058 PWs) bands (ev): 9.4220 9.4220 10.2007 10.2007 10.8360 10.8360 11.2175 11.2175 11.4213 11.4213 11.5315 11.5315 11.8896 11.8896 12.4142 12.4142 12.5750 12.5750 12.7064 12.7064 13.5730 13.5730 14.0017 14.0017 14.3178 14.3178 14.4032 14.4032 14.6628 14.6628 15.3025 15.3025 16.2963 16.2963 16.3505 16.3505 16.5123 16.5123 16.7379 16.7379 16.7562 16.7562 16.9838 16.9838 21.6075 21.6075 k = 0.1897 0.5000 0.1897 ( 2066 PWs) bands (ev): 9.3955 9.3955 10.2055 10.2055 10.8750 10.8750 11.1846 11.1846 11.4269 11.4269 11.5085 11.5085 11.8755 11.8755 12.3886 12.3886 12.5637 12.5637 12.6697 12.6697 13.5495 13.5495 13.9753 13.9753 14.3599 14.3599 14.4350 14.4350 14.7033 14.7033 15.3070 15.3070 16.2784 16.2784 16.3189 16.3189 16.5012 16.5012 16.7242 16.7242 16.7407 16.7407 16.9880 16.9880 21.7607 21.7607 k = 0.1810 0.5000 0.1810 ( 2066 PWs) bands (ev): 9.3671 9.3671 10.2075 10.2075 10.9039 10.9039 11.1592 11.1592 11.3650 11.3650 11.5593 11.5593 11.8630 11.8630 12.3610 12.3610 12.5547 12.5547 12.6399 12.6399 13.5259 13.5259 13.9509 13.9509 14.3910 14.3910 14.4731 14.4731 14.7481 14.7481 15.3068 15.3068 16.2608 16.2608 16.2883 16.2883 16.4911 16.4911 16.7115 16.7115 16.7281 16.7281 16.9949 16.9949 21.9065 21.9065 k = 0.1724 0.5000 0.1724 ( 2054 PWs) bands (ev): 9.3368 9.3368 10.2066 10.2066 10.9162 10.9162 11.1498 11.1498 11.3010 11.3010 11.6151 11.6151 11.8536 11.8536 12.3315 12.3315 12.5463 12.5463 12.6186 12.6186 13.5024 13.5024 13.9289 13.9289 14.4138 14.4138 14.5139 14.5139 14.7960 14.7960 15.3021 15.3021 16.2413 16.2413 16.2612 16.2612 16.4813 16.4813 16.6994 16.6994 16.7195 16.7195 17.0046 17.0046 22.0377 22.0377 k = 0.1638 0.5000 0.1638 ( 2054 PWs) bands (ev): 9.3049 9.3049 10.2032 10.2032 10.9090 10.9090 11.1587 11.1587 11.2427 11.2427 11.6656 11.6656 11.8499 11.8499 12.3004 12.3004 12.5370 12.5370 12.6068 12.6068 13.4789 13.4789 13.9096 13.9096 14.4322 14.4322 14.5535 14.5535 14.8453 14.8453 15.2935 15.2935 16.2159 16.2159 16.2415 16.2415 16.4710 16.4710 16.6876 16.6876 16.7162 16.7162 17.0172 17.0172 22.1444 22.1444 k = 0.1552 0.5000 0.1552 ( 2058 PWs) bands (ev): 9.2718 9.2718 10.1972 10.1972 10.8869 10.8869 11.1672 11.1672 11.2051 11.2051 11.7044 11.7044 11.8572 11.8572 12.2681 12.2681 12.5271 12.5271 12.6037 12.6037 13.4555 13.4555 13.8930 13.8930 14.4481 14.4481 14.5899 14.5899 14.8937 14.8937 15.2823 15.2823 16.1869 16.1869 16.2271 16.2271 16.4592 16.4592 16.6762 16.6762 16.7192 16.7192 17.0324 17.0324 22.2250 22.2250 k = 0.1466 0.5000 0.1466 ( 2060 PWs) bands (ev): 9.2377 9.2377 10.1892 10.1892 10.8571 10.8571 11.1290 11.1290 11.2276 11.2276 11.7260 11.7260 11.8803 11.8803 12.2352 12.2352 12.5179 12.5179 12.6072 12.6072 13.4323 13.4323 13.8795 13.8795 14.4626 14.4626 14.6223 14.6223 14.9382 14.9382 15.2711 15.2711 16.1574 16.1574 16.2147 16.2147 16.4451 16.4451 16.6653 16.6653 16.7290 16.7290 17.0502 17.0502 22.2902 22.2902 k = 0.1379 0.5000 0.1379 ( 2060 PWs) bands (ev): 9.2030 9.2030 10.1792 10.1792 10.8241 10.8241 11.0852 11.0852 11.2640 11.2640 11.7325 11.7325 11.9169 11.9169 12.2025 12.2025 12.5104 12.5104 12.6155 12.6155 13.4092 13.4092 13.8692 13.8692 14.4760 14.4760 14.6505 14.6505 14.9745 14.9745 15.2638 15.2638 16.1284 16.1284 16.2033 16.2033 16.4284 16.4284 16.6550 16.6550 16.7459 16.7459 17.0703 17.0703 22.3504 22.3504 k = 0.1293 0.5000 0.1293 ( 2052 PWs) bands (ev): 9.1681 9.1681 10.1678 10.1678 10.7904 10.7904 11.0449 11.0449 11.3025 11.3025 11.7311 11.7311 11.9595 11.9595 12.1707 12.1707 12.5049 12.5049 12.6275 12.6275 13.3863 13.3863 13.8621 13.8621 14.4887 14.4887 14.6744 14.6744 14.9970 14.9970 15.2659 15.2659 16.1004 16.1004 16.1927 16.1927 16.4090 16.4090 16.6454 16.6454 16.7694 16.7694 17.0923 17.0923 22.4109 22.4109 k = 0.1207 0.5000 0.1207 ( 2052 PWs) bands (ev): 9.1333 9.1333 10.1551 10.1551 10.7572 10.7572 11.0086 11.0086 11.3409 11.3409 11.7264 11.7264 12.0029 12.0029 12.1404 12.1404 12.5012 12.5012 12.6425 12.6425 13.3636 13.3636 13.8582 13.8582 14.5006 14.5006 14.6941 14.6941 15.0015 15.0015 15.2817 15.2817 16.0734 16.0734 16.1824 16.1824 16.3872 16.3872 16.6362 16.6362 16.7986 16.7986 17.1157 17.1157 22.4744 22.4744 k = 0.1121 0.5000 0.1121 ( 2056 PWs) bands (ev): 9.0991 9.0991 10.1416 10.1416 10.7253 10.7253 10.9761 10.9761 11.3779 11.3779 11.7208 11.7208 12.0434 12.0434 12.1132 12.1132 12.4992 12.4992 12.6600 12.6600 13.3411 13.3411 13.8576 13.8576 14.5118 14.5118 14.7099 14.7099 14.9890 14.9890 15.3106 15.3106 16.0476 16.0476 16.1723 16.1723 16.3632 16.3632 16.6277 16.6277 16.8327 16.8327 17.1401 17.1401 22.5420 22.5420 k = 0.1034 0.5000 0.1034 ( 2048 PWs) bands (ev): 9.0659 9.0659 10.1277 10.1277 10.6950 10.6950 10.9474 10.9474 11.4129 11.4129 11.7154 11.7154 12.0673 12.0673 12.1021 12.1021 12.4986 12.4986 12.6797 12.6797 13.3190 13.3190 13.8602 13.8602 14.5223 14.5223 14.7220 14.7220 14.9644 14.9644 15.3484 15.3484 16.0233 16.0233 16.1624 16.1624 16.3374 16.3374 16.6198 16.6198 16.8705 16.8705 17.1651 17.1651 22.6147 22.6147 k = 0.0948 0.5000 0.0948 ( 2048 PWs) bands (ev): 9.0339 9.0339 10.1136 10.1136 10.6666 10.6666 10.9220 10.9220 11.4450 11.4450 11.7108 11.7108 12.0522 12.0522 12.1289 12.1289 12.4991 12.4991 12.7014 12.7014 13.2971 13.2971 13.8659 13.8659 14.5321 14.5321 14.7306 14.7306 14.9323 14.9323 15.3912 15.3912 16.0005 16.0005 16.1526 16.1526 16.3101 16.3101 16.6124 16.6124 16.9106 16.9106 17.1901 17.1901 22.6925 22.6925 k = 0.0862 0.5000 0.0862 ( 2052 PWs) bands (ev): 9.0036 9.0036 10.0996 10.0996 10.6403 10.6403 10.8996 10.8996 11.4739 11.4739 11.7072 11.7072 12.0314 12.0314 12.1604 12.1604 12.5006 12.5006 12.7246 12.7246 13.2757 13.2757 13.8744 13.8744 14.5411 14.5411 14.7362 14.7362 14.8959 14.8959 15.4363 15.4363 15.9792 15.9792 16.1427 16.1427 16.2815 16.2815 16.6056 16.6056 16.9520 16.9520 17.2147 17.2147 22.7757 22.7758 k = 0.0776 0.5000 0.0776 ( 2052 PWs) bands (ev): 8.9753 8.9753 10.0862 10.0862 10.6163 10.6163 10.8802 10.8802 11.4990 11.4990 11.7051 11.7051 12.0124 12.0124 12.1890 12.1890 12.5026 12.5026 12.7491 12.7491 13.2546 13.2546 13.8855 13.8855 14.5492 14.5492 14.7393 14.7393 14.8573 14.8573 15.4825 15.4825 15.9597 15.9597 16.1327 16.1327 16.2521 16.2521 16.5995 16.5995 16.9934 16.9934 17.2383 17.2383 22.8641 22.8641 k = 0.0690 0.5000 0.0690 ( 2052 PWs) bands (ev): 8.9491 8.9491 10.0734 10.0734 10.5946 10.5946 10.8634 10.8634 11.5199 11.5199 11.7042 11.7042 11.9961 11.9961 12.2139 12.2139 12.5051 12.5051 12.7745 12.7745 13.2340 13.2340 13.8988 13.8988 14.5562 14.5562 14.7402 14.7402 14.8181 14.8181 15.5288 15.5288 15.9420 15.9420 16.1221 16.1221 16.2225 16.2225 16.5940 16.5940 17.0337 17.0337 17.2606 17.2606 22.9569 22.9569 k = 0.0603 0.5000 0.0603 ( 2056 PWs) bands (ev): 8.9255 8.9255 10.0616 10.0616 10.5752 10.5752 10.8491 10.8491 11.5367 11.5367 11.7046 11.7046 11.9829 11.9829 12.2350 12.2350 12.5077 12.5077 12.8003 12.8003 13.2139 13.2139 13.9139 13.9139 14.5621 14.5621 14.7395 14.7395 14.7797 14.7797 15.5749 15.5749 15.9263 15.9263 16.1102 16.1102 16.1937 16.1937 16.5891 16.5891 17.0718 17.0718 17.2812 17.2812 23.0533 23.0533 k = 0.0517 0.5000 0.0517 ( 2056 PWs) bands (ev): 8.9046 8.9046 10.0510 10.0510 10.5584 10.5584 10.8370 10.8370 11.5496 11.5496 11.7059 11.7059 11.9727 11.9727 12.2526 12.2526 12.5104 12.5104 12.8261 12.8261 13.1944 13.1944 13.9300 13.9300 14.5665 14.5665 14.7370 14.7370 14.7441 14.7441 15.6203 15.6203 15.9127 15.9127 16.0953 16.0953 16.1675 16.1675 16.5848 16.5848 17.1069 17.1069 17.2997 17.2997 23.1517 23.1517 k = 0.0431 0.5000 0.0431 ( 2056 PWs) bands (ev): 8.8866 8.8866 10.0417 10.0417 10.5441 10.5441 10.8270 10.8270 11.5590 11.5590 11.7075 11.7075 11.9654 11.9654 12.2668 12.2668 12.5128 12.5128 12.8511 12.8511 13.1757 13.1757 13.9465 13.9465 14.5691 14.5691 14.7102 14.7102 14.7357 14.7357 15.6647 15.6647 15.9013 15.9013 16.0748 16.0748 16.1468 16.1468 16.5812 16.5812 17.1380 17.1380 17.3159 17.3159 23.2496 23.2496 k = 0.0345 0.5000 0.0345 ( 2060 PWs) bands (ev): 8.8717 8.8717 10.0339 10.0339 10.5324 10.5324 10.8190 10.8190 11.5656 11.5656 11.7090 11.7090 11.9605 11.9605 12.2780 12.2780 12.5148 12.5148 12.8745 12.8745 13.1581 13.1581 13.9624 13.9624 14.5695 14.5695 14.6826 14.6826 14.7330 14.7330 15.7076 15.7076 15.8927 15.8927 16.0481 16.0481 16.1326 16.1326 16.5783 16.5783 17.1644 17.1644 17.3293 17.3293 23.3434 23.3434 k = 0.0259 0.5000 0.0259 ( 2056 PWs) bands (ev): 8.8599 8.8599 10.0277 10.0277 10.5232 10.5232 10.8129 10.8129 11.5701 11.5701 11.7103 11.7103 11.9576 11.9576 12.2863 12.2863 12.5165 12.5165 12.8954 12.8954 13.1423 13.1423 13.9765 13.9765 14.5674 14.5674 14.6616 14.6616 14.7305 14.7305 15.7480 15.7480 15.8874 15.8874 16.0167 16.0167 16.1236 16.1236 16.5760 16.5760 17.1856 17.1856 17.3401 17.3401 23.4281 23.4281 k = 0.0172 0.5000 0.0172 ( 2056 PWs) bands (ev): 8.8515 8.8515 10.0233 10.0233 10.5166 10.5166 10.8086 10.8086 11.5729 11.5729 11.7111 11.7111 11.9561 11.9561 12.2921 12.2921 12.5177 12.5177 12.9124 12.9124 13.1292 13.1292 13.9878 13.9878 14.5633 14.5633 14.6478 14.6478 14.7285 14.7285 15.7836 15.7836 15.8871 15.8871 15.9830 15.9830 16.1181 16.1181 16.5743 16.5743 17.2010 17.2010 17.3478 17.3478 23.4970 23.4970 k = 0.0086 0.5000 0.0086 ( 2048 PWs) bands (ev): 8.8464 8.8464 10.0205 10.0205 10.5127 10.5127 10.8060 10.8060 11.5745 11.5745 11.7116 11.7116 11.9554 11.9554 12.2956 12.2956 12.5185 12.5185 12.9238 12.9238 13.1203 13.1203 13.9952 13.9952 14.5594 14.5594 14.6405 14.6405 14.7272 14.7272 15.8092 15.8092 15.8960 15.8960 15.9493 15.9493 16.1151 16.1151 16.5734 16.5734 17.2105 17.2105 17.3525 17.3525 23.5427 23.5427 k = 0.0000 0.5000-0.0000 ( 2040 PWs) bands (ev): 8.8447 8.8447 10.0196 10.0196 10.5114 10.5114 10.8052 10.8052 11.5750 11.5750 11.7118 11.7118 11.9552 11.9552 12.2967 12.2967 12.5188 12.5188 12.9278 12.9278 13.1172 13.1172 13.9977 13.9977 14.5577 14.5577 14.6383 14.6383 14.7268 14.7268 15.8184 15.8184 15.9137 15.9137 15.9228 15.9228 16.1141 16.1141 16.5731 16.5731 17.2136 17.2136 17.3542 17.3542 23.5587 23.5587 k = 0.5000 0.5000-0.0000 ( 2048 PWs) bands (ev): 10.4383 10.4383 10.5374 10.5374 11.3538 11.3538 11.4242 11.4242 11.5540 11.5540 11.5781 11.5781 12.0699 12.0699 12.2347 12.2347 12.2670 12.2670 12.7154 12.7154 13.2977 13.2977 13.8714 13.8714 13.9355 13.9355 14.0233 14.0233 14.5810 14.5810 14.9498 14.9498 15.1367 15.1367 15.9981 15.9981 16.1015 16.1015 16.1252 16.1252 18.1389 18.1389 18.6830 18.6830 18.7060 18.7060 k = 0.5000 0.5000 0.0122 ( 2048 PWs) bands (ev): 10.4361 10.4361 10.5351 10.5351 11.3323 11.3323 11.3876 11.3876 11.5893 11.5893 11.5983 11.5983 12.0713 12.0713 12.2385 12.2385 12.2695 12.2695 12.7189 12.7189 13.2995 13.2995 13.8719 13.8719 13.9302 13.9302 14.0248 14.0248 14.5800 14.5800 14.9561 14.9561 15.1338 15.1338 16.0013 16.0013 16.1027 16.1027 16.1267 16.1267 18.1385 18.1385 18.6823 18.6823 18.7038 18.7038 k = 0.5000 0.5000 0.0244 ( 2048 PWs) bands (ev): 10.4298 10.4298 10.5283 10.5283 11.2819 11.2819 11.3196 11.3196 11.6444 11.6444 11.6528 11.6528 12.0761 12.0761 12.2498 12.2498 12.2774 12.2774 12.7292 12.7292 13.3049 13.3049 13.8733 13.8733 13.9154 13.9154 14.0283 14.0283 14.5775 14.5775 14.9745 14.9745 15.1250 15.1250 16.0108 16.0108 16.1066 16.1066 16.1312 16.1312 18.1376 18.1376 18.6799 18.6799 18.6978 18.6978 k = 0.5000 0.5000 0.0366 ( 2056 PWs) bands (ev): 10.4193 10.4193 10.5170 10.5170 11.2197 11.2197 11.2451 11.2451 11.6990 11.6990 11.7186 11.7186 12.0853 12.0853 12.2682 12.2682 12.2910 12.2910 12.7460 12.7460 13.3138 13.3138 13.8757 13.8757 13.8934 13.8934 14.0322 14.0322 14.5745 14.5745 15.0036 15.0036 15.1109 15.1109 16.0259 16.0259 16.1130 16.1130 16.1387 16.1387 18.1360 18.1360 18.6760 18.6760 18.6887 18.6887 k = 0.5000 0.5000 0.0488 ( 2044 PWs) bands (ev): 10.4050 10.4050 10.5016 10.5016 11.1528 11.1528 11.1690 11.1690 11.7543 11.7543 11.7800 11.7800 12.1011 12.1011 12.2933 12.2933 12.3110 12.3110 12.7691 12.7691 13.3264 13.3264 13.8659 13.8659 13.8793 13.8793 14.0355 14.0355 14.5722 14.5722 15.0414 15.0414 15.0921 15.0921 16.0463 16.0463 16.1221 16.1221 16.1492 16.1492 18.1337 18.1337 18.6705 18.6705 18.6771 18.6771 k = 0.5000 0.5000 0.0610 ( 2044 PWs) bands (ev): 10.3872 10.3872 10.4823 10.4823 11.0840 11.0840 11.0927 11.0927 11.8068 11.8068 11.8332 11.8332 12.1254 12.1254 12.3249 12.3249 12.3382 12.3382 12.7979 12.7979 13.3426 13.3426 13.8344 13.8344 13.8840 13.8840 14.0379 14.0379 14.5715 14.5715 15.0692 15.0692 15.0861 15.0861 16.0708 16.0708 16.1339 16.1339 16.1624 16.1624 18.1307 18.1307 18.6631 18.6631 18.6633 18.6633 k = 0.5000 0.5000 0.0732 ( 2036 PWs) bands (ev): 10.3660 10.3660 10.4595 10.4595 11.0146 11.0146 11.0169 11.0169 11.8545 11.8545 11.8758 11.8758 12.1598 12.1598 12.3627 12.3627 12.3730 12.3730 12.8317 12.8317 13.3625 13.3625 13.7997 13.7997 13.8901 13.8901 14.0397 14.0397 14.5730 14.5730 15.0430 15.0430 15.1364 15.1364 16.0984 16.0984 16.1488 16.1488 16.1784 16.1784 18.1270 18.1270 18.6470 18.6470 18.6544 18.6544 k = 0.5000 0.5000 0.0854 ( 2036 PWs) bands (ev): 10.3420 10.3420 10.4336 10.4336 10.9419 10.9419 10.9454 10.9454 11.8965 11.8965 11.9077 11.9077 12.2034 12.2034 12.4066 12.4066 12.4155 12.4155 12.8700 12.8700 13.3862 13.3862 13.7629 13.7629 13.8978 13.8978 14.0412 14.0412 14.5771 14.5771 15.0141 15.0141 15.1909 15.1909 16.1275 16.1275 16.1674 16.1674 16.1968 16.1968 18.1225 18.1225 18.6288 18.6288 18.6437 18.6437 k = 0.5000 0.5000 0.0976 ( 2044 PWs) bands (ev): 10.3155 10.3155 10.4049 10.4049 10.8680 10.8680 10.8768 10.8768 11.9311 11.9311 11.9326 11.9326 12.2531 12.2531 12.4565 12.4565 12.4651 12.4651 12.9121 12.9121 13.4138 13.4138 13.7247 13.7247 13.9073 13.9073 14.0429 14.0429 14.5838 14.5838 14.9833 14.9833 15.2488 15.2488 16.1557 16.1557 16.1913 16.1913 16.2175 16.2175 18.1172 18.1172 18.6084 18.6084 18.6311 18.6311 k = 0.5000 0.5000 0.1098 ( 2052 PWs) bands (ev): 10.2869 10.2869 10.3739 10.3739 10.7954 10.7954 10.8090 10.8090 11.9486 11.9486 11.9635 11.9635 12.3056 12.3056 12.5119 12.5119 12.5208 12.5208 12.9574 12.9574 13.4453 13.4453 13.6859 13.6859 13.9189 13.9189 14.0453 14.0453 14.5933 14.5933 14.9510 14.9510 15.3093 15.3093 16.1814 16.1814 16.2216 16.2216 16.2403 16.2403 18.1109 18.1109 18.5859 18.5859 18.6166 18.6166 k = 0.5000 0.5000 0.1220 ( 2052 PWs) bands (ev): 10.2565 10.2565 10.3410 10.3410 10.7241 10.7241 10.7424 10.7424 11.9626 11.9626 11.9898 11.9898 12.3587 12.3587 12.5721 12.5721 12.5809 12.5809 13.0052 13.0052 13.4808 13.4808 13.6471 13.6471 13.9327 13.9327 14.0492 14.0492 14.6056 14.6056 14.9178 14.9178 15.3716 15.3716 16.2057 16.2057 16.2567 16.2567 16.2651 16.2651 18.1037 18.1037 18.5612 18.5612 18.6000 18.6000 k = 0.5000 0.5000 0.1341 ( 2048 PWs) bands (ev): 10.2247 10.2247 10.3065 10.3065 10.6545 10.6545 10.6770 10.6770 11.9744 11.9744 12.0125 12.0125 12.4112 12.4112 12.6357 12.6357 12.6438 12.6438 13.0550 13.0550 13.5207 13.5207 13.6089 13.6089 13.9492 13.9492 14.0551 14.0551 14.6208 14.6208 14.8840 14.8840 15.4354 15.4354 16.2299 16.2299 16.2916 16.2916 16.2947 16.2947 18.0954 18.0954 18.5341 18.5341 18.5812 18.5812 k = 0.5000 0.5000 0.1463 ( 2048 PWs) bands (ev): 10.1917 10.1917 10.2708 10.2708 10.5864 10.5864 10.6131 10.6131 11.9849 11.9849 12.0322 12.0322 12.4627 12.4627 12.7012 12.7012 12.7077 12.7077 13.1064 13.1064 13.5649 13.5649 13.5720 13.5720 13.9687 13.9687 14.0638 14.0638 14.6389 14.6389 14.8501 14.8501 15.5002 15.5002 16.2547 16.2547 16.3197 16.3197 16.3341 16.3341 18.0859 18.0859 18.5048 18.5048 18.5601 18.5601 k = 0.5000 0.5000 0.1585 ( 2052 PWs) bands (ev): 10.1580 10.1580 10.2342 10.2342 10.5201 10.5201 10.5507 10.5507 11.9945 11.9945 12.0496 12.0496 12.5132 12.5132 12.7671 12.7671 12.7708 12.7708 13.1588 13.1588 13.5370 13.5370 13.6137 13.6137 13.9914 13.9914 14.0760 14.0760 14.6599 14.6599 14.8163 14.8163 15.5656 15.5656 16.2804 16.2804 16.3490 16.3490 16.3744 16.3744 18.0752 18.0752 18.4730 18.4730 18.5365 18.5365 k = 0.5000 0.5000 0.1707 ( 2052 PWs) bands (ev): 10.1238 10.1238 10.1971 10.1971 10.4556 10.4556 10.4900 10.4900 12.0035 12.0035 12.0652 12.0652 12.5628 12.5628 12.8314 12.8314 12.8322 12.8322 13.2121 13.2121 13.5046 13.5046 13.6671 13.6671 14.0176 14.0176 14.0923 14.0923 14.6842 14.6842 14.7830 14.7830 15.6313 15.6313 16.3069 16.3069 16.3795 16.3795 16.4152 16.4152 18.0631 18.0631 18.4387 18.4388 18.5103 18.5103 k = 0.5000 0.5000 0.1829 ( 2052 PWs) bands (ev): 10.0893 10.0893 10.1597 10.1597 10.3929 10.3929 10.4309 10.4309 12.0121 12.0121 12.0791 12.0791 12.6115 12.6115 12.8876 12.8876 12.8953 12.8953 13.2657 13.2657 13.4759 13.4759 13.7253 13.7253 14.0477 14.0477 14.1134 14.1134 14.7116 14.7116 14.7504 14.7504 15.6969 15.6969 16.3342 16.3342 16.4108 16.4108 16.4560 16.4560 18.0495 18.0495 18.4019 18.4020 18.4813 18.4813 k = 0.5000 0.5000 0.1951 ( 2052 PWs) bands (ev): 10.0548 10.0548 10.1223 10.1223 10.3323 10.3323 10.3737 10.3737 12.0203 12.0203 12.0916 12.0916 12.6595 12.6595 12.9376 12.9376 12.9556 12.9556 13.3180 13.3180 13.4530 13.4530 13.7883 13.7883 14.0819 14.0819 14.1398 14.1398 14.7188 14.7188 14.7426 14.7426 15.7622 15.7622 16.3622 16.3622 16.4428 16.4428 16.4966 16.4966 18.0342 18.0342 18.3625 18.3626 18.4495 18.4495 k = 0.5000 0.5000 0.2073 ( 2044 PWs) bands (ev): 10.0204 10.0204 10.0850 10.0850 10.2736 10.2736 10.3183 10.3183 12.0281 12.0281 12.1027 12.1027 12.7066 12.7066 12.9799 12.9799 13.0124 13.0124 13.3616 13.3616 13.4442 13.4442 13.8558 13.8558 14.1202 14.1202 14.1720 14.1720 14.6888 14.6888 14.7773 14.7773 15.8270 15.8270 16.3908 16.3908 16.4753 16.4753 16.5369 16.5369 18.0172 18.0172 18.3205 18.3205 18.4145 18.4145 k = 0.5000 0.5000 0.2195 ( 2044 PWs) bands (ev): 9.9864 9.9864 10.0481 10.0481 10.2170 10.2170 10.2648 10.2648 12.0355 12.0355 12.1124 12.1124 12.7527 12.7527 13.0135 13.0135 13.0654 13.0654 13.3759 13.3759 13.4704 13.4704 13.9274 13.9274 14.1629 14.1629 14.2100 14.2100 14.6606 14.6606 14.8160 14.8160 15.8910 15.8910 16.4197 16.4197 16.5079 16.5079 16.5766 16.5766 17.9982 17.9982 18.2757 18.2757 18.3763 18.3763 k = 0.5000 0.5000 0.2317 ( 2044 PWs) bands (ev): 9.9529 9.9529 10.0118 10.0118 10.1625 10.1625 10.2132 10.2132 12.0424 12.0424 12.1208 12.1208 12.7979 12.7979 13.0380 13.0380 13.1144 13.1144 13.3698 13.3698 13.5225 13.5225 14.0023 14.0023 14.2099 14.2099 14.2537 14.2537 14.6350 14.6350 14.8590 14.8590 15.9540 15.9540 16.4488 16.4488 16.5406 16.5406 16.6155 16.6155 17.9772 17.9772 18.2282 18.2282 18.3348 18.3348 k = 0.5000 0.5000 0.2439 ( 2052 PWs) bands (ev): 9.9201 9.9201 9.9762 9.9762 10.1101 10.1101 10.1637 10.1637 12.0489 12.0489 12.1278 12.1278 12.8419 12.8419 13.0542 13.0542 13.1594 13.1594 13.3614 13.3614 13.5814 13.5814 14.0793 14.0793 14.2611 14.2611 14.3031 14.3031 14.6130 14.6130 14.9064 14.9064 16.0157 16.0157 16.4778 16.4778 16.5731 16.5731 16.6535 16.6535 17.9538 17.9538 18.1780 18.1780 18.2897 18.2897 k = 0.5000 0.5000 0.2561 ( 2052 PWs) bands (ev): 9.8880 9.8880 9.9416 9.9416 10.0600 10.0600 10.1163 10.1163 12.0549 12.0549 12.1334 12.1334 12.8847 12.8847 13.0632 13.0632 13.2007 13.2007 13.3545 13.3545 13.6419 13.6419 14.1559 14.1559 14.3169 14.3169 14.3578 14.3578 14.5967 14.5967 14.9585 14.9585 16.0760 16.0760 16.5067 16.5067 16.6053 16.6053 16.6904 16.6904 17.9282 17.9282 18.1249 18.1249 18.2410 18.2410 k = 0.5000 0.5000 0.2683 ( 2052 PWs) bands (ev): 9.8569 9.8569 9.9079 9.9079 10.0121 10.0121 10.0709 10.0709 12.0605 12.0605 12.1376 12.1376 12.9262 12.9262 13.0666 13.0666 13.2384 13.2384 13.3496 13.3496 13.7019 13.7019 14.2273 14.2273 14.3779 14.3779 14.4176 14.4176 14.5894 14.5894 15.0153 15.0153 16.1347 16.1347 16.5352 16.5352 16.6369 16.6369 16.7261 16.7261 17.8999 17.8999 18.0692 18.0692 18.1886 18.1886 k = 0.5000 0.5000 0.2805 ( 2056 PWs) bands (ev): 9.8268 9.8268 9.8754 9.8754 9.9665 9.9665 10.0277 10.0277 12.0655 12.0655 12.1404 12.1404 12.9662 12.9662 13.0662 13.0662 13.2728 13.2728 13.3461 13.3461 13.7602 13.7602 14.2856 14.2856 14.4462 14.4462 14.4820 14.4820 14.5966 14.5966 15.0769 15.0769 16.1915 16.1915 16.5632 16.5632 16.6677 16.6677 16.7605 16.7605 17.8691 17.8691 18.0107 18.0107 18.1324 18.1324 k = 0.5000 0.5000 0.2927 ( 2056 PWs) bands (ev): 9.7978 9.7978 9.8441 9.8441 9.9233 9.9233 9.9867 9.9867 12.0701 12.0701 12.1419 12.1419 13.0046 13.0046 13.0633 13.0633 13.3043 13.3043 13.3436 13.3436 13.8158 13.8158 14.3227 14.3227 14.5235 14.5235 14.5509 14.5509 14.6237 14.6237 15.1433 15.1433 16.2463 16.2463 16.5905 16.5905 16.6976 16.6976 16.7934 16.7934 17.8354 17.8354 17.9497 17.9497 18.0725 18.0725 k = 0.5000 0.5000 0.3049 ( 2048 PWs) bands (ev): 9.7700 9.7700 9.8142 9.8142 9.8824 9.8824 9.9478 9.9478 12.0741 12.0741 12.1421 12.1421 13.0414 13.0414 13.0590 13.0590 13.3332 13.3332 13.3418 13.3418 13.8681 13.8681 14.3384 14.3384 14.6088 14.6088 14.6238 14.6238 14.6718 14.6718 15.2142 15.2142 16.2989 16.2989 16.6169 16.6169 16.7264 16.7264 16.8247 16.8247 17.7989 17.7989 17.8863 17.8863 18.0090 18.0090 k = 0.5000 0.5000 0.3171 ( 2056 PWs) bands (ev): 9.7435 9.7435 9.7857 9.7857 9.8439 9.8439 9.9112 9.9112 12.0777 12.0777 12.1412 12.1412 13.0540 13.0540 13.0764 13.0764 13.3403 13.3403 13.3596 13.3596 13.9166 13.9166 14.3394 14.3394 14.6979 14.6979 14.7005 14.7005 14.7371 14.7371 15.2894 15.2894 16.3492 16.3492 16.6420 16.6420 16.7536 16.7536 16.8542 16.8542 17.7593 17.7593 17.8205 17.8205 17.9419 17.9419 k = 0.5000 0.5000 0.3293 ( 2048 PWs) bands (ev): 9.7183 9.7183 9.7588 9.7588 9.8078 9.8078 9.8768 9.8768 12.0808 12.0808 12.1393 12.1393 13.0489 13.0489 13.1095 13.1095 13.3392 13.3392 13.3838 13.3838 13.9611 13.9611 14.3327 14.3327 14.7806 14.7806 14.7849 14.7849 14.8181 14.8181 15.3686 15.3686 16.3968 16.3968 16.6659 16.6659 16.7793 16.7793 16.8817 16.8817 17.7169 17.7169 17.7529 17.7529 17.8716 17.8716 k = 0.5000 0.5000 0.3415 ( 2048 PWs) bands (ev): 9.6945 9.6945 9.7334 9.7334 9.7743 9.7743 9.8447 9.8447 12.0835 12.0835 12.1364 12.1364 13.0440 13.0440 13.1407 13.1407 13.3382 13.3382 13.4061 13.4061 14.0015 14.0015 14.3222 14.3222 14.8637 14.8637 14.8685 14.8685 14.9113 14.9113 15.4511 15.4511 16.4417 16.4417 16.6881 16.6881 16.8030 16.8030 16.9070 16.9070 17.6715 17.6715 17.6834 17.6834 17.7985 17.7985 k = 0.5000 0.5000 0.3537 ( 2052 PWs) bands (ev): 9.6721 9.6721 9.7096 9.7096 9.7432 9.7432 9.8149 9.8149 12.0857 12.0857 12.1329 12.1329 13.0394 13.0394 13.1698 13.1698 13.3376 13.3376 13.4264 13.4264 14.0379 14.0379 14.3102 14.3102 14.9493 14.9493 14.9525 14.9525 15.0098 15.0098 15.5366 15.5366 16.4836 16.4836 16.7084 16.7084 16.8245 16.8245 16.9299 16.9299 17.6128 17.6128 17.6231 17.6231 17.7232 17.7232 k = 0.5000 0.5000 0.3659 ( 2052 PWs) bands (ev): 9.6512 9.6512 9.6876 9.6876 9.7147 9.7147 9.7874 9.7874 12.0877 12.0877 12.1289 12.1289 13.0352 13.0352 13.1968 13.1968 13.3371 13.3371 13.4451 13.4451 14.0703 14.0703 14.2979 14.2979 15.0368 15.0368 15.0385 15.0385 15.1101 15.1101 15.6246 15.6246 16.5223 16.5223 16.7266 16.7266 16.8433 16.8433 16.9500 16.9500 17.5417 17.5417 17.5717 17.5717 17.6469 17.6469 k = 0.5000 0.5000 0.3780 ( 2052 PWs) bands (ev): 9.6319 9.6319 9.6673 9.6673 9.6887 9.6887 9.7623 9.7623 12.0892 12.0892 12.1246 12.1246 13.0314 13.0314 13.2215 13.2215 13.3369 13.3369 13.4620 13.4620 14.0991 14.0991 14.2859 14.2859 15.1257 15.1257 15.1260 15.1260 15.2107 15.2107 15.7144 15.7144 16.5575 16.5575 16.7422 16.7422 16.8589 16.8589 16.9668 16.9668 17.4709 17.4709 17.5164 17.5164 17.5718 17.5718 k = 0.5000 0.5000 0.3902 ( 2052 PWs) bands (ev): 9.6141 9.6141 9.6488 9.6488 9.6653 9.6653 9.7395 9.7395 12.0905 12.0905 12.1200 12.1200 13.0281 13.0281 13.2441 13.2441 13.3370 13.3370 13.4773 13.4773 14.1244 14.1244 14.2747 14.2747 15.2146 15.2146 15.2153 15.2153 15.3105 15.3105 15.8054 15.8054 16.5890 16.5890 16.7549 16.7549 16.8706 16.8706 16.9794 16.9794 17.4017 17.4017 17.4551 17.4551 17.5021 17.5021 k = 0.5000 0.5000 0.4024 ( 2060 PWs) bands (ev): 9.5978 9.5978 9.6322 9.6322 9.6445 9.6445 9.7191 9.7191 12.0915 12.0915 12.1155 12.1155 13.0251 13.0251 13.2643 13.2643 13.3372 13.3372 13.4911 13.4911 14.1464 14.1464 14.2643 14.2643 15.3034 15.3034 15.3046 15.3046 15.4087 15.4087 15.8968 15.8968 16.6164 16.6164 16.7640 16.7640 16.8774 16.8774 16.9868 16.9868 17.3359 17.3359 17.3871 17.3871 17.4415 17.4415 k = 0.5000 0.5000 0.4146 ( 2056 PWs) bands (ev): 9.5833 9.5833 9.6174 9.6174 9.6264 9.6264 9.7010 9.7010 12.0924 12.0924 12.1111 12.1111 13.0225 13.0225 13.2822 13.2822 13.3377 13.3377 13.5032 13.5032 14.1653 14.1653 14.2550 14.2550 15.3914 15.3914 15.3927 15.3927 15.5042 15.5042 15.9878 15.9878 16.6389 16.6389 16.7691 16.7691 16.8782 16.8782 16.9870 16.9870 17.2759 17.2759 17.3179 17.3179 17.3887 17.3887 k = 0.5000 0.5000 0.4268 ( 2056 PWs) bands (ev): 9.5704 9.5704 9.6046 9.6046 9.6108 9.6108 9.6854 9.6854 12.0930 12.0930 12.1070 12.1070 13.0203 13.0203 13.2977 13.2977 13.3382 13.3382 13.5138 13.5138 14.1814 14.1814 14.2469 14.2469 15.4772 15.4772 15.4784 15.4784 15.5956 15.5956 16.0772 16.0772 16.6558 16.6558 16.7694 16.7694 16.8722 16.8722 16.9773 16.9773 17.2242 17.2242 17.2542 17.2542 17.3426 17.3426 k = 0.5000 0.5000 0.4390 ( 2040 PWs) bands (ev): 9.5594 9.5594 9.5937 9.5937 9.5978 9.5978 9.6722 9.6722 12.0935 12.0935 12.1034 12.1034 13.0185 13.0185 13.3109 13.3109 13.3389 13.3389 13.5228 13.5228 14.1947 14.1947 14.2400 14.2400 15.5591 15.5591 15.5599 15.5599 15.6814 15.6814 16.1635 16.1635 16.6656 16.6656 16.7645 16.7645 16.8597 16.8597 16.9552 16.9552 17.1833 17.1833 17.2016 17.2016 17.3041 17.3041 k = 0.5000 0.5000 0.4512 ( 2024 PWs) bands (ev): 9.5502 9.5502 9.5847 9.5847 9.5872 9.5872 9.6613 9.6613 12.0938 12.0938 12.1003 12.1003 13.0169 13.0169 13.3217 13.3217 13.3395 13.3395 13.5302 13.5302 14.2055 14.2055 14.2344 14.2344 15.6346 15.6346 15.6351 15.6351 15.7593 15.7593 16.2444 16.2444 16.6669 16.6669 16.7543 16.7543 16.8438 16.8438 16.9214 16.9214 17.1533 17.1533 17.1626 17.1626 17.2744 17.2744 k = 0.5000 0.5000 0.4634 ( 2008 PWs) bands (ev): 9.5430 9.5430 9.5778 9.5778 9.5791 9.5791 9.6529 9.6529 12.0941 12.0941 12.0977 12.0977 13.0158 13.0158 13.3301 13.3301 13.3401 13.3401 13.5360 13.5360 14.2138 14.2138 14.2300 14.2300 15.7006 15.7006 15.7007 15.7007 15.8265 15.8265 16.3166 16.3166 16.6592 16.6592 16.7398 16.7398 16.8291 16.8291 16.8819 16.8819 17.1326 17.1326 17.1357 17.1357 17.2536 17.2536 k = 0.5000 0.5000 0.4756 ( 2008 PWs) bands (ev): 9.5378 9.5378 9.5727 9.5727 9.5733 9.5733 9.6469 9.6469 12.0942 12.0942 12.0959 12.0959 13.0149 13.0149 13.3360 13.3360 13.3405 13.3405 13.5401 13.5401 14.2197 14.2197 14.2269 14.2269 15.7528 15.7528 15.7529 15.7529 15.8792 15.8792 16.3752 16.3752 16.6461 16.6461 16.7241 16.7241 16.8189 16.8189 16.8456 16.8456 17.1182 17.1182 17.1183 17.1183 17.2406 17.2406 k = 0.5000 0.5000 0.4878 ( 2008 PWs) bands (ev): 9.5346 9.5346 9.5697 9.5697 9.5699 9.5699 9.6432 9.6432 12.0943 12.0943 12.0947 12.0947 13.0144 13.0144 13.3396 13.3396 13.3407 13.3407 13.5426 13.5426 14.2232 14.2232 14.2250 14.2250 15.7868 15.7868 15.7869 15.7869 15.9134 15.9134 16.4141 16.4141 16.6343 16.6343 16.7114 16.7114 16.8132 16.8132 16.8204 16.8204 17.1084 17.1084 17.1087 17.1087 17.2338 17.2338 k = 0.5000 0.5000 0.5000 ( 2008 PWs) bands (ev): 9.5335 9.5335 9.5687 9.5687 9.5687 9.5687 9.6420 9.6420 12.0944 12.0944 12.0944 12.0944 13.0142 13.0142 13.3408 13.3408 13.3408 13.3408 13.5434 13.5434 14.2244 14.2244 14.2244 14.2244 15.7987 15.7987 15.7987 15.7987 15.9252 15.9252 16.4278 16.4278 16.6297 16.6297 16.7065 16.7065 16.8114 16.8114 16.8114 16.8114 17.1051 17.1051 17.1051 17.1051 17.2316 17.2316 Writing output data file FePt3.save init_run : 0.60s CPU 0.79s WALL ( 1 calls) electrons : 103.80s CPU 106.16s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 103.79s CPU 106.16s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.07s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.03s WALL ( 316 calls) cegterg : 97.00s CPU 98.77s WALL ( 485 calls) Called by sum_band: Called by *egterg: h_psi : 41.03s CPU 42.47s WALL ( 7730 calls) s_psi : 4.98s CPU 4.94s WALL ( 7730 calls) g_psi : 0.12s CPU 0.12s WALL ( 6929 calls) cdiaghg : 46.14s CPU 46.66s WALL ( 7245 calls) cegterg:over : 3.96s CPU 3.98s WALL ( 6929 calls) cegterg:upda : 2.50s CPU 2.54s WALL ( 6929 calls) cegterg:last : 1.77s CPU 1.75s WALL ( 1509 calls) cdiaghg:chol : 2.55s CPU 2.52s WALL ( 7245 calls) cdiaghg:inve : 1.84s CPU 1.72s WALL ( 7245 calls) cdiaghg:para : 2.55s CPU 2.67s WALL ( 14490 calls) Called by h_psi: h_psi:vloc : 31.21s CPU 32.32s WALL ( 7730 calls) h_psi:vnl : 9.71s CPU 10.04s WALL ( 7730 calls) add_vuspsi : 5.46s CPU 5.60s WALL ( 7730 calls) General routines calbec : 4.22s CPU 4.42s WALL ( 7730 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 27.95s CPU 29.06s WALL ( 892976 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.08s CPU 0.17s WALL ( 632 calls) Parallel routines fft_scatter : 17.25s CPU 18.06s WALL ( 892999 calls) PWSCF : 1m54.70s CPU 2m 5.74s WALL This run was terminated on: 18:17:43 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=