Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:28:50 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: ./Ni3Pt.save/ file Ni.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 48 18 5 1508 356 61 Max 49 19 6 1511 371 66 Sum 1741 673 213 54339 13133 2301 bravais-lattice index = 14 lattice parameter (alat) = 7.0865 a.u. unit-cell volume = 355.8691 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 42.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.086472 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 Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients 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 Ni 10.00 58.69340 Ni( 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= 325 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 2) = ( 0.0000000 0.0119048 -0.0000000), wk = 0.0030769 k( 3) = ( 0.0000000 0.0238095 -0.0000000), wk = 0.0030769 k( 4) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0030769 k( 5) = ( 0.0000000 0.0476191 -0.0000000), wk = 0.0030769 k( 6) = ( 0.0000000 0.0595238 -0.0000000), wk = 0.0030769 k( 7) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0030769 k( 8) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0030769 k( 9) = ( 0.0000000 0.0952381 -0.0000000), wk = 0.0030769 k( 10) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0030769 k( 11) = ( 0.0000000 0.1190476 -0.0000000), wk = 0.0030769 k( 12) = ( 0.0000000 0.1309524 -0.0000000), wk = 0.0030769 k( 13) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0030769 k( 14) = ( 0.0000000 0.1547619 -0.0000000), wk = 0.0030769 k( 15) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0030769 k( 16) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0030769 k( 17) = ( 0.0000000 0.1904762 -0.0000000), wk = 0.0030769 k( 18) = ( 0.0000000 0.2023810 -0.0000000), wk = 0.0030769 k( 19) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0030769 k( 20) = ( 0.0000000 0.2261905 -0.0000000), wk = 0.0030769 k( 21) = ( 0.0000000 0.2380952 -0.0000000), wk = 0.0030769 k( 22) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0030769 k( 23) = ( 0.0000000 0.2619048 -0.0000000), wk = 0.0030769 k( 24) = ( 0.0000000 0.2738095 -0.0000000), wk = 0.0030769 k( 25) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0030769 k( 26) = ( 0.0000000 0.2976190 -0.0000000), wk = 0.0030769 k( 27) = ( 0.0000000 0.3095238 -0.0000000), wk = 0.0030769 k( 28) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0030769 k( 29) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0030769 k( 30) = ( 0.0000000 0.3452381 -0.0000000), wk = 0.0030769 k( 31) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0030769 k( 32) = ( 0.0000000 0.3690476 -0.0000000), wk = 0.0030769 k( 33) = ( 0.0000000 0.3809524 -0.0000000), wk = 0.0030769 k( 34) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0030769 k( 35) = ( 0.0000000 0.4047619 -0.0000000), wk = 0.0030769 k( 36) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0030769 k( 37) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0030769 k( 38) = ( 0.0000000 0.4404762 -0.0000000), wk = 0.0030769 k( 39) = ( 0.0000000 0.4523810 -0.0000000), wk = 0.0030769 k( 40) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0030769 k( 41) = ( 0.0000000 0.4761905 -0.0000000), wk = 0.0030769 k( 42) = ( 0.0000000 0.4880952 -0.0000000), wk = 0.0030769 k( 43) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030769 k( 44) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030769 k( 45) = ( 0.0119048 0.5000000 -0.0000000), wk = 0.0030769 k( 46) = ( 0.0238095 0.5000000 -0.0000000), wk = 0.0030769 k( 47) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0030769 k( 48) = ( 0.0476191 0.5000000 -0.0000000), wk = 0.0030769 k( 49) = ( 0.0595238 0.5000000 -0.0000000), wk = 0.0030769 k( 50) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0030769 k( 51) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0030769 k( 52) = ( 0.0952381 0.5000000 -0.0000000), wk = 0.0030769 k( 53) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0030769 k( 54) = ( 0.1190476 0.5000000 -0.0000000), wk = 0.0030769 k( 55) = ( 0.1309524 0.5000000 -0.0000000), wk = 0.0030769 k( 56) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0030769 k( 57) = ( 0.1547619 0.5000000 -0.0000000), wk = 0.0030769 k( 58) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0030769 k( 59) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0030769 k( 60) = ( 0.1904762 0.5000000 -0.0000000), wk = 0.0030769 k( 61) = ( 0.2023810 0.5000000 -0.0000000), wk = 0.0030769 k( 62) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0030769 k( 63) = ( 0.2261905 0.5000000 -0.0000000), wk = 0.0030769 k( 64) = ( 0.2380952 0.5000000 -0.0000000), wk = 0.0030769 k( 65) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0030769 k( 66) = ( 0.2619048 0.5000000 -0.0000000), wk = 0.0030769 k( 67) = ( 0.2738095 0.5000000 -0.0000000), wk = 0.0030769 k( 68) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0030769 k( 69) = ( 0.2976190 0.5000000 -0.0000000), wk = 0.0030769 k( 70) = ( 0.3095238 0.5000000 -0.0000000), wk = 0.0030769 k( 71) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0030769 k( 72) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0030769 k( 73) = ( 0.3452381 0.5000000 -0.0000000), wk = 0.0030769 k( 74) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0030769 k( 75) = ( 0.3690476 0.5000000 -0.0000000), wk = 0.0030769 k( 76) = ( 0.3809524 0.5000000 -0.0000000), wk = 0.0030769 k( 77) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0030769 k( 78) = ( 0.4047619 0.5000000 -0.0000000), wk = 0.0030769 k( 79) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0030769 k( 80) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0030769 k( 81) = ( 0.4404762 0.5000000 -0.0000000), wk = 0.0030769 k( 82) = ( 0.4523810 0.5000000 -0.0000000), wk = 0.0030769 k( 83) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0030769 k( 84) = ( 0.4761905 0.5000000 -0.0000000), wk = 0.0030769 k( 85) = ( 0.4880952 0.5000000 -0.0000000), wk = 0.0030769 k( 86) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030769 k( 87) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030769 k( 88) = ( 0.4916667 0.4916667 -0.0000000), wk = 0.0030769 k( 89) = ( 0.4833333 0.4833333 -0.0000000), wk = 0.0030769 k( 90) = ( 0.4750000 0.4750000 -0.0000000), wk = 0.0030769 k( 91) = ( 0.4666667 0.4666667 -0.0000000), wk = 0.0030769 k( 92) = ( 0.4583333 0.4583333 -0.0000000), wk = 0.0030769 k( 93) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0030769 k( 94) = ( 0.4416667 0.4416667 -0.0000000), wk = 0.0030769 k( 95) = ( 0.4333333 0.4333333 -0.0000000), wk = 0.0030769 k( 96) = ( 0.4250000 0.4250000 -0.0000000), wk = 0.0030769 k( 97) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0030769 k( 98) = ( 0.4083333 0.4083333 -0.0000000), wk = 0.0030769 k( 99) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0030769 k( 100) = ( 0.3916667 0.3916667 -0.0000000), wk = 0.0030769 k( 101) = ( 0.3833333 0.3833333 -0.0000000), wk = 0.0030769 k( 102) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0030769 k( 103) = ( 0.3666667 0.3666667 -0.0000000), wk = 0.0030769 k( 104) = ( 0.3583333 0.3583333 -0.0000000), wk = 0.0030769 k( 105) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0030769 k( 106) = ( 0.3416667 0.3416667 -0.0000000), wk = 0.0030769 k( 107) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0030769 k( 108) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0030769 k( 109) = ( 0.3166667 0.3166667 -0.0000000), wk = 0.0030769 k( 110) = ( 0.3083333 0.3083333 -0.0000000), wk = 0.0030769 k( 111) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0030769 k( 112) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0030769 k( 113) = ( 0.2833333 0.2833333 -0.0000000), wk = 0.0030769 k( 114) = ( 0.2750000 0.2750000 -0.0000000), wk = 0.0030769 k( 115) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0030769 k( 116) = ( 0.2583333 0.2583333 -0.0000000), wk = 0.0030769 k( 117) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0030769 k( 118) = ( 0.2416667 0.2416667 -0.0000000), wk = 0.0030769 k( 119) = ( 0.2333333 0.2333333 -0.0000000), wk = 0.0030769 k( 120) = ( 0.2250000 0.2250000 -0.0000000), wk = 0.0030769 k( 121) = ( 0.2166667 0.2166667 -0.0000000), wk = 0.0030769 k( 122) = ( 0.2083333 0.2083333 -0.0000000), wk = 0.0030769 k( 123) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0030769 k( 124) = ( 0.1916667 0.1916667 -0.0000000), wk = 0.0030769 k( 125) = ( 0.1833333 0.1833333 -0.0000000), wk = 0.0030769 k( 126) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0030769 k( 127) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0030769 k( 128) = ( 0.1583333 0.1583333 -0.0000000), wk = 0.0030769 k( 129) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0030769 k( 130) = ( 0.1416667 0.1416667 -0.0000000), wk = 0.0030769 k( 131) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0030769 k( 132) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0030769 k( 133) = ( 0.1166667 0.1166667 -0.0000000), wk = 0.0030769 k( 134) = ( 0.1083333 0.1083333 -0.0000000), wk = 0.0030769 k( 135) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0030769 k( 136) = ( 0.0916667 0.0916667 -0.0000000), wk = 0.0030769 k( 137) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0030769 k( 138) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0030769 k( 139) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0030769 k( 140) = ( 0.0583333 0.0583333 -0.0000000), wk = 0.0030769 k( 141) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0030769 k( 142) = ( 0.0416667 0.0416667 -0.0000000), wk = 0.0030769 k( 143) = ( 0.0333333 0.0333333 -0.0000000), wk = 0.0030769 k( 144) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0030769 k( 145) = ( 0.0166667 0.0166667 -0.0000000), wk = 0.0030769 k( 146) = ( 0.0083333 0.0083333 -0.0000000), wk = 0.0030769 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 148) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 149) = ( 0.0068493 0.0068493 0.0068493), wk = 0.0030769 k( 150) = ( 0.0136986 0.0136986 0.0136986), wk = 0.0030769 k( 151) = ( 0.0205479 0.0205479 0.0205479), wk = 0.0030769 k( 152) = ( 0.0273973 0.0273973 0.0273973), wk = 0.0030769 k( 153) = ( 0.0342466 0.0342466 0.0342466), wk = 0.0030769 k( 154) = ( 0.0410959 0.0410959 0.0410959), wk = 0.0030769 k( 155) = ( 0.0479452 0.0479452 0.0479452), wk = 0.0030769 k( 156) = ( 0.0547945 0.0547945 0.0547945), wk = 0.0030769 k( 157) = ( 0.0616438 0.0616438 0.0616438), wk = 0.0030769 k( 158) = ( 0.0684932 0.0684932 0.0684931), wk = 0.0030769 k( 159) = ( 0.0753425 0.0753425 0.0753425), wk = 0.0030769 k( 160) = ( 0.0821918 0.0821918 0.0821918), wk = 0.0030769 k( 161) = ( 0.0890411 0.0890411 0.0890411), wk = 0.0030769 k( 162) = ( 0.0958904 0.0958904 0.0958904), wk = 0.0030769 k( 163) = ( 0.1027397 0.1027397 0.1027397), wk = 0.0030769 k( 164) = ( 0.1095890 0.1095890 0.1095890), wk = 0.0030769 k( 165) = ( 0.1164384 0.1164384 0.1164384), wk = 0.0030769 k( 166) = ( 0.1232877 0.1232877 0.1232877), wk = 0.0030769 k( 167) = ( 0.1301370 0.1301370 0.1301370), wk = 0.0030769 k( 168) = ( 0.1369863 0.1369863 0.1369863), wk = 0.0030769 k( 169) = ( 0.1438356 0.1438356 0.1438356), wk = 0.0030769 k( 170) = ( 0.1506849 0.1506849 0.1506849), wk = 0.0030769 k( 171) = ( 0.1575342 0.1575342 0.1575342), wk = 0.0030769 k( 172) = ( 0.1643836 0.1643836 0.1643836), wk = 0.0030769 k( 173) = ( 0.1712329 0.1712329 0.1712329), wk = 0.0030769 k( 174) = ( 0.1780822 0.1780822 0.1780822), wk = 0.0030769 k( 175) = ( 0.1849315 0.1849315 0.1849315), wk = 0.0030769 k( 176) = ( 0.1917808 0.1917808 0.1917808), wk = 0.0030769 k( 177) = ( 0.1986301 0.1986301 0.1986301), wk = 0.0030769 k( 178) = ( 0.2054795 0.2054794 0.2054794), wk = 0.0030769 k( 179) = ( 0.2123288 0.2123288 0.2123288), wk = 0.0030769 k( 180) = ( 0.2191781 0.2191781 0.2191781), wk = 0.0030769 k( 181) = ( 0.2260274 0.2260274 0.2260274), wk = 0.0030769 k( 182) = ( 0.2328767 0.2328767 0.2328767), wk = 0.0030769 k( 183) = ( 0.2397260 0.2397260 0.2397260), wk = 0.0030769 k( 184) = ( 0.2465753 0.2465753 0.2465753), wk = 0.0030769 k( 185) = ( 0.2534247 0.2534247 0.2534247), wk = 0.0030769 k( 186) = ( 0.2602740 0.2602740 0.2602740), wk = 0.0030769 k( 187) = ( 0.2671233 0.2671233 0.2671233), wk = 0.0030769 k( 188) = ( 0.2739726 0.2739726 0.2739726), wk = 0.0030769 k( 189) = ( 0.2808219 0.2808219 0.2808219), wk = 0.0030769 k( 190) = ( 0.2876712 0.2876712 0.2876712), wk = 0.0030769 k( 191) = ( 0.2945205 0.2945205 0.2945205), wk = 0.0030769 k( 192) = ( 0.3013699 0.3013699 0.3013699), wk = 0.0030769 k( 193) = ( 0.3082192 0.3082192 0.3082192), wk = 0.0030769 k( 194) = ( 0.3150685 0.3150685 0.3150685), wk = 0.0030769 k( 195) = ( 0.3219178 0.3219178 0.3219178), wk = 0.0030769 k( 196) = ( 0.3287671 0.3287671 0.3287671), wk = 0.0030769 k( 197) = ( 0.3356164 0.3356164 0.3356164), wk = 0.0030769 k( 198) = ( 0.3424658 0.3424657 0.3424657), wk = 0.0030769 k( 199) = ( 0.3493151 0.3493151 0.3493151), wk = 0.0030769 k( 200) = ( 0.3561644 0.3561644 0.3561644), wk = 0.0030769 k( 201) = ( 0.3630137 0.3630137 0.3630137), wk = 0.0030769 k( 202) = ( 0.3698630 0.3698630 0.3698630), wk = 0.0030769 k( 203) = ( 0.3767123 0.3767123 0.3767123), wk = 0.0030769 k( 204) = ( 0.3835616 0.3835616 0.3835616), wk = 0.0030769 k( 205) = ( 0.3904110 0.3904110 0.3904110), wk = 0.0030769 k( 206) = ( 0.3972603 0.3972603 0.3972603), wk = 0.0030769 k( 207) = ( 0.4041096 0.4041096 0.4041096), wk = 0.0030769 k( 208) = ( 0.4109589 0.4109589 0.4109589), wk = 0.0030769 k( 209) = ( 0.4178082 0.4178082 0.4178082), wk = 0.0030769 k( 210) = ( 0.4246575 0.4246575 0.4246575), wk = 0.0030769 k( 211) = ( 0.4315068 0.4315068 0.4315068), wk = 0.0030769 k( 212) = ( 0.4383562 0.4383562 0.4383562), wk = 0.0030769 k( 213) = ( 0.4452055 0.4452055 0.4452055), wk = 0.0030769 k( 214) = ( 0.4520548 0.4520548 0.4520548), wk = 0.0030769 k( 215) = ( 0.4589041 0.4589041 0.4589041), wk = 0.0030769 k( 216) = ( 0.4657534 0.4657534 0.4657534), wk = 0.0030769 k( 217) = ( 0.4726027 0.4726027 0.4726027), wk = 0.0030769 k( 218) = ( 0.4794521 0.4794520 0.4794520), wk = 0.0030769 k( 219) = ( 0.4863014 0.4863014 0.4863014), wk = 0.0030769 k( 220) = ( 0.4931507 0.4931507 0.4931507), wk = 0.0030769 k( 221) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 k( 222) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 k( 223) = ( 0.4916667 0.5000000 0.4916667), wk = 0.0030769 k( 224) = ( 0.4833333 0.5000000 0.4833333), wk = 0.0030769 k( 225) = ( 0.4750000 0.5000000 0.4750000), wk = 0.0030769 k( 226) = ( 0.4666667 0.5000000 0.4666667), wk = 0.0030769 k( 227) = ( 0.4583333 0.5000000 0.4583333), wk = 0.0030769 k( 228) = ( 0.4500000 0.5000000 0.4500000), wk = 0.0030769 k( 229) = ( 0.4416667 0.5000000 0.4416667), wk = 0.0030769 k( 230) = ( 0.4333333 0.5000000 0.4333333), wk = 0.0030769 k( 231) = ( 0.4250000 0.5000000 0.4250000), wk = 0.0030769 k( 232) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0030769 k( 233) = ( 0.4083333 0.5000000 0.4083333), wk = 0.0030769 k( 234) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0030769 k( 235) = ( 0.3916667 0.5000000 0.3916667), wk = 0.0030769 k( 236) = ( 0.3833333 0.5000000 0.3833333), wk = 0.0030769 k( 237) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0030769 k( 238) = ( 0.3666667 0.5000000 0.3666667), wk = 0.0030769 k( 239) = ( 0.3583333 0.5000000 0.3583333), wk = 0.0030769 k( 240) = ( 0.3500000 0.5000000 0.3500000), wk = 0.0030769 k( 241) = ( 0.3416667 0.5000000 0.3416667), wk = 0.0030769 k( 242) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0030769 k( 243) = ( 0.3250000 0.5000000 0.3250000), wk = 0.0030769 k( 244) = ( 0.3166667 0.5000000 0.3166667), wk = 0.0030769 k( 245) = ( 0.3083333 0.5000000 0.3083333), wk = 0.0030769 k( 246) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0030769 k( 247) = ( 0.2916667 0.5000000 0.2916667), wk = 0.0030769 k( 248) = ( 0.2833333 0.5000000 0.2833333), wk = 0.0030769 k( 249) = ( 0.2750000 0.5000000 0.2750000), wk = 0.0030769 k( 250) = ( 0.2666667 0.5000000 0.2666667), wk = 0.0030769 k( 251) = ( 0.2583333 0.5000000 0.2583333), wk = 0.0030769 k( 252) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0030769 k( 253) = ( 0.2416667 0.5000000 0.2416667), wk = 0.0030769 k( 254) = ( 0.2333333 0.5000000 0.2333333), wk = 0.0030769 k( 255) = ( 0.2250000 0.5000000 0.2250000), wk = 0.0030769 k( 256) = ( 0.2166667 0.5000000 0.2166667), wk = 0.0030769 k( 257) = ( 0.2083333 0.5000000 0.2083333), wk = 0.0030769 k( 258) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0030769 k( 259) = ( 0.1916667 0.5000000 0.1916667), wk = 0.0030769 k( 260) = ( 0.1833333 0.5000000 0.1833333), wk = 0.0030769 k( 261) = ( 0.1750000 0.5000000 0.1750000), wk = 0.0030769 k( 262) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0030769 k( 263) = ( 0.1583333 0.5000000 0.1583333), wk = 0.0030769 k( 264) = ( 0.1500000 0.5000000 0.1500000), wk = 0.0030769 k( 265) = ( 0.1416667 0.5000000 0.1416667), wk = 0.0030769 k( 266) = ( 0.1333333 0.5000000 0.1333333), wk = 0.0030769 k( 267) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0030769 k( 268) = ( 0.1166667 0.5000000 0.1166667), wk = 0.0030769 k( 269) = ( 0.1083333 0.5000000 0.1083333), wk = 0.0030769 k( 270) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0030769 k( 271) = ( 0.0916667 0.5000000 0.0916667), wk = 0.0030769 k( 272) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0030769 k( 273) = ( 0.0750000 0.5000000 0.0750000), wk = 0.0030769 k( 274) = ( 0.0666667 0.5000000 0.0666667), wk = 0.0030769 k( 275) = ( 0.0583333 0.5000000 0.0583333), wk = 0.0030769 k( 276) = ( 0.0500000 0.5000000 0.0500000), wk = 0.0030769 k( 277) = ( 0.0416667 0.5000000 0.0416667), wk = 0.0030769 k( 278) = ( 0.0333333 0.5000000 0.0333333), wk = 0.0030769 k( 279) = ( 0.0250000 0.5000000 0.0250000), wk = 0.0030769 k( 280) = ( 0.0166667 0.5000000 0.0166667), wk = 0.0030769 k( 281) = ( 0.0083333 0.5000000 0.0083333), wk = 0.0030769 k( 282) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030769 k( 283) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030769 k( 284) = ( 0.5000000 0.5000000 0.0119048), wk = 0.0030769 k( 285) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0030769 k( 286) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0030769 k( 287) = ( 0.5000000 0.5000000 0.0476190), wk = 0.0030769 k( 288) = ( 0.5000000 0.5000000 0.0595238), wk = 0.0030769 k( 289) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0030769 k( 290) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0030769 k( 291) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0030769 k( 292) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0030769 k( 293) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0030769 k( 294) = ( 0.5000000 0.5000000 0.1309524), wk = 0.0030769 k( 295) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0030769 k( 296) = ( 0.5000000 0.5000000 0.1547619), wk = 0.0030769 k( 297) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0030769 k( 298) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0030769 k( 299) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0030769 k( 300) = ( 0.5000000 0.5000000 0.2023809), wk = 0.0030769 k( 301) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0030769 k( 302) = ( 0.5000000 0.5000000 0.2261905), wk = 0.0030769 k( 303) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0030769 k( 304) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0030769 k( 305) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0030769 k( 306) = ( 0.5000000 0.5000000 0.2738095), wk = 0.0030769 k( 307) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0030769 k( 308) = ( 0.5000000 0.5000000 0.2976190), wk = 0.0030769 k( 309) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0030769 k( 310) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0030769 k( 311) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0030769 k( 312) = ( 0.5000000 0.5000000 0.3452381), wk = 0.0030769 k( 313) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0030769 k( 314) = ( 0.5000000 0.5000000 0.3690476), wk = 0.0030769 k( 315) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0030769 k( 316) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0030769 k( 317) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0030769 k( 318) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0030769 k( 319) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0030769 k( 320) = ( 0.5000000 0.5000000 0.4404762), wk = 0.0030769 k( 321) = ( 0.5000000 0.5000000 0.4523809), wk = 0.0030769 k( 322) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0030769 k( 323) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0030769 k( 324) = ( 0.5000000 0.5000000 0.4880952), wk = 0.0030769 k( 325) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 2) = ( 0.0000000 0.0119048 0.0000000), wk = 0.0030769 k( 3) = ( 0.0000000 0.0238095 0.0000000), wk = 0.0030769 k( 4) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0030769 k( 5) = ( 0.0000000 0.0476191 0.0000000), wk = 0.0030769 k( 6) = ( 0.0000000 0.0595238 0.0000000), wk = 0.0030769 k( 7) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0030769 k( 8) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0030769 k( 9) = ( 0.0000000 0.0952381 0.0000000), wk = 0.0030769 k( 10) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0030769 k( 11) = ( 0.0000000 0.1190476 0.0000000), wk = 0.0030769 k( 12) = ( 0.0000000 0.1309524 0.0000000), wk = 0.0030769 k( 13) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0030769 k( 14) = ( 0.0000000 0.1547619 0.0000000), wk = 0.0030769 k( 15) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0030769 k( 16) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0030769 k( 17) = ( 0.0000000 0.1904762 0.0000000), wk = 0.0030769 k( 18) = ( 0.0000000 0.2023810 0.0000000), wk = 0.0030769 k( 19) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0030769 k( 20) = ( 0.0000000 0.2261905 0.0000000), wk = 0.0030769 k( 21) = ( 0.0000000 0.2380952 0.0000000), wk = 0.0030769 k( 22) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0030769 k( 23) = ( 0.0000000 0.2619048 0.0000000), wk = 0.0030769 k( 24) = ( 0.0000000 0.2738095 0.0000000), wk = 0.0030769 k( 25) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0030769 k( 26) = ( 0.0000000 0.2976190 0.0000000), wk = 0.0030769 k( 27) = ( 0.0000000 0.3095238 0.0000000), wk = 0.0030769 k( 28) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0030769 k( 29) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0030769 k( 30) = ( 0.0000000 0.3452381 0.0000000), wk = 0.0030769 k( 31) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0030769 k( 32) = ( 0.0000000 0.3690476 0.0000000), wk = 0.0030769 k( 33) = ( 0.0000000 0.3809524 0.0000000), wk = 0.0030769 k( 34) = ( 0.0000000 0.3928571 0.0000000), wk = 0.0030769 k( 35) = ( 0.0000000 0.4047619 0.0000000), wk = 0.0030769 k( 36) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0030769 k( 37) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0030769 k( 38) = ( 0.0000000 0.4404762 0.0000000), wk = 0.0030769 k( 39) = ( 0.0000000 0.4523810 0.0000000), wk = 0.0030769 k( 40) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0030769 k( 41) = ( 0.0000000 0.4761905 0.0000000), wk = 0.0030769 k( 42) = ( 0.0000000 0.4880952 0.0000000), wk = 0.0030769 k( 43) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030769 k( 44) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030769 k( 45) = ( 0.0119048 0.5000000 0.0000000), wk = 0.0030769 k( 46) = ( 0.0238095 0.5000000 0.0000000), wk = 0.0030769 k( 47) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0030769 k( 48) = ( 0.0476191 0.5000000 0.0000000), wk = 0.0030769 k( 49) = ( 0.0595238 0.5000000 0.0000000), wk = 0.0030769 k( 50) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0030769 k( 51) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0030769 k( 52) = ( 0.0952381 0.5000000 0.0000000), wk = 0.0030769 k( 53) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0030769 k( 54) = ( 0.1190476 0.5000000 0.0000000), wk = 0.0030769 k( 55) = ( 0.1309524 0.5000000 0.0000000), wk = 0.0030769 k( 56) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0030769 k( 57) = ( 0.1547619 0.5000000 0.0000000), wk = 0.0030769 k( 58) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0030769 k( 59) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0030769 k( 60) = ( 0.1904762 0.5000000 0.0000000), wk = 0.0030769 k( 61) = ( 0.2023810 0.5000000 0.0000000), wk = 0.0030769 k( 62) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0030769 k( 63) = ( 0.2261905 0.5000000 0.0000000), wk = 0.0030769 k( 64) = ( 0.2380952 0.5000000 0.0000000), wk = 0.0030769 k( 65) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0030769 k( 66) = ( 0.2619048 0.5000000 0.0000000), wk = 0.0030769 k( 67) = ( 0.2738095 0.5000000 0.0000000), wk = 0.0030769 k( 68) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0030769 k( 69) = ( 0.2976190 0.5000000 0.0000000), wk = 0.0030769 k( 70) = ( 0.3095238 0.5000000 0.0000000), wk = 0.0030769 k( 71) = ( 0.3214286 0.5000000 0.0000000), wk = 0.0030769 k( 72) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0030769 k( 73) = ( 0.3452381 0.5000000 0.0000000), wk = 0.0030769 k( 74) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0030769 k( 75) = ( 0.3690476 0.5000000 0.0000000), wk = 0.0030769 k( 76) = ( 0.3809524 0.5000000 0.0000000), wk = 0.0030769 k( 77) = ( 0.3928571 0.5000000 0.0000000), wk = 0.0030769 k( 78) = ( 0.4047619 0.5000000 -0.0000000), wk = 0.0030769 k( 79) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0030769 k( 80) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0030769 k( 81) = ( 0.4404762 0.5000000 0.0000000), wk = 0.0030769 k( 82) = ( 0.4523810 0.5000000 0.0000000), wk = 0.0030769 k( 83) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0030769 k( 84) = ( 0.4761905 0.5000000 0.0000000), wk = 0.0030769 k( 85) = ( 0.4880952 0.5000000 0.0000000), wk = 0.0030769 k( 86) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030769 k( 87) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030769 k( 88) = ( 0.4916667 0.4916667 0.0000000), wk = 0.0030769 k( 89) = ( 0.4833333 0.4833333 0.0000000), wk = 0.0030769 k( 90) = ( 0.4750000 0.4750000 0.0000000), wk = 0.0030769 k( 91) = ( 0.4666667 0.4666667 0.0000000), wk = 0.0030769 k( 92) = ( 0.4583333 0.4583333 0.0000000), wk = 0.0030769 k( 93) = ( 0.4500000 0.4500000 0.0000000), wk = 0.0030769 k( 94) = ( 0.4416667 0.4416667 0.0000000), wk = 0.0030769 k( 95) = ( 0.4333333 0.4333333 0.0000000), wk = 0.0030769 k( 96) = ( 0.4250000 0.4250000 0.0000000), wk = 0.0030769 k( 97) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0030769 k( 98) = ( 0.4083333 0.4083333 0.0000000), wk = 0.0030769 k( 99) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0030769 k( 100) = ( 0.3916667 0.3916667 0.0000000), wk = 0.0030769 k( 101) = ( 0.3833333 0.3833333 0.0000000), wk = 0.0030769 k( 102) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0030769 k( 103) = ( 0.3666667 0.3666667 -0.0000000), wk = 0.0030769 k( 104) = ( 0.3583333 0.3583333 -0.0000000), wk = 0.0030769 k( 105) = ( 0.3500000 0.3500000 0.0000000), wk = 0.0030769 k( 106) = ( 0.3416667 0.3416667 0.0000000), wk = 0.0030769 k( 107) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0030769 k( 108) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0030769 k( 109) = ( 0.3166667 0.3166667 0.0000000), wk = 0.0030769 k( 110) = ( 0.3083333 0.3083333 0.0000000), wk = 0.0030769 k( 111) = ( 0.3000000 0.3000000 0.0000000), wk = 0.0030769 k( 112) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0030769 k( 113) = ( 0.2833333 0.2833333 -0.0000000), wk = 0.0030769 k( 114) = ( 0.2750000 0.2750000 0.0000000), wk = 0.0030769 k( 115) = ( 0.2666667 0.2666667 0.0000000), wk = 0.0030769 k( 116) = ( 0.2583333 0.2583333 0.0000000), wk = 0.0030769 k( 117) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0030769 k( 118) = ( 0.2416667 0.2416667 0.0000000), wk = 0.0030769 k( 119) = ( 0.2333333 0.2333333 0.0000000), wk = 0.0030769 k( 120) = ( 0.2250000 0.2250000 0.0000000), wk = 0.0030769 k( 121) = ( 0.2166667 0.2166667 0.0000000), wk = 0.0030769 k( 122) = ( 0.2083333 0.2083333 0.0000000), wk = 0.0030769 k( 123) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0030769 k( 124) = ( 0.1916667 0.1916667 0.0000000), wk = 0.0030769 k( 125) = ( 0.1833333 0.1833333 0.0000000), wk = 0.0030769 k( 126) = ( 0.1750000 0.1750000 0.0000000), wk = 0.0030769 k( 127) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0030769 k( 128) = ( 0.1583333 0.1583333 -0.0000000), wk = 0.0030769 k( 129) = ( 0.1500000 0.1500000 0.0000000), wk = 0.0030769 k( 130) = ( 0.1416667 0.1416667 0.0000000), wk = 0.0030769 k( 131) = ( 0.1333333 0.1333333 0.0000000), wk = 0.0030769 k( 132) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0030769 k( 133) = ( 0.1166667 0.1166667 0.0000000), wk = 0.0030769 k( 134) = ( 0.1083333 0.1083333 0.0000000), wk = 0.0030769 k( 135) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0030769 k( 136) = ( 0.0916667 0.0916667 0.0000000), wk = 0.0030769 k( 137) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0030769 k( 138) = ( 0.0750000 0.0750000 0.0000000), wk = 0.0030769 k( 139) = ( 0.0666667 0.0666667 0.0000000), wk = 0.0030769 k( 140) = ( 0.0583333 0.0583333 0.0000000), wk = 0.0030769 k( 141) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0030769 k( 142) = ( 0.0416667 0.0416667 0.0000000), wk = 0.0030769 k( 143) = ( 0.0333333 0.0333333 0.0000000), wk = 0.0030769 k( 144) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0030769 k( 145) = ( 0.0166667 0.0166667 0.0000000), wk = 0.0030769 k( 146) = ( 0.0083333 0.0083333 0.0000000), wk = 0.0030769 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 148) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 149) = ( 0.0068493 0.0068493 0.0068493), wk = 0.0030769 k( 150) = ( 0.0136986 0.0136986 0.0136986), wk = 0.0030769 k( 151) = ( 0.0205479 0.0205479 0.0205479), wk = 0.0030769 k( 152) = ( 0.0273973 0.0273973 0.0273973), wk = 0.0030769 k( 153) = ( 0.0342466 0.0342466 0.0342466), wk = 0.0030769 k( 154) = ( 0.0410959 0.0410959 0.0410959), wk = 0.0030769 k( 155) = ( 0.0479452 0.0479452 0.0479452), wk = 0.0030769 k( 156) = ( 0.0547945 0.0547945 0.0547945), wk = 0.0030769 k( 157) = ( 0.0616438 0.0616438 0.0616438), wk = 0.0030769 k( 158) = ( 0.0684932 0.0684932 0.0684932), wk = 0.0030769 k( 159) = ( 0.0753425 0.0753425 0.0753425), wk = 0.0030769 k( 160) = ( 0.0821918 0.0821918 0.0821918), wk = 0.0030769 k( 161) = ( 0.0890411 0.0890411 0.0890411), wk = 0.0030769 k( 162) = ( 0.0958904 0.0958904 0.0958904), wk = 0.0030769 k( 163) = ( 0.1027397 0.1027397 0.1027397), wk = 0.0030769 k( 164) = ( 0.1095890 0.1095890 0.1095890), wk = 0.0030769 k( 165) = ( 0.1164384 0.1164384 0.1164384), wk = 0.0030769 k( 166) = ( 0.1232877 0.1232877 0.1232877), wk = 0.0030769 k( 167) = ( 0.1301370 0.1301370 0.1301370), wk = 0.0030769 k( 168) = ( 0.1369863 0.1369863 0.1369863), wk = 0.0030769 k( 169) = ( 0.1438356 0.1438356 0.1438356), wk = 0.0030769 k( 170) = ( 0.1506849 0.1506849 0.1506849), wk = 0.0030769 k( 171) = ( 0.1575342 0.1575342 0.1575342), wk = 0.0030769 k( 172) = ( 0.1643836 0.1643836 0.1643836), wk = 0.0030769 k( 173) = ( 0.1712329 0.1712329 0.1712329), wk = 0.0030769 k( 174) = ( 0.1780822 0.1780822 0.1780822), wk = 0.0030769 k( 175) = ( 0.1849315 0.1849315 0.1849315), wk = 0.0030769 k( 176) = ( 0.1917808 0.1917808 0.1917808), wk = 0.0030769 k( 177) = ( 0.1986301 0.1986301 0.1986301), wk = 0.0030769 k( 178) = ( 0.2054795 0.2054795 0.2054795), wk = 0.0030769 k( 179) = ( 0.2123288 0.2123288 0.2123288), wk = 0.0030769 k( 180) = ( 0.2191781 0.2191781 0.2191781), wk = 0.0030769 k( 181) = ( 0.2260274 0.2260274 0.2260274), wk = 0.0030769 k( 182) = ( 0.2328767 0.2328767 0.2328767), wk = 0.0030769 k( 183) = ( 0.2397260 0.2397260 0.2397260), wk = 0.0030769 k( 184) = ( 0.2465753 0.2465753 0.2465753), wk = 0.0030769 k( 185) = ( 0.2534247 0.2534247 0.2534247), wk = 0.0030769 k( 186) = ( 0.2602740 0.2602740 0.2602740), wk = 0.0030769 k( 187) = ( 0.2671233 0.2671233 0.2671233), wk = 0.0030769 k( 188) = ( 0.2739726 0.2739726 0.2739726), wk = 0.0030769 k( 189) = ( 0.2808219 0.2808219 0.2808219), wk = 0.0030769 k( 190) = ( 0.2876712 0.2876712 0.2876712), wk = 0.0030769 k( 191) = ( 0.2945205 0.2945205 0.2945205), wk = 0.0030769 k( 192) = ( 0.3013699 0.3013699 0.3013699), wk = 0.0030769 k( 193) = ( 0.3082192 0.3082192 0.3082192), wk = 0.0030769 k( 194) = ( 0.3150685 0.3150685 0.3150685), wk = 0.0030769 k( 195) = ( 0.3219178 0.3219178 0.3219178), wk = 0.0030769 k( 196) = ( 0.3287671 0.3287671 0.3287671), wk = 0.0030769 k( 197) = ( 0.3356164 0.3356164 0.3356164), wk = 0.0030769 k( 198) = ( 0.3424658 0.3424658 0.3424658), wk = 0.0030769 k( 199) = ( 0.3493151 0.3493151 0.3493151), wk = 0.0030769 k( 200) = ( 0.3561644 0.3561644 0.3561644), wk = 0.0030769 k( 201) = ( 0.3630137 0.3630137 0.3630137), wk = 0.0030769 k( 202) = ( 0.3698630 0.3698630 0.3698630), wk = 0.0030769 k( 203) = ( 0.3767123 0.3767123 0.3767123), wk = 0.0030769 k( 204) = ( 0.3835616 0.3835616 0.3835616), wk = 0.0030769 k( 205) = ( 0.3904110 0.3904110 0.3904110), wk = 0.0030769 k( 206) = ( 0.3972603 0.3972603 0.3972603), wk = 0.0030769 k( 207) = ( 0.4041096 0.4041096 0.4041096), wk = 0.0030769 k( 208) = ( 0.4109589 0.4109589 0.4109589), wk = 0.0030769 k( 209) = ( 0.4178082 0.4178082 0.4178082), wk = 0.0030769 k( 210) = ( 0.4246575 0.4246575 0.4246575), wk = 0.0030769 k( 211) = ( 0.4315068 0.4315068 0.4315068), wk = 0.0030769 k( 212) = ( 0.4383562 0.4383562 0.4383562), wk = 0.0030769 k( 213) = ( 0.4452055 0.4452055 0.4452055), wk = 0.0030769 k( 214) = ( 0.4520548 0.4520548 0.4520548), wk = 0.0030769 k( 215) = ( 0.4589041 0.4589041 0.4589041), wk = 0.0030769 k( 216) = ( 0.4657534 0.4657534 0.4657534), wk = 0.0030769 k( 217) = ( 0.4726027 0.4726027 0.4726027), wk = 0.0030769 k( 218) = ( 0.4794521 0.4794521 0.4794521), wk = 0.0030769 k( 219) = ( 0.4863014 0.4863014 0.4863014), wk = 0.0030769 k( 220) = ( 0.4931507 0.4931507 0.4931507), wk = 0.0030769 k( 221) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 k( 222) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 k( 223) = ( 0.4916667 0.5000000 0.4916667), wk = 0.0030769 k( 224) = ( 0.4833333 0.5000000 0.4833333), wk = 0.0030769 k( 225) = ( 0.4750000 0.5000000 0.4750000), wk = 0.0030769 k( 226) = ( 0.4666667 0.5000000 0.4666667), wk = 0.0030769 k( 227) = ( 0.4583333 0.5000000 0.4583333), wk = 0.0030769 k( 228) = ( 0.4500000 0.5000000 0.4500000), wk = 0.0030769 k( 229) = ( 0.4416667 0.5000000 0.4416667), wk = 0.0030769 k( 230) = ( 0.4333333 0.5000000 0.4333333), wk = 0.0030769 k( 231) = ( 0.4250000 0.5000000 0.4250000), wk = 0.0030769 k( 232) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0030769 k( 233) = ( 0.4083333 0.5000000 0.4083333), wk = 0.0030769 k( 234) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0030769 k( 235) = ( 0.3916667 0.5000000 0.3916667), wk = 0.0030769 k( 236) = ( 0.3833333 0.5000000 0.3833333), wk = 0.0030769 k( 237) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0030769 k( 238) = ( 0.3666667 0.5000000 0.3666667), wk = 0.0030769 k( 239) = ( 0.3583333 0.5000000 0.3583333), wk = 0.0030769 k( 240) = ( 0.3500000 0.5000000 0.3500000), wk = 0.0030769 k( 241) = ( 0.3416667 0.5000000 0.3416667), wk = 0.0030769 k( 242) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0030769 k( 243) = ( 0.3250000 0.5000000 0.3250000), wk = 0.0030769 k( 244) = ( 0.3166667 0.5000000 0.3166667), wk = 0.0030769 k( 245) = ( 0.3083333 0.5000000 0.3083333), wk = 0.0030769 k( 246) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0030769 k( 247) = ( 0.2916667 0.5000000 0.2916667), wk = 0.0030769 k( 248) = ( 0.2833333 0.5000000 0.2833333), wk = 0.0030769 k( 249) = ( 0.2750000 0.5000000 0.2750000), wk = 0.0030769 k( 250) = ( 0.2666667 0.5000000 0.2666667), wk = 0.0030769 k( 251) = ( 0.2583333 0.5000000 0.2583333), wk = 0.0030769 k( 252) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0030769 k( 253) = ( 0.2416667 0.5000000 0.2416667), wk = 0.0030769 k( 254) = ( 0.2333333 0.5000000 0.2333333), wk = 0.0030769 k( 255) = ( 0.2250000 0.5000000 0.2250000), wk = 0.0030769 k( 256) = ( 0.2166667 0.5000000 0.2166667), wk = 0.0030769 k( 257) = ( 0.2083333 0.5000000 0.2083333), wk = 0.0030769 k( 258) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0030769 k( 259) = ( 0.1916667 0.5000000 0.1916667), wk = 0.0030769 k( 260) = ( 0.1833333 0.5000000 0.1833333), wk = 0.0030769 k( 261) = ( 0.1750000 0.5000000 0.1750000), wk = 0.0030769 k( 262) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0030769 k( 263) = ( 0.1583333 0.5000000 0.1583333), wk = 0.0030769 k( 264) = ( 0.1500000 0.5000000 0.1500000), wk = 0.0030769 k( 265) = ( 0.1416667 0.5000000 0.1416667), wk = 0.0030769 k( 266) = ( 0.1333333 0.5000000 0.1333333), wk = 0.0030769 k( 267) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0030769 k( 268) = ( 0.1166667 0.5000000 0.1166667), wk = 0.0030769 k( 269) = ( 0.1083333 0.5000000 0.1083333), wk = 0.0030769 k( 270) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0030769 k( 271) = ( 0.0916667 0.5000000 0.0916667), wk = 0.0030769 k( 272) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0030769 k( 273) = ( 0.0750000 0.5000000 0.0750000), wk = 0.0030769 k( 274) = ( 0.0666667 0.5000000 0.0666667), wk = 0.0030769 k( 275) = ( 0.0583333 0.5000000 0.0583333), wk = 0.0030769 k( 276) = ( 0.0500000 0.5000000 0.0500000), wk = 0.0030769 k( 277) = ( 0.0416667 0.5000000 0.0416667), wk = 0.0030769 k( 278) = ( 0.0333333 0.5000000 0.0333333), wk = 0.0030769 k( 279) = ( 0.0250000 0.5000000 0.0250000), wk = 0.0030769 k( 280) = ( 0.0166667 0.5000000 0.0166667), wk = 0.0030769 k( 281) = ( 0.0083333 0.5000000 0.0083333), wk = 0.0030769 k( 282) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030769 k( 283) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030769 k( 284) = ( 0.5000000 0.5000000 0.0119048), wk = 0.0030769 k( 285) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0030769 k( 286) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0030769 k( 287) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0030769 k( 288) = ( 0.5000000 0.5000000 0.0595238), wk = 0.0030769 k( 289) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0030769 k( 290) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0030769 k( 291) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0030769 k( 292) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0030769 k( 293) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0030769 k( 294) = ( 0.5000000 0.5000000 0.1309524), wk = 0.0030769 k( 295) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0030769 k( 296) = ( 0.5000000 0.5000000 0.1547619), wk = 0.0030769 k( 297) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0030769 k( 298) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0030769 k( 299) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0030769 k( 300) = ( 0.5000000 0.5000000 0.2023810), wk = 0.0030769 k( 301) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0030769 k( 302) = ( 0.5000000 0.5000000 0.2261905), wk = 0.0030769 k( 303) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0030769 k( 304) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0030769 k( 305) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0030769 k( 306) = ( 0.5000000 0.5000000 0.2738095), wk = 0.0030769 k( 307) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0030769 k( 308) = ( 0.5000000 0.5000000 0.2976190), wk = 0.0030769 k( 309) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0030769 k( 310) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0030769 k( 311) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0030769 k( 312) = ( 0.5000000 0.5000000 0.3452381), wk = 0.0030769 k( 313) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0030769 k( 314) = ( 0.5000000 0.5000000 0.3690476), wk = 0.0030769 k( 315) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0030769 k( 316) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0030769 k( 317) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0030769 k( 318) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0030769 k( 319) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0030769 k( 320) = ( 0.5000000 0.5000000 0.4404762), wk = 0.0030769 k( 321) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0030769 k( 322) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0030769 k( 323) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0030769 k( 324) = ( 0.5000000 0.5000000 0.4880952), wk = 0.0030769 k( 325) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 Dense grid: 54339 G-vectors FFT dimensions: ( 48, 48, 48) Smooth grid: 13133 G-vectors FFT dimensions: ( 30, 30, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.07 Mb ( 100, 48) NL pseudopotentials 0.10 Mb ( 50, 136) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.01 Mb ( 1510) G-vector shells 0.00 Mb ( 346) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.29 Mb ( 100, 192) Each subspace H/S matrix 0.04 Mb ( 48, 48) Each matrix 0.20 Mb ( 136, 2, 48) The potential is recalculated from file : ./Ni3Pt.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 3.4 secs Computing kpt #: 5 total cpu time spent up to now is 3.7 secs Computing kpt #: 6 total cpu time spent up to now is 3.9 secs Computing kpt #: 7 total cpu time spent up to now is 4.1 secs Computing kpt #: 8 total cpu time spent up to now is 4.4 secs Computing kpt #: 9 total cpu time spent up to now is 4.6 secs Computing kpt #: 10 total cpu time spent up to now is 4.9 secs Computing kpt #: 11 total cpu time spent up to now is 5.1 secs Computing kpt #: 12 total cpu time spent up to now is 5.3 secs Computing kpt #: 13 total cpu time spent up to now is 5.6 secs Computing kpt #: 14 total cpu time spent up to now is 5.8 secs Computing kpt #: 15 total cpu time spent up to now is 6.0 secs Computing kpt #: 16 total cpu time spent up to now is 6.3 secs Computing kpt #: 17 total cpu time spent up to now is 6.5 secs Computing kpt #: 18 total cpu time spent up to now is 6.7 secs Computing kpt #: 19 total cpu time spent up to now is 7.0 secs Computing kpt #: 20 total cpu time spent up to now is 7.2 secs Computing kpt #: 21 total cpu time spent up to now is 7.4 secs Computing kpt #: 22 total cpu time spent up to now is 7.6 secs Computing kpt #: 23 total cpu time spent up to now is 7.9 secs Computing kpt #: 24 total cpu time spent up to now is 8.1 secs Computing kpt #: 25 total cpu time spent up to now is 8.3 secs Computing kpt #: 26 total cpu time spent up to now is 8.6 secs Computing kpt #: 27 total cpu time spent up to now is 8.8 secs Computing kpt #: 28 total cpu time spent up to now is 9.1 secs Computing kpt #: 29 total cpu time spent up to now is 9.3 secs Computing kpt #: 30 total cpu time spent up to now is 9.5 secs Computing kpt #: 31 total cpu time spent up to now is 9.8 secs Computing kpt #: 32 total cpu time spent up to now is 10.0 secs Computing kpt #: 33 total cpu time spent up to now is 10.3 secs Computing kpt #: 34 total cpu time spent up to now is 10.5 secs Computing kpt #: 35 total cpu time spent up to now is 10.7 secs Computing kpt #: 36 total cpu time spent up to now is 11.0 secs Computing kpt #: 37 total cpu time spent up to now is 11.2 secs Computing kpt #: 38 total cpu time spent up to now is 11.5 secs Computing kpt #: 39 total cpu time spent up to now is 11.8 secs Computing kpt #: 40 total cpu time spent up to now is 12.1 secs Computing kpt #: 41 total cpu time spent up to now is 12.4 secs Computing kpt #: 42 total cpu time spent up to now is 12.8 secs Computing kpt #: 43 total cpu time spent up to now is 13.1 secs Computing kpt #: 44 total cpu time spent up to now is 13.4 secs Computing kpt #: 45 total cpu time spent up to now is 13.7 secs Computing kpt #: 46 total cpu time spent up to now is 14.1 secs Computing kpt #: 47 total cpu time spent up to now is 14.6 secs Computing kpt #: 48 total cpu time spent up to now is 15.2 secs Computing kpt #: 49 total cpu time spent up to now is 15.7 secs Computing kpt #: 50 total cpu time spent up to now is 16.1 secs Computing kpt #: 51 total cpu time spent up to now is 16.4 secs Computing kpt #: 52 total cpu time spent up to now is 16.7 secs Computing kpt #: 53 total cpu time spent up to now is 16.9 secs Computing kpt #: 54 total cpu time spent up to now is 17.2 secs Computing kpt #: 55 total cpu time spent up to now is 17.5 secs Computing kpt #: 56 total cpu time spent up to now is 17.7 secs Computing kpt #: 57 total cpu time spent up to now is 18.0 secs Computing kpt #: 58 total cpu time spent up to now is 18.2 secs Computing kpt #: 59 total cpu time spent up to now is 18.5 secs Computing kpt #: 60 total cpu time spent up to now is 18.7 secs Computing kpt #: 61 total cpu time spent up to now is 19.0 secs Computing kpt #: 62 total cpu time spent up to now is 19.2 secs Computing kpt #: 63 total cpu time spent up to now is 19.5 secs Computing kpt #: 64 total cpu time spent up to now is 19.7 secs Computing kpt #: 65 total cpu time spent up to now is 20.0 secs Computing kpt #: 66 total cpu time spent up to now is 20.2 secs Computing kpt #: 67 total cpu time spent up to now is 20.5 secs Computing kpt #: 68 total cpu time spent up to now is 20.7 secs Computing kpt #: 69 total cpu time spent up to now is 21.0 secs Computing kpt #: 70 total cpu time spent up to now is 21.2 secs Computing kpt #: 71 total cpu time spent up to now is 21.5 secs Computing kpt #: 72 total cpu time spent up to now is 21.7 secs Computing kpt #: 73 total cpu time spent up to now is 21.9 secs Computing kpt #: 74 total cpu time spent up to now is 22.2 secs Computing kpt #: 75 total cpu time spent up to now is 22.4 secs Computing kpt #: 76 total cpu time spent up to now is 22.7 secs Computing kpt #: 77 total cpu time spent up to now is 22.9 secs Computing kpt #: 78 total cpu time spent up to now is 23.1 secs Computing kpt #: 79 total cpu time spent up to now is 23.4 secs Computing kpt #: 80 total cpu time spent up to now is 23.6 secs Computing kpt #: 81 total cpu time spent up to now is 23.8 secs Computing kpt #: 82 total cpu time spent up to now is 24.1 secs Computing kpt #: 83 total cpu time spent up to now is 24.3 secs Computing kpt #: 84 total cpu time spent up to now is 24.6 secs Computing kpt #: 85 total cpu time spent up to now is 24.8 secs Computing kpt #: 86 total cpu time spent up to now is 25.0 secs Computing kpt #: 87 total cpu time spent up to now is 25.2 secs Computing kpt #: 88 total cpu time spent up to now is 25.5 secs Computing kpt #: 89 total cpu time spent up to now is 25.7 secs Computing kpt #: 90 total cpu time spent up to now is 25.9 secs Computing kpt #: 91 total cpu time spent up to now is 26.2 secs Computing kpt #: 92 total cpu time spent up to now is 26.4 secs Computing kpt #: 93 total cpu time spent up to now is 26.7 secs Computing kpt #: 94 total cpu time spent up to now is 26.9 secs Computing kpt #: 95 total cpu time spent up to now is 27.1 secs Computing kpt #: 96 total cpu time spent up to now is 27.4 secs Computing kpt #: 97 total cpu time spent up to now is 27.6 secs Computing kpt #: 98 total cpu time spent up to now is 27.9 secs Computing kpt #: 99 total cpu time spent up to now is 28.1 secs Computing kpt #: 100 total cpu time spent up to now is 28.4 secs Computing kpt #: 101 total cpu time spent up to now is 28.6 secs Computing kpt #: 102 total cpu time spent up to now is 28.9 secs Computing kpt #: 103 total cpu time spent up to now is 29.1 secs Computing kpt #: 104 total cpu time spent up to now is 29.4 secs Computing kpt #: 105 total cpu time spent up to now is 29.6 secs Computing kpt #: 106 total cpu time spent up to now is 29.9 secs Computing kpt #: 107 total cpu time spent up to now is 30.1 secs Computing kpt #: 108 total cpu time spent up to now is 30.4 secs Computing kpt #: 109 total cpu time spent up to now is 30.6 secs Computing kpt #: 110 total cpu time spent up to now is 30.9 secs Computing kpt #: 111 total cpu time spent up to now is 31.2 secs Computing kpt #: 112 total cpu time spent up to now is 31.5 secs Computing kpt #: 113 total cpu time spent up to now is 31.9 secs Computing kpt #: 114 total cpu time spent up to now is 32.3 secs Computing kpt #: 115 total cpu time spent up to now is 32.6 secs Computing kpt #: 116 total cpu time spent up to now is 32.9 secs Computing kpt #: 117 total cpu time spent up to now is 33.2 secs Computing kpt #: 118 total cpu time spent up to now is 33.4 secs Computing kpt #: 119 total cpu time spent up to now is 33.7 secs Computing kpt #: 120 total cpu time spent up to now is 33.9 secs Computing kpt #: 121 total cpu time spent up to now is 34.1 secs Computing kpt #: 122 total cpu time spent up to now is 34.4 secs Computing kpt #: 123 total cpu time spent up to now is 34.6 secs Computing kpt #: 124 total cpu time spent up to now is 34.8 secs Computing kpt #: 125 total cpu time spent up to now is 35.1 secs Computing kpt #: 126 total cpu time spent up to now is 35.3 secs Computing kpt #: 127 total cpu time spent up to now is 35.5 secs Computing kpt #: 128 total cpu time spent up to now is 35.8 secs Computing kpt #: 129 total cpu time spent up to now is 36.0 secs Computing kpt #: 130 total cpu time spent up to now is 36.2 secs Computing kpt #: 131 total cpu time spent up to now is 36.5 secs Computing kpt #: 132 total cpu time spent up to now is 36.7 secs Computing kpt #: 133 total cpu time spent up to now is 36.9 secs Computing kpt #: 134 total cpu time spent up to now is 37.2 secs Computing kpt #: 135 total cpu time spent up to now is 37.5 secs Computing kpt #: 136 total cpu time spent up to now is 37.7 secs Computing kpt #: 137 total cpu time spent up to now is 37.9 secs Computing kpt #: 138 total cpu time spent up to now is 38.2 secs Computing kpt #: 139 total cpu time spent up to now is 38.4 secs Computing kpt #: 140 total cpu time spent up to now is 38.6 secs Computing kpt #: 141 total cpu time spent up to now is 38.9 secs Computing kpt #: 142 total cpu time spent up to now is 39.1 secs Computing kpt #: 143 total cpu time spent up to now is 39.3 secs Computing kpt #: 144 total cpu time spent up to now is 39.6 secs Computing kpt #: 145 total cpu time spent up to now is 39.8 secs Computing kpt #: 146 total cpu time spent up to now is 40.0 secs Computing kpt #: 147 total cpu time spent up to now is 40.3 secs Computing kpt #: 148 total cpu time spent up to now is 40.5 secs Computing kpt #: 149 total cpu time spent up to now is 40.7 secs Computing kpt #: 150 total cpu time spent up to now is 40.9 secs Computing kpt #: 151 total cpu time spent up to now is 41.2 secs Computing kpt #: 152 total cpu time spent up to now is 41.4 secs Computing kpt #: 153 total cpu time spent up to now is 41.6 secs Computing kpt #: 154 total cpu time spent up to now is 41.9 secs Computing kpt #: 155 total cpu time spent up to now is 42.1 secs Computing kpt #: 156 total cpu time spent up to now is 42.4 secs Computing kpt #: 157 total cpu time spent up to now is 42.6 secs Computing kpt #: 158 total cpu time spent up to now is 42.8 secs Computing kpt #: 159 total cpu time spent up to now is 43.1 secs Computing kpt #: 160 total cpu time spent up to now is 43.3 secs Computing kpt #: 161 total cpu time spent up to now is 43.5 secs Computing kpt #: 162 total cpu time spent up to now is 43.8 secs Computing kpt #: 163 total cpu time spent up to now is 44.0 secs Computing kpt #: 164 total cpu time spent up to now is 44.3 secs Computing kpt #: 165 total cpu time spent up to now is 44.5 secs Computing kpt #: 166 total cpu time spent up to now is 44.7 secs Computing kpt #: 167 total cpu time spent up to now is 45.0 secs Computing kpt #: 168 total cpu time spent up to now is 45.2 secs Computing kpt #: 169 total cpu time spent up to now is 45.5 secs Computing kpt #: 170 total cpu time spent up to now is 45.7 secs Computing kpt #: 171 total cpu time spent up to now is 45.9 secs Computing kpt #: 172 total cpu time spent up to now is 46.2 secs Computing kpt #: 173 total cpu time spent up to now is 46.4 secs Computing kpt #: 174 total cpu time spent up to now is 46.6 secs Computing kpt #: 175 total cpu time spent up to now is 46.9 secs Computing kpt #: 176 total cpu time spent up to now is 47.1 secs Computing kpt #: 177 total cpu time spent up to now is 47.4 secs Computing kpt #: 178 total cpu time spent up to now is 47.6 secs Computing kpt #: 179 total cpu time spent up to now is 47.8 secs Computing kpt #: 180 total cpu time spent up to now is 48.1 secs Computing kpt #: 181 total cpu time spent up to now is 48.3 secs Computing kpt #: 182 total cpu time spent up to now is 48.5 secs Computing kpt #: 183 total cpu time spent up to now is 48.8 secs Computing kpt #: 184 total cpu time spent up to now is 49.0 secs Computing kpt #: 185 total cpu time spent up to now is 49.3 secs Computing kpt #: 186 total cpu time spent up to now is 49.5 secs Computing kpt #: 187 total cpu time spent up to now is 49.7 secs Computing kpt #: 188 total cpu time spent up to now is 50.0 secs Computing kpt #: 189 total cpu time spent up to now is 50.2 secs Computing kpt #: 190 total cpu time spent up to now is 50.5 secs Computing kpt #: 191 total cpu time spent up to now is 50.7 secs Computing kpt #: 192 total cpu time spent up to now is 50.9 secs Computing kpt #: 193 total cpu time spent up to now is 51.2 secs Computing kpt #: 194 total cpu time spent up to now is 51.4 secs Computing kpt #: 195 total cpu time spent up to now is 51.7 secs Computing kpt #: 196 total cpu time spent up to now is 51.9 secs Computing kpt #: 197 total cpu time spent up to now is 52.1 secs Computing kpt #: 198 total cpu time spent up to now is 52.4 secs Computing kpt #: 199 total cpu time spent up to now is 52.6 secs Computing kpt #: 200 total cpu time spent up to now is 52.8 secs Computing kpt #: 201 total cpu time spent up to now is 53.1 secs Computing kpt #: 202 total cpu time spent up to now is 53.3 secs Computing kpt #: 203 total cpu time spent up to now is 53.5 secs Computing kpt #: 204 total cpu time spent up to now is 53.8 secs Computing kpt #: 205 total cpu time spent up to now is 54.0 secs Computing kpt #: 206 total cpu time spent up to now is 54.2 secs Computing kpt #: 207 total cpu time spent up to now is 54.5 secs Computing kpt #: 208 total cpu time spent up to now is 54.7 secs Computing kpt #: 209 total cpu time spent up to now is 54.9 secs Computing kpt #: 210 total cpu time spent up to now is 55.2 secs Computing kpt #: 211 total cpu time spent up to now is 55.4 secs Computing kpt #: 212 total cpu time spent up to now is 55.7 secs Computing kpt #: 213 total cpu time spent up to now is 55.9 secs Computing kpt #: 214 total cpu time spent up to now is 56.1 secs Computing kpt #: 215 total cpu time spent up to now is 56.4 secs Computing kpt #: 216 total cpu time spent up to now is 56.6 secs Computing kpt #: 217 total cpu time spent up to now is 56.8 secs Computing kpt #: 218 total cpu time spent up to now is 57.1 secs Computing kpt #: 219 total cpu time spent up to now is 57.3 secs Computing kpt #: 220 total cpu time spent up to now is 57.5 secs Computing kpt #: 221 total cpu time spent up to now is 57.8 secs Computing kpt #: 222 total cpu time spent up to now is 58.0 secs Computing kpt #: 223 total cpu time spent up to now is 58.2 secs Computing kpt #: 224 total cpu time spent up to now is 58.5 secs Computing kpt #: 225 total cpu time spent up to now is 58.7 secs Computing kpt #: 226 total cpu time spent up to now is 58.9 secs Computing kpt #: 227 total cpu time spent up to now is 59.2 secs Computing kpt #: 228 total cpu time spent up to now is 59.4 secs Computing kpt #: 229 total cpu time spent up to now is 59.6 secs Computing kpt #: 230 total cpu time spent up to now is 59.9 secs Computing kpt #: 231 total cpu time spent up to now is 60.1 secs Computing kpt #: 232 total cpu time spent up to now is 60.3 secs Computing kpt #: 233 total cpu time spent up to now is 60.6 secs Computing kpt #: 234 total cpu time spent up to now is 60.8 secs Computing kpt #: 235 total cpu time spent up to now is 61.0 secs Computing kpt #: 236 total cpu time spent up to now is 61.3 secs Computing kpt #: 237 total cpu time spent up to now is 61.5 secs Computing kpt #: 238 total cpu time spent up to now is 61.8 secs Computing kpt #: 239 total cpu time spent up to now is 62.0 secs Computing kpt #: 240 total cpu time spent up to now is 62.3 secs Computing kpt #: 241 total cpu time spent up to now is 62.5 secs Computing kpt #: 242 total cpu time spent up to now is 62.8 secs Computing kpt #: 243 total cpu time spent up to now is 63.0 secs Computing kpt #: 244 total cpu time spent up to now is 63.3 secs Computing kpt #: 245 total cpu time spent up to now is 63.5 secs Computing kpt #: 246 total cpu time spent up to now is 63.8 secs Computing kpt #: 247 total cpu time spent up to now is 64.1 secs Computing kpt #: 248 total cpu time spent up to now is 64.3 secs Computing kpt #: 249 total cpu time spent up to now is 64.6 secs Computing kpt #: 250 total cpu time spent up to now is 64.8 secs Computing kpt #: 251 total cpu time spent up to now is 65.1 secs Computing kpt #: 252 total cpu time spent up to now is 65.3 secs Computing kpt #: 253 total cpu time spent up to now is 65.6 secs Computing kpt #: 254 total cpu time spent up to now is 65.9 secs Computing kpt #: 255 total cpu time spent up to now is 66.2 secs Computing kpt #: 256 total cpu time spent up to now is 66.4 secs Computing kpt #: 257 total cpu time spent up to now is 66.7 secs Computing kpt #: 258 total cpu time spent up to now is 67.0 secs Computing kpt #: 259 total cpu time spent up to now is 67.3 secs Computing kpt #: 260 total cpu time spent up to now is 67.6 secs Computing kpt #: 261 total cpu time spent up to now is 67.9 secs Computing kpt #: 262 total cpu time spent up to now is 68.2 secs Computing kpt #: 263 total cpu time spent up to now is 68.5 secs Computing kpt #: 264 total cpu time spent up to now is 68.9 secs Computing kpt #: 265 total cpu time spent up to now is 69.4 secs Computing kpt #: 266 total cpu time spent up to now is 69.8 secs Computing kpt #: 267 total cpu time spent up to now is 70.2 secs Computing kpt #: 268 total cpu time spent up to now is 70.7 secs Computing kpt #: 269 total cpu time spent up to now is 71.4 secs Computing kpt #: 270 total cpu time spent up to now is 71.9 secs Computing kpt #: 271 total cpu time spent up to now is 72.4 secs Computing kpt #: 272 total cpu time spent up to now is 72.8 secs Computing kpt #: 273 total cpu time spent up to now is 73.3 secs Computing kpt #: 274 total cpu time spent up to now is 73.8 secs Computing kpt #: 275 total cpu time spent up to now is 74.1 secs Computing kpt #: 276 total cpu time spent up to now is 74.5 secs Computing kpt #: 277 total cpu time spent up to now is 75.0 secs Computing kpt #: 278 total cpu time spent up to now is 75.3 secs Computing kpt #: 279 total cpu time spent up to now is 75.6 secs Computing kpt #: 280 total cpu time spent up to now is 75.8 secs Computing kpt #: 281 total cpu time spent up to now is 76.1 secs Computing kpt #: 282 total cpu time spent up to now is 76.5 secs Computing kpt #: 283 total cpu time spent up to now is 76.7 secs Computing kpt #: 284 total cpu time spent up to now is 76.9 secs Computing kpt #: 285 total cpu time spent up to now is 77.2 secs Computing kpt #: 286 total cpu time spent up to now is 77.4 secs Computing kpt #: 287 total cpu time spent up to now is 77.6 secs Computing kpt #: 288 total cpu time spent up to now is 77.9 secs Computing kpt #: 289 total cpu time spent up to now is 78.1 secs Computing kpt #: 290 total cpu time spent up to now is 78.3 secs Computing kpt #: 291 total cpu time spent up to now is 78.6 secs Computing kpt #: 292 total cpu time spent up to now is 78.8 secs Computing kpt #: 293 total cpu time spent up to now is 79.0 secs Computing kpt #: 294 total cpu time spent up to now is 79.3 secs Computing kpt #: 295 total cpu time spent up to now is 79.5 secs Computing kpt #: 296 total cpu time spent up to now is 79.7 secs Computing kpt #: 297 total cpu time spent up to now is 80.0 secs Computing kpt #: 298 total cpu time spent up to now is 80.2 secs Computing kpt #: 299 total cpu time spent up to now is 80.5 secs Computing kpt #: 300 total cpu time spent up to now is 80.7 secs Computing kpt #: 301 total cpu time spent up to now is 80.9 secs Computing kpt #: 302 total cpu time spent up to now is 81.2 secs Computing kpt #: 303 total cpu time spent up to now is 81.4 secs Computing kpt #: 304 total cpu time spent up to now is 81.7 secs Computing kpt #: 305 total cpu time spent up to now is 81.9 secs Computing kpt #: 306 total cpu time spent up to now is 82.1 secs Computing kpt #: 307 total cpu time spent up to now is 82.4 secs Computing kpt #: 308 total cpu time spent up to now is 82.6 secs Computing kpt #: 309 total cpu time spent up to now is 82.8 secs Computing kpt #: 310 total cpu time spent up to now is 83.1 secs Computing kpt #: 311 total cpu time spent up to now is 83.3 secs Computing kpt #: 312 total cpu time spent up to now is 83.5 secs Computing kpt #: 313 total cpu time spent up to now is 83.8 secs Computing kpt #: 314 total cpu time spent up to now is 84.0 secs Computing kpt #: 315 total cpu time spent up to now is 84.3 secs Computing kpt #: 316 total cpu time spent up to now is 84.5 secs Computing kpt #: 317 total cpu time spent up to now is 84.7 secs Computing kpt #: 318 total cpu time spent up to now is 85.0 secs Computing kpt #: 319 total cpu time spent up to now is 85.2 secs Computing kpt #: 320 total cpu time spent up to now is 85.4 secs Computing kpt #: 321 total cpu time spent up to now is 85.7 secs Computing kpt #: 322 total cpu time spent up to now is 85.9 secs Computing kpt #: 323 total cpu time spent up to now is 86.1 secs Computing kpt #: 324 total cpu time spent up to now is 86.4 secs Computing kpt #: 325 total cpu time spent up to now is 86.6 secs ethr = 2.50E-08, avg # of iterations = 14.6 total cpu time spent up to now is 86.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): 4.2776 4.2776 7.6564 7.6564 7.6564 7.6564 8.6632 8.6632 8.6632 8.6632 8.9538 8.9538 9.4627 9.4627 11.1168 11.1168 11.1168 11.1168 11.3361 11.3361 12.2374 12.2374 12.2374 12.2374 12.7781 12.7781 12.9114 12.9114 12.9114 12.9114 12.9544 12.9544 13.0217 13.0217 13.0217 13.0217 13.3854 13.3854 13.3854 13.3854 13.6085 13.6085 14.7326 14.7326 15.3863 15.3863 15.3863 15.3863 k = 0.0000 0.0119-0.0000 ( 1647 PWs) bands (ev): 4.2794 4.2794 7.6571 7.6571 7.6572 7.6572 8.6638 8.6638 8.6638 8.6638 8.9543 8.9543 9.4632 9.4632 11.1166 11.1166 11.1172 11.1172 11.3362 11.3362 12.2368 12.2368 12.2377 12.2377 12.7775 12.7775 12.9094 12.9094 12.9109 12.9109 12.9527 12.9527 13.0187 13.0187 13.0213 13.0213 13.3800 13.3800 13.3845 13.3845 13.6048 13.6048 14.7368 14.7368 15.3817 15.3817 15.3943 15.3943 k = 0.0000 0.0238-0.0000 ( 1647 PWs) bands (ev): 4.2846 4.2846 7.6592 7.6592 7.6598 7.6598 8.6654 8.6654 8.6655 8.6655 8.9560 8.9560 9.4645 9.4645 11.1159 11.1159 11.1183 11.1183 11.3365 11.3365 12.2350 12.2350 12.2383 12.2383 12.7759 12.7759 12.9029 12.9029 12.9092 12.9092 12.9479 12.9479 13.0096 13.0096 13.0200 13.0200 13.3644 13.3644 13.3818 13.3818 13.5941 13.5941 14.7478 14.7478 15.3692 15.3692 15.4180 15.4180 k = 0.0000 0.0357-0.0000 ( 1635 PWs) bands (ev): 4.2933 4.2933 7.6627 7.6627 7.6640 7.6640 8.6681 8.6681 8.6684 8.6684 8.9590 8.9590 9.4672 9.4672 11.1147 11.1147 11.1203 11.1203 11.3371 11.3371 12.2319 12.2319 12.2394 12.2394 12.7733 12.7733 12.8904 12.8904 12.9066 12.9066 12.9410 12.9410 12.9944 12.9944 13.0181 13.0181 13.3403 13.3403 13.3771 13.3771 13.5777 13.5777 14.7607 14.7607 15.3531 15.3531 15.4564 15.4564 k = 0.0000 0.0476-0.0000 ( 1643 PWs) bands (ev): 4.3054 4.3054 7.6674 7.6674 7.6698 7.6698 8.6718 8.6718 8.6723 8.6723 8.9629 8.9629 9.4703 9.4703 11.1130 11.1130 11.1229 11.1229 11.3378 11.3378 12.2276 12.2276 12.2409 12.2409 12.7692 12.7692 12.8703 12.8703 12.9027 12.9027 12.9331 12.9331 12.9727 12.9727 13.0155 13.0155 13.3099 13.3099 13.3700 13.3700 13.5575 13.5575 14.7672 14.7672 15.3409 15.3409 15.5084 15.5084 k = 0.0000 0.0595-0.0000 ( 1647 PWs) bands (ev): 4.3210 4.3210 7.6736 7.6736 7.6772 7.6772 8.6765 8.6765 8.6772 8.6772 8.9680 8.9680 9.4744 9.4744 11.1106 11.1106 11.1262 11.1262 11.3389 11.3389 12.2220 12.2220 12.2429 12.2429 12.7641 12.7641 12.8418 12.8418 12.8977 12.8977 12.9245 12.9245 12.9445 12.9445 13.0122 13.0122 13.2760 13.2760 13.3599 13.3599 13.5356 13.5356 14.7569 14.7569 15.3423 15.3423 15.5724 15.5724 k = 0.0000 0.0714-0.0000 ( 1647 PWs) bands (ev): 4.3400 4.3400 7.6810 7.6810 7.6862 7.6862 8.6823 8.6823 8.6833 8.6833 8.9742 8.9742 9.4793 9.4793 11.1076 11.1076 11.1303 11.1303 11.3405 11.3405 12.2152 12.2152 12.2452 12.2452 12.7576 12.7576 12.8047 12.8047 12.8916 12.8916 12.9101 12.9101 12.9152 12.9152 13.0086 13.0086 13.2408 13.2408 13.3467 13.3467 13.5143 13.5143 14.7216 14.7216 15.3652 15.3652 15.6470 15.6470 k = 0.0000 0.0833-0.0000 ( 1647 PWs) bands (ev): 4.3624 4.3624 7.6898 7.6898 7.6966 7.6966 8.6891 8.6891 8.6904 8.6904 8.9815 8.9815 9.4852 9.4852 11.1037 11.1037 11.1350 11.1350 11.3427 11.3427 12.2072 12.2072 12.2480 12.2480 12.7494 12.7494 12.7594 12.7594 12.8684 12.8684 12.8858 12.8858 12.9047 12.9047 13.0044 13.0044 13.2060 13.2060 13.3300 13.3300 13.4950 13.4950 14.6593 14.6593 15.4117 15.4117 15.7306 15.7306 k = 0.0000 0.0952-0.0000 ( 1647 PWs) bands (ev): 4.3882 4.3882 7.6998 7.6998 7.7084 7.7084 8.6969 8.6969 8.6985 8.6985 8.9899 8.9899 9.4919 9.4919 11.0990 11.0990 11.1404 11.1404 11.3455 11.3455 12.1979 12.1979 12.2512 12.2512 12.7067 12.7067 12.7385 12.7385 12.8231 12.8231 12.8777 12.8777 12.8927 12.8927 12.9996 12.9996 13.1727 13.1727 13.3100 13.3100 13.4788 13.4788 14.5739 14.5739 15.4782 15.4782 15.8221 15.8221 k = 0.0000 0.1071-0.0000 ( 1651 PWs) bands (ev): 4.4174 4.4174 7.7111 7.7111 7.7216 7.7216 8.7057 8.7057 8.7076 8.7076 8.9993 8.9993 9.4995 9.4995 11.0933 11.0933 11.1465 11.1465 11.3490 11.3490 12.1874 12.1874 12.2549 12.2549 12.6475 12.6475 12.7209 12.7209 12.7769 12.7769 12.8690 12.8690 12.8792 12.8792 12.9937 12.9937 13.1416 13.1416 13.2874 13.2874 13.4655 13.4655 14.4707 14.4707 15.5599 15.5599 15.9204 15.9204 k = 0.0000 0.1190-0.0000 ( 1647 PWs) bands (ev): 4.4499 4.4499 7.7235 7.7235 7.7360 7.7360 8.7155 8.7155 8.7177 8.7177 9.0099 9.0099 9.5079 9.5079 11.0867 11.0867 11.1533 11.1533 11.3535 11.3535 12.1758 12.1758 12.2589 12.2589 12.5834 12.5834 12.6849 12.6849 12.7429 12.7429 12.8595 12.8595 12.8640 12.8640 12.9864 12.9864 13.1131 13.1131 13.2629 13.2629 13.4547 13.4547 14.3544 14.3544 15.6528 15.6528 16.0245 16.0245 k = 0.0000 0.1310-0.0000 ( 1647 PWs) bands (ev): 4.4857 4.4857 7.7371 7.7371 7.7515 7.7515 8.7263 8.7263 8.7286 8.7286 9.0216 9.0216 9.5171 9.5171 11.0789 11.0789 11.1606 11.1606 11.3587 11.3587 12.1627 12.1627 12.2633 12.2633 12.5154 12.5154 12.6292 12.6292 12.7231 12.7231 12.8471 12.8471 12.8493 12.8493 12.9766 12.9766 13.0879 13.0879 13.2373 13.2373 13.4459 13.4459 14.2286 14.2286 15.7542 15.7542 16.1336 16.1336 k = 0.0000 0.1429-0.0000 ( 1647 PWs) bands (ev): 4.5248 4.5248 7.7517 7.7517 7.7679 7.7679 8.7379 8.7379 8.7404 8.7404 9.0344 9.0344 9.5272 9.5272 11.0701 11.0701 11.1683 11.1683 11.3648 11.3648 12.1483 12.1483 12.2679 12.2679 12.4448 12.4448 12.5649 12.5649 12.7070 12.7070 12.8285 12.8285 12.8382 12.8382 12.9627 12.9627 13.0668 13.0668 13.2111 13.2111 13.4386 13.4386 14.0960 14.0960 15.8620 15.8620 16.2473 16.2473 k = 0.0000 0.1548-0.0000 ( 1659 PWs) bands (ev): 4.5672 4.5672 7.7672 7.7672 7.7851 7.7851 8.7504 8.7504 8.7529 8.7529 9.0481 9.0481 9.5378 9.5378 11.0601 11.0601 11.1765 11.1765 11.3718 11.3718 12.1322 12.1322 12.2727 12.2727 12.3728 12.3728 12.4967 12.4967 12.6909 12.6909 12.8081 12.8081 12.8260 12.8260 12.9438 12.9438 13.0506 13.0506 13.1842 13.1842 13.4322 13.4322 13.9588 13.9588 15.9751 15.9751 16.3648 16.3648 k = 0.0000 0.1667-0.0000 ( 1659 PWs) bands (ev): 4.6127 4.6127 7.7837 7.7837 7.8030 7.8030 8.7638 8.7638 8.7661 8.7661 9.0629 9.0629 9.5494 9.5494 11.0491 11.0491 11.1850 11.1850 11.3798 11.3798 12.1141 12.1141 12.2774 12.2774 12.3007 12.3007 12.4266 12.4266 12.6741 12.6741 12.7862 12.7862 12.8135 12.8135 12.9195 12.9195 13.0389 13.0389 13.1573 13.1573 13.4266 13.4266 13.8190 13.8190 16.0925 16.0925 16.4859 16.4859 k = 0.0000 0.1786-0.0000 ( 1651 PWs) bands (ev): 4.6614 4.6614 7.8012 7.8012 7.8214 7.8214 8.7781 8.7781 8.7799 8.7799 9.0788 9.0788 9.5619 9.5619 11.0372 11.0372 11.1940 11.1940 11.3887 11.3887 12.0934 12.0934 12.2303 12.2303 12.2802 12.2802 12.3574 12.3574 12.6563 12.6563 12.7625 12.7625 12.8002 12.8002 12.8907 12.8907 13.0308 13.0308 13.1303 13.1303 13.4216 13.4216 13.6783 13.6783 16.2135 16.2135 16.6101 16.6101 k = 0.0000 0.1905-0.0000 ( 1651 PWs) bands (ev): 4.7131 4.7131 7.8194 7.8194 7.8400 7.8400 8.7932 8.7932 8.7941 8.7941 9.0956 9.0956 9.5751 9.5751 11.0243 11.0243 11.2028 11.2028 11.3982 11.3982 12.0663 12.0663 12.1651 12.1651 12.2617 12.2617 12.3089 12.3089 12.6374 12.6374 12.7371 12.7371 12.7861 12.7861 12.8580 12.8580 13.0248 13.0248 13.1032 13.1032 13.4170 13.4170 13.5383 13.5383 16.3375 16.3375 16.7371 16.7371 k = 0.0000 0.2024-0.0000 ( 1643 PWs) bands (ev): 4.7679 4.7679 7.8383 7.8383 7.8586 7.8586 8.8085 8.8085 8.8092 8.8092 9.1136 9.1136 9.5893 9.5893 11.0108 11.0108 11.2114 11.2114 11.4084 11.4084 12.0268 12.0268 12.1122 12.1122 12.1984 12.1984 12.3055 12.3055 12.6173 12.6173 12.7096 12.7096 12.7712 12.7712 12.8218 12.8218 13.0201 13.0201 13.0762 13.0762 13.4011 13.4011 13.4129 13.4129 16.4643 16.4643 16.8667 16.8667 k = 0.0000 0.2143-0.0000 ( 1643 PWs) bands (ev): 4.8256 4.8256 7.8578 7.8578 7.8770 7.8770 8.8231 8.8231 8.8257 8.8257 9.1323 9.1323 9.6043 9.6043 10.9963 10.9963 11.2195 11.2195 11.4189 11.4189 11.9719 11.9719 12.0752 12.0752 12.1272 12.1272 12.3107 12.3107 12.5961 12.5961 12.6795 12.6795 12.7553 12.7553 12.7821 12.7821 13.0157 13.0157 13.0493 13.0493 13.2691 13.2691 13.4091 13.4091 16.5934 16.5934 16.9987 16.9987 k = 0.0000 0.2262-0.0000 ( 1651 PWs) bands (ev): 4.8862 4.8862 7.8779 7.8779 7.8947 7.8947 8.8377 8.8377 8.8429 8.8429 9.1520 9.1520 9.6203 9.6203 10.9809 10.9809 11.2264 11.2264 11.4293 11.4293 11.9092 11.9092 12.0469 12.0469 12.0557 12.0557 12.3176 12.3176 12.5739 12.5739 12.6453 12.6453 12.7384 12.7384 12.7390 12.7390 13.0092 13.0092 13.0228 13.0228 13.1468 13.1468 13.4055 13.4055 16.7246 16.7246 17.1328 17.1328 k = 0.0000 0.2381-0.0000 ( 1643 PWs) bands (ev): 4.9495 4.9495 7.8983 7.8983 7.9116 7.9116 8.8520 8.8520 8.8606 8.8606 9.1726 9.1726 9.6373 9.6373 10.9650 10.9650 11.2325 11.2325 11.4400 11.4400 11.8457 11.8457 11.9858 11.9858 12.0219 12.0219 12.3253 12.3253 12.5509 12.5509 12.6037 12.6037 12.6936 12.6936 12.7203 12.7203 12.9858 12.9858 12.9966 12.9966 13.0526 13.0526 13.4021 13.4021 16.8577 16.8577 17.2690 17.2690 k = 0.0000 0.2500-0.0000 ( 1639 PWs) bands (ev): 5.0155 5.0155 7.9191 7.9191 7.9273 7.9273 8.8658 8.8658 8.8788 8.8788 9.1940 9.1940 9.6555 9.6555 10.9486 10.9486 11.2359 11.2359 11.4493 11.4493 11.7843 11.7843 11.9184 11.9184 11.9975 11.9975 12.3334 12.3334 12.5273 12.5273 12.5490 12.5490 12.6494 12.6494 12.7010 12.7010 12.9101 12.9101 12.9710 12.9710 13.0251 13.0251 13.3990 13.3990 16.9925 16.9925 17.4071 17.4071 k = 0.0000 0.2619-0.0000 ( 1643 PWs) bands (ev): 5.0841 5.0841 7.9401 7.9401 7.9413 7.9413 8.8789 8.8789 8.8974 8.8974 9.2163 9.2163 9.6749 9.6749 10.9317 10.9317 11.2359 11.2359 11.4563 11.4563 11.7272 11.7272 11.8550 11.8550 11.9728 11.9728 12.3419 12.3419 12.4770 12.4770 12.5030 12.5030 12.6091 12.6091 12.6803 12.6803 12.8291 12.8291 12.9460 12.9460 13.0193 13.0193 13.3960 13.3960 17.1288 17.1288 17.5469 17.5469 k = 0.0000 0.2738-0.0000 ( 1643 PWs) bands (ev): 5.1552 5.1552 7.9532 7.9532 7.9612 7.9612 8.8912 8.8912 8.9163 8.9163 9.2393 9.2393 9.6958 9.6958 10.9145 10.9145 11.2312 11.2312 11.4590 11.4590 11.6762 11.6762 11.7980 11.7980 11.9474 11.9474 12.3506 12.3506 12.3908 12.3908 12.4782 12.4782 12.5728 12.5728 12.6584 12.6584 12.7600 12.7600 12.9219 12.9219 13.0167 13.0167 13.3933 13.3933 17.2665 17.2665 17.6883 17.6883 k = 0.0000 0.2857-0.0000 ( 1643 PWs) bands (ev): 5.2285 5.2285 7.9626 7.9626 7.9822 7.9822 8.9025 8.9025 8.9355 8.9355 9.2629 9.2629 9.7183 9.7183 10.8971 10.8971 11.2200 11.2200 11.4543 11.4543 11.6329 11.6329 11.7508 11.7508 11.9207 11.9207 12.2972 12.2972 12.3594 12.3594 12.4532 12.4532 12.5389 12.5389 12.6350 12.6350 12.7010 12.7010 12.8986 12.8986 13.0151 13.0151 13.3908 13.3908 17.4054 17.4054 17.8313 17.8313 k = 0.0000 0.2976-0.0000 ( 1643 PWs) bands (ev): 5.3040 5.3040 7.9689 7.9689 8.0031 8.0031 8.9125 8.9125 8.9548 8.9548 9.2872 9.2872 9.7424 9.7424 10.8796 10.8796 11.2015 11.2015 11.4383 11.4383 11.5984 11.5984 11.7171 11.7171 11.8918 11.8918 12.2029 12.2029 12.3680 12.3680 12.4286 12.4286 12.5062 12.5062 12.6102 12.6102 12.6488 12.6488 12.8763 12.8763 13.0139 13.0139 13.3884 13.3884 17.5453 17.5453 17.9757 17.9757 k = 0.0000 0.3095-0.0000 ( 1642 PWs) bands (ev): 5.3815 5.3815 7.9717 7.9717 8.0237 8.0237 8.9214 8.9214 8.9741 8.9741 9.3121 9.3121 9.7683 9.7683 10.8620 10.8620 11.1752 11.1752 11.4092 11.4092 11.5725 11.5725 11.6991 11.6991 11.8594 11.8594 12.1140 12.1140 12.3747 12.3747 12.4060 12.4060 12.4743 12.4743 12.5843 12.5843 12.6010 12.6010 12.8550 12.8550 13.0130 13.0130 13.3862 13.3862 17.6860 17.6860 18.1215 18.1215 k = 0.0000 0.3214-0.0000 ( 1642 PWs) bands (ev): 5.4607 5.4607 7.9704 7.9704 8.0439 8.0439 8.9290 8.9290 8.9933 8.9933 9.3373 9.3373 9.7961 9.7961 10.8447 10.8447 11.1423 11.1423 11.3690 11.3690 11.5531 11.5531 11.6951 11.6951 11.8217 11.8217 12.0357 12.0357 12.3689 12.3689 12.3961 12.3961 12.4431 12.4431 12.5560 12.5560 12.5573 12.5573 12.8346 12.8346 13.0123 13.0123 13.3841 13.3841 17.8275 17.8275 18.2685 18.2685 k = 0.0000 0.3333-0.0000 ( 1630 PWs) bands (ev): 5.5414 5.5414 7.9646 7.9646 8.0636 8.0636 8.9355 8.9355 9.0124 9.0124 9.3630 9.3630 9.8259 9.8259 10.8275 10.8275 11.1050 11.1050 11.3219 11.3219 11.5361 11.5361 11.7012 11.7012 11.7783 11.7783 11.9727 11.9727 12.3481 12.3481 12.4015 12.4015 12.4125 12.4125 12.5130 12.5130 12.5297 12.5297 12.8151 12.8151 13.0118 13.0118 13.3823 13.3823 17.9695 17.9695 18.4167 18.4167 k = 0.0000 0.3452-0.0000 ( 1642 PWs) bands (ev): 5.6234 5.6234 7.9537 7.9537 8.0826 8.0826 8.9408 8.9408 9.0309 9.0309 9.3887 9.3887 9.8576 9.8576 10.8106 10.8106 11.0648 11.0648 11.2710 11.2710 11.5149 11.5149 11.7135 11.7135 11.7334 11.7334 11.9259 11.9259 12.3247 12.3247 12.3826 12.3826 12.4084 12.4084 12.4715 12.4715 12.5024 12.5024 12.7964 12.7964 13.0113 13.0113 13.3805 13.3805 18.1118 18.1118 18.5659 18.5659 k = 0.0000 0.3571-0.0000 ( 1650 PWs) bands (ev): 5.7062 5.7062 7.9375 7.9375 8.1009 8.1009 8.9453 8.9453 9.0490 9.0490 9.4145 9.4145 9.8908 9.8908 10.7944 10.7944 11.0238 11.0238 11.2191 11.2191 11.4823 11.4823 11.6970 11.6970 11.7304 11.7304 11.8923 11.8923 12.3015 12.3015 12.3534 12.3534 12.4125 12.4125 12.4311 12.4311 12.4780 12.4780 12.7784 12.7784 13.0108 13.0108 13.3789 13.3789 18.2541 18.2541 18.7161 18.7161 k = 0.0000 0.3690-0.0000 ( 1642 PWs) bands (ev): 5.7895 5.7895 7.9158 7.9158 8.1182 8.1182 8.9492 8.9492 9.0664 9.0664 9.4401 9.4401 9.9259 9.9259 10.7788 10.7788 10.9839 10.9839 11.1678 11.1678 11.4349 11.4349 11.6752 11.6752 11.7505 11.7505 11.8683 11.8683 12.2795 12.2795 12.3254 12.3254 12.3920 12.3920 12.4065 12.4065 12.4635 12.4635 12.7611 12.7611 13.0105 13.0105 13.3774 13.3774 18.3961 18.3961 18.8671 18.8671 k = 0.0000 0.3810-0.0000 ( 1646 PWs) bands (ev): 5.8727 5.8727 7.8888 7.8888 8.1346 8.1346 8.9527 8.9527 9.0830 9.0830 9.4652 9.4652 9.9624 9.9624 10.7638 10.7638 10.9457 10.9457 11.1180 11.1180 11.3763 11.3763 11.6654 11.6654 11.7727 11.7727 11.8517 11.8517 12.2584 12.2584 12.2982 12.2982 12.3539 12.3539 12.3856 12.3856 12.4634 12.4634 12.7444 12.7444 13.0102 13.0102 13.3761 13.3761 18.5374 18.5374 19.0188 19.0188 k = 0.0000 0.3929-0.0000 ( 1646 PWs) bands (ev): 5.9553 5.9553 7.8566 7.8566 8.1497 8.1497 8.9559 8.9559 9.0987 9.0987 9.4897 9.4897 10.0000 10.0000 10.7498 10.7498 10.9103 10.9103 11.0705 11.0705 11.3125 11.3125 11.6622 11.6622 11.7966 11.7966 11.8419 11.8419 12.2385 12.2385 12.2718 12.2718 12.3176 12.3176 12.3572 12.3572 12.4707 12.4707 12.7282 12.7282 13.0099 13.0099 13.3749 13.3749 18.6774 18.6774 19.1710 19.1710 k = 0.0000 0.4048-0.0000 ( 1646 PWs) bands (ev): 6.0364 6.0364 7.8199 7.8199 8.1637 8.1637 8.9589 8.9589 9.1132 9.1132 9.5132 9.5132 10.0382 10.0382 10.7368 10.7368 10.8786 10.8786 11.0259 11.0259 11.2478 11.2478 11.6611 11.6611 11.8219 11.8219 11.8386 11.8386 12.2202 12.2202 12.2456 12.2456 12.2838 12.2838 12.3262 12.3262 12.4805 12.4805 12.7126 12.7126 13.0097 13.0097 13.3739 13.3739 18.8153 18.8153 19.3235 19.3235 k = 0.0000 0.4167-0.0000 ( 1646 PWs) bands (ev): 6.1151 6.1151 7.7796 7.7796 8.1762 8.1762 8.9619 8.9619 9.1265 9.1265 9.5354 9.5354 10.0763 10.0763 10.7252 10.7252 10.8511 10.8511 10.9849 10.9849 11.1841 11.1841 11.6597 11.6597 11.8415 11.8415 11.8481 11.8481 12.2036 12.2036 12.2186 12.2186 12.2538 12.2538 12.2944 12.2944 12.4914 12.4914 12.6975 12.6975 13.0096 13.0096 13.3730 13.3730 18.9503 18.9503 19.4760 19.4760 k = 0.0000 0.4286-0.0000 ( 1646 PWs) bands (ev): 6.1902 6.1902 7.7373 7.7373 8.1873 8.1873 8.9648 8.9648 9.1383 9.1383 9.5559 9.5559 10.1135 10.1135 10.7146 10.7146 10.8284 10.8284 10.9479 10.9479 11.1231 11.1231 11.6577 11.6577 11.8505 11.8505 11.8754 11.8754 12.1888 12.1888 12.1894 12.1894 12.2291 12.2291 12.2618 12.2618 12.5028 12.5028 12.6828 12.6828 13.0094 13.0094 13.3722 13.3722 19.0807 19.0807 19.6278 19.6278 k = 0.0000 0.4405-0.0000 ( 1646 PWs) bands (ev): 6.2601 6.2601 7.6944 7.6944 8.1969 8.1969 8.9675 8.9675 9.1486 9.1486 9.5742 9.5742 10.1488 10.1488 10.7054 10.7054 10.8111 10.8111 10.9155 10.9155 11.0656 11.0656 11.6548 11.6548 11.8644 11.8644 11.9036 11.9036 12.1584 12.1584 12.1760 12.1760 12.2096 12.2096 12.2291 12.2291 12.5143 12.5143 12.6687 12.6687 13.0093 13.0093 13.3715 13.3715 19.2046 19.2046 19.7782 19.7782 k = 0.0000 0.4524-0.0000 ( 1646 PWs) bands (ev): 6.3228 6.3228 7.6534 7.6534 8.2048 8.2048 8.9700 8.9700 9.1572 9.1572 9.5900 9.5900 10.1810 10.1810 10.6977 10.6977 10.7997 10.7997 10.8882 10.8882 11.0125 11.0125 11.6515 11.6515 11.8819 11.8819 11.9323 11.9323 12.1273 12.1273 12.1653 12.1653 12.1944 12.1944 12.1967 12.1967 12.5257 12.5257 12.6552 12.6552 13.0092 13.0092 13.3710 13.3710 19.3188 19.3188 19.9257 19.9257 k = 0.0000 0.4643-0.0000 ( 1646 PWs) bands (ev): 6.3759 6.3759 7.6168 7.6168 8.2111 8.2111 8.9721 8.9721 9.1639 9.1639 9.6028 9.6028 10.2086 10.2086 10.6915 10.6915 10.7947 10.7947 10.8664 10.8664 10.9650 10.9650 11.6484 11.6484 11.9017 11.9017 11.9612 11.9612 12.0972 12.0972 12.1561 12.1561 12.1655 12.1655 12.1828 12.1828 12.5367 12.5367 12.6428 12.6428 13.0091 13.0091 13.3706 13.3706 19.4191 19.4191 20.0672 20.0672 k = 0.0000 0.4762-0.0000 ( 1654 PWs) bands (ev): 6.4167 6.4167 7.5876 7.5876 8.2155 8.2155 8.9736 8.9736 9.1688 9.1688 9.6122 9.6122 10.2299 10.2299 10.6870 10.6870 10.7955 10.7955 10.8503 10.8503 10.9248 10.9248 11.6460 11.6460 11.9221 11.9221 11.9897 11.9897 12.0696 12.0696 12.1333 12.1333 12.1516 12.1516 12.1745 12.1745 12.5464 12.5464 12.6320 12.6320 13.0088 13.0088 13.3701 13.3701 19.4992 19.4992 20.1960 20.1960 k = 0.0000 0.4881-0.0000 ( 1654 PWs) bands (ev): 6.4426 6.4426 7.5686 7.5686 8.2182 8.2182 8.9746 8.9746 9.1718 9.1718 9.6180 9.6180 10.2434 10.2434 10.6843 10.6843 10.8008 10.8008 10.8407 10.8407 10.8953 10.8953 11.6444 11.6444 11.9399 11.9399 12.0153 12.0153 12.0476 12.0476 12.1066 12.1066 12.1477 12.1477 12.1696 12.1696 12.5537 12.5537 12.6241 12.6241 13.0088 13.0088 13.3700 13.3700 19.5519 19.5519 20.2966 20.2966 k = 0.0000 0.5000-0.0000 ( 1654 PWs) bands (ev): 6.4515 6.4515 7.5620 7.5620 8.2191 8.2191 8.9750 8.9750 9.1728 9.1728 9.6200 9.6200 10.2480 10.2480 10.6834 10.6834 10.8043 10.8043 10.8374 10.8374 10.8835 10.8835 11.6439 11.6439 11.9479 11.9479 12.0283 12.0283 12.0382 12.0382 12.0932 12.0932 12.1464 12.1464 12.1679 12.1679 12.5565 12.5565 12.6211 12.6211 13.0088 13.0088 13.3699 13.3699 19.5704 19.5704 20.3376 20.3376 k = 0.0000 0.5000-0.0000 ( 1654 PWs) bands (ev): 6.4515 6.4515 7.5620 7.5620 8.2191 8.2191 8.9750 8.9750 9.1728 9.1728 9.6200 9.6200 10.2480 10.2480 10.6834 10.6834 10.8043 10.8043 10.8374 10.8374 10.8835 10.8835 11.6439 11.6439 11.9479 11.9479 12.0283 12.0283 12.0382 12.0382 12.0932 12.0932 12.1464 12.1464 12.1679 12.1679 12.5565 12.5565 12.6211 12.6211 13.0088 13.0088 13.3699 13.3699 19.5704 19.5704 20.3376 20.3376 k = 0.0119 0.5000-0.0000 ( 1654 PWs) bands (ev): 6.4532 6.4532 7.5626 7.5626 8.2199 8.2199 8.9749 8.9749 9.1732 9.1732 9.6197 9.6197 10.2487 10.2487 10.6836 10.6836 10.8020 10.8020 10.8343 10.8343 10.8874 10.8874 11.6411 11.6411 11.9493 11.9493 12.0288 12.0288 12.0387 12.0387 12.0931 12.0931 12.1465 12.1465 12.1685 12.1685 12.5571 12.5571 12.6217 12.6217 13.0081 13.0081 13.3682 13.3682 19.5630 19.5630 20.3267 20.3267 k = 0.0238 0.5000-0.0000 ( 1642 PWs) bands (ev): 6.4582 6.4582 7.5641 7.5641 8.2223 8.2223 8.9748 8.9748 9.1745 9.1745 9.6191 9.6191 10.2507 10.2507 10.6842 10.6842 10.7941 10.7941 10.8290 10.8290 10.8959 10.8959 11.6330 11.6330 11.9531 11.9531 12.0296 12.0296 12.0408 12.0408 12.0929 12.0929 12.1469 12.1469 12.1704 12.1704 12.5589 12.5589 12.6238 12.6238 13.0063 13.0063 13.3634 13.3634 19.5395 19.5395 20.2978 20.2978 k = 0.0357 0.5000-0.0000 ( 1642 PWs) bands (ev): 6.4665 6.4665 7.5668 7.5668 8.2261 8.2261 8.9747 8.9747 9.1767 9.1767 9.6180 9.6180 10.2538 10.2538 10.6852 10.6852 10.7799 10.7799 10.8254 10.8254 10.9053 10.9053 11.6205 11.6205 11.9582 11.9582 12.0298 12.0298 12.0454 12.0454 12.0927 12.0927 12.1475 12.1475 12.1732 12.1732 12.5620 12.5620 12.6271 12.6271 13.0028 13.0028 13.3551 13.3551 19.4956 19.4956 20.2602 20.2603 k = 0.0476 0.5000-0.0000 ( 1638 PWs) bands (ev): 6.4781 6.4781 7.5704 7.5704 8.2315 8.2315 8.9745 8.9745 9.1796 9.1796 9.6165 9.6165 10.2583 10.2583 10.6866 10.6866 10.7613 10.7613 10.8237 10.8237 10.9141 10.9141 11.6043 11.6043 11.9635 11.9635 12.0291 12.0291 12.0525 12.0525 12.0929 12.0929 12.1483 12.1483 12.1767 12.1767 12.5665 12.5665 12.6320 12.6320 12.9980 12.9980 13.3437 13.3437 19.4267 19.4267 20.2241 20.2241 k = 0.0595 0.5000-0.0000 ( 1638 PWs) bands (ev): 6.4930 6.4930 7.5750 7.5750 8.2385 8.2385 8.9743 8.9743 9.1835 9.1835 9.6146 9.6146 10.2638 10.2638 10.6883 10.6883 10.7401 10.7401 10.8230 10.8230 10.9214 10.9214 11.5856 11.5856 11.9683 11.9683 12.0277 12.0277 12.0609 12.0609 12.0943 12.0943 12.1492 12.1492 12.1807 12.1807 12.5727 12.5727 12.6385 12.6385 12.9918 12.9918 13.3291 13.3291 19.3301 19.3301 20.1580 20.1580 k = 0.0714 0.5000-0.0000 ( 1642 PWs) bands (ev): 6.5112 6.5112 7.5804 7.5804 8.2468 8.2468 8.9742 8.9742 9.1881 9.1881 9.6123 9.6123 10.2704 10.2704 10.6898 10.6898 10.7174 10.7174 10.8227 10.8227 10.9270 10.9270 11.5649 11.5649 11.9721 11.9721 12.0257 12.0257 12.0684 12.0684 12.0980 12.0980 12.1502 12.1502 12.1847 12.1847 12.5809 12.5809 12.6468 12.6468 12.9842 12.9842 13.3116 13.3116 19.2078 19.2078 19.9751 19.9751 k = 0.0833 0.5000-0.0000 ( 1646 PWs) bands (ev): 6.5326 6.5326 7.5868 7.5868 8.2567 8.2567 8.9741 8.9741 9.1936 9.1936 9.6098 9.6098 10.2783 10.2783 10.6871 10.6871 10.6981 10.6981 10.8227 10.8227 10.9307 10.9307 11.5430 11.5430 11.9752 11.9752 12.0231 12.0231 12.0730 12.0730 12.1050 12.1050 12.1515 12.1515 12.1885 12.1885 12.5912 12.5912 12.6570 12.6570 12.9754 12.9754 13.2913 13.2913 19.0642 19.0642 19.7786 19.7786 k = 0.0952 0.5000-0.0000 ( 1642 PWs) bands (ev): 6.5572 6.5572 7.5939 7.5939 8.2680 8.2680 8.9742 8.9742 9.2000 9.2000 9.6071 9.6071 10.2873 10.2873 10.6651 10.6651 10.6975 10.6975 10.8228 10.8228 10.9325 10.9325 11.5204 11.5204 11.9776 11.9776 12.0201 12.0201 12.0748 12.0748 12.1141 12.1141 12.1531 12.1531 12.1920 12.1920 12.6043 12.6043 12.6695 12.6695 12.9653 12.9653 13.2684 13.2684 18.9050 18.9050 19.5808 19.5808 k = 0.1071 0.5000-0.0000 ( 1638 PWs) bands (ev): 6.5850 6.5850 7.6018 7.6018 8.2807 8.2807 8.9745 8.9745 9.2074 9.2074 9.6041 9.6041 10.2974 10.2974 10.6391 10.6391 10.7005 10.7005 10.8230 10.8230 10.9325 10.9325 11.4973 11.4973 11.9796 11.9796 12.0165 12.0165 12.0752 12.0752 12.1232 12.1232 12.1551 12.1551 12.1949 12.1949 12.6200 12.6200 12.6842 12.6842 12.9540 12.9540 13.2431 13.2431 18.7347 18.7347 19.3836 19.3836 k = 0.1190 0.5000-0.0000 ( 1634 PWs) bands (ev): 6.6158 6.6158 7.6102 7.6102 8.2947 8.2947 8.9751 8.9751 9.2156 9.2156 9.6011 9.6011 10.3085 10.3085 10.6122 10.6122 10.7044 10.7044 10.8233 10.8233 10.9306 10.9306 11.4741 11.4741 11.9812 11.9812 12.0120 12.0120 12.0747 12.0747 12.1302 12.1302 12.1576 12.1576 12.1970 12.1970 12.6386 12.6386 12.7013 12.7013 12.9416 12.9416 13.2158 13.2158 18.5571 18.5571 19.1876 19.1876 k = 0.1310 0.5000-0.0000 ( 1634 PWs) bands (ev): 6.6497 6.6497 7.6192 7.6192 8.3100 8.3100 8.9761 8.9761 9.2247 9.2247 9.5980 9.5980 10.3208 10.3208 10.5847 10.5847 10.7084 10.7084 10.8236 10.8236 10.9270 10.9270 11.4508 11.4508 11.9827 11.9827 12.0067 12.0067 12.0737 12.0737 12.1348 12.1348 12.1603 12.1603 12.1982 12.1982 12.6600 12.6600 12.7210 12.7210 12.9282 12.9282 13.1864 13.1864 18.3748 18.3748 18.9936 18.9936 k = 0.1429 0.5000-0.0000 ( 1644 PWs) bands (ev): 6.6866 6.6866 7.6285 7.6285 8.3265 8.3265 8.9775 8.9775 9.2346 9.2346 9.5948 9.5948 10.3337 10.3337 10.5566 10.5566 10.7127 10.7127 10.8238 10.8238 10.9217 10.9217 11.4277 11.4277 11.9838 11.9838 12.0004 12.0004 12.0724 12.0724 12.1370 12.1370 12.1624 12.1624 12.1984 12.1984 12.6840 12.6840 12.7432 12.7432 12.9138 12.9138 13.1554 13.1554 18.1898 18.1898 18.8018 18.8018 k = 0.1548 0.5000-0.0000 ( 1634 PWs) bands (ev): 6.7264 6.7264 7.6382 7.6382 8.3442 8.3442 8.9795 8.9795 9.2456 9.2456 9.5917 9.5917 10.3480 10.3480 10.5284 10.5284 10.7178 10.7178 10.8240 10.8240 10.9149 10.9149 11.4051 11.4051 11.9841 11.9841 11.9939 11.9939 12.0711 12.0711 12.1375 12.1375 12.1636 12.1636 12.1977 12.1977 12.7103 12.7103 12.7681 12.7681 12.8988 12.8988 13.1233 13.1233 18.0036 18.0036 18.6126 18.6126 k = 0.1667 0.5000-0.0000 ( 1634 PWs) bands (ev): 6.7690 6.7690 7.6480 7.6480 8.3630 8.3630 8.9821 8.9821 9.2574 9.2574 9.5886 9.5886 10.3631 10.3631 10.5000 10.5000 10.7228 10.7228 10.8241 10.8241 10.9069 10.9069 11.3827 11.3827 11.9797 11.9797 11.9904 11.9904 12.0697 12.0697 12.1367 12.1367 12.1632 12.1632 12.1959 12.1959 12.7381 12.7381 12.7953 12.7953 12.8837 12.8837 13.0902 13.0902 17.8174 17.8174 18.4263 18.4263 k = 0.1786 0.5000-0.0000 ( 1634 PWs) bands (ev): 6.8143 6.8143 7.6579 7.6579 8.3829 8.3829 8.9855 8.9855 9.2701 9.2701 9.5857 9.5857 10.3790 10.3790 10.4715 10.4715 10.7280 10.7280 10.8240 10.8240 10.8977 10.8977 11.3609 11.3609 11.9697 11.9697 11.9910 11.9910 12.0683 12.0683 12.1346 12.1346 12.1613 12.1613 12.1930 12.1930 12.7661 12.7661 12.8230 12.8230 12.8710 12.8710 13.0569 13.0569 17.6319 17.6319 18.2429 18.2429 k = 0.1905 0.5000-0.0000 ( 1628 PWs) bands (ev): 6.8623 6.8623 7.6678 7.6678 8.4037 8.4037 8.9898 8.9898 9.2837 9.2837 9.5828 9.5828 10.3952 10.3952 10.4434 10.4434 10.7335 10.7335 10.8237 10.8237 10.8876 10.8876 11.3398 11.3398 11.9571 11.9571 11.9925 11.9925 12.0670 12.0670 12.1315 12.1315 12.1579 12.1579 12.1889 12.1889 12.7910 12.7910 12.8393 12.8393 12.8747 12.8747 13.0245 13.0245 17.4481 17.4481 18.0629 18.0629 k = 0.2024 0.5000-0.0000 ( 1628 PWs) bands (ev): 6.9128 6.9128 7.6774 7.6774 8.4254 8.4254 8.9950 8.9950 9.2983 9.2983 9.5802 9.5802 10.4057 10.4057 10.4216 10.4216 10.7391 10.7391 10.8229 10.8229 10.8771 10.8771 11.3190 11.3190 11.9422 11.9422 11.9944 11.9944 12.0658 12.0658 12.1273 12.1273 12.1532 12.1532 12.1838 12.1838 12.8012 12.8012 12.8435 12.8435 12.9043 12.9043 12.9954 12.9954 17.2663 17.2663 17.8862 17.8862 k = 0.2143 0.5000-0.0000 ( 1632 PWs) bands (ev): 6.9656 6.9656 7.6868 7.6868 8.4479 8.4479 9.0011 9.0011 9.3137 9.3137 9.5776 9.5776 10.3830 10.3830 10.4338 10.4338 10.7449 10.7449 10.8214 10.8214 10.8665 10.8665 11.2989 11.2989 11.9251 11.9251 11.9965 11.9965 12.0647 12.0647 12.1219 12.1219 12.1473 12.1473 12.1776 12.1776 12.7906 12.7906 12.8540 12.8540 12.9404 12.9404 12.9766 12.9766 17.0872 17.0872 17.7131 17.7131 k = 0.2262 0.5000-0.0000 ( 1628 PWs) bands (ev): 7.0207 7.0207 7.6958 7.6958 8.4711 8.4711 9.0084 9.0084 9.3300 9.3300 9.5753 9.5753 10.3547 10.3547 10.4521 10.4521 10.7508 10.7508 10.8185 10.8185 10.8567 10.8567 11.2795 11.2795 11.9058 11.9058 11.9987 11.9987 12.0639 12.0639 12.1157 12.1157 12.1406 12.1406 12.1706 12.1706 12.7725 12.7725 12.8516 12.8516 12.9684 12.9684 12.9891 12.9891 16.9112 16.9112 17.5437 17.5437 k = 0.2381 0.5000-0.0000 ( 1632 PWs) bands (ev): 7.0779 7.0779 7.7043 7.7043 8.4949 8.4949 9.0169 9.0169 9.3471 9.3471 9.5731 9.5731 10.3260 10.3260 10.4712 10.4712 10.7566 10.7566 10.8135 10.8135 10.8487 10.8487 11.2607 11.2607 11.8842 11.8842 12.0009 12.0009 12.0632 12.0632 12.1084 12.1084 12.1329 12.1329 12.1627 12.1627 12.7518 12.7518 12.8311 12.8311 12.9916 12.9916 13.0294 13.0294 16.7387 16.7387 17.3781 17.3781 k = 0.2500 0.5000-0.0000 ( 1634 PWs) bands (ev): 7.1369 7.1369 7.7123 7.7123 8.5192 8.5192 9.0265 9.0265 9.3650 9.3650 9.5711 9.5711 10.2971 10.2971 10.4908 10.4908 10.7622 10.7622 10.8064 10.8064 10.8431 10.8431 11.2426 11.2426 11.8603 11.8603 12.0030 12.0030 12.0627 12.0627 12.1003 12.1003 12.1245 12.1245 12.1540 12.1540 12.7295 12.7295 12.8016 12.8016 13.0232 13.0232 13.0740 13.0740 16.5700 16.5700 17.2164 17.2164 k = 0.2619 0.5000-0.0000 ( 1634 PWs) bands (ev): 7.1976 7.1976 7.7197 7.7197 8.5439 8.5439 9.0374 9.0374 9.3835 9.3835 9.5692 9.5692 10.2683 10.2683 10.5106 10.5106 10.7670 10.7670 10.7980 10.7980 10.8397 10.8397 11.2254 11.2254 11.8342 11.8342 12.0048 12.0048 12.0622 12.0622 12.0919 12.0919 12.1154 12.1154 12.1448 12.1448 12.7060 12.7060 12.7691 12.7691 13.0596 13.0596 13.1204 13.1204 16.4054 16.4054 17.0589 17.0589 k = 0.2738 0.5000-0.0000 ( 1634 PWs) bands (ev): 7.2598 7.2598 7.7265 7.7265 8.5690 8.5690 9.0495 9.0495 9.4027 9.4027 9.5675 9.5675 10.2393 10.2393 10.5304 10.5304 10.7695 10.7695 10.7913 10.7913 10.8375 10.8375 11.2089 11.2089 11.8060 11.8060 12.0059 12.0059 12.0616 12.0616 12.0838 12.0838 12.1057 12.1057 12.1351 12.1351 12.6812 12.6812 12.7360 12.7360 13.0986 13.0986 13.1682 13.1682 16.2453 16.2453 16.9055 16.9055 k = 0.2857 0.5000-0.0000 ( 1630 PWs) bands (ev): 7.3232 7.3232 7.7325 7.7325 8.5942 8.5942 9.0628 9.0628 9.4223 9.4223 9.5658 9.5658 10.2104 10.2104 10.5500 10.5500 10.7665 10.7665 10.7903 10.7903 10.8362 10.8362 11.1933 11.1933 11.7755 11.7755 12.0057 12.0057 12.0600 12.0600 12.0773 12.0773 12.0957 12.0957 12.1253 12.1253 12.6549 12.6549 12.7036 12.7036 13.1396 13.1396 13.2172 13.2172 16.0899 16.0899 16.7564 16.7564 k = 0.2976 0.5000-0.0000 ( 1636 PWs) bands (ev): 7.3875 7.3875 7.7380 7.7380 8.6197 8.6197 9.0772 9.0772 9.4422 9.4422 9.5642 9.5642 10.1813 10.1813 10.5689 10.5689 10.7597 10.7597 10.7936 10.7936 10.8351 10.8351 11.1781 11.1781 11.7428 11.7428 12.0035 12.0035 12.0561 12.0561 12.0734 12.0734 12.0860 12.0860 12.1157 12.1157 12.6269 12.6269 12.6727 12.6727 13.1820 13.1820 13.2671 13.2671 15.9393 15.9393 16.6118 16.6118 k = 0.3095 0.5000-0.0000 ( 1632 PWs) bands (ev): 7.4524 7.4524 7.7428 7.7428 8.6452 8.6452 9.0927 9.0927 9.4622 9.4622 9.5626 9.5626 10.1521 10.1521 10.5866 10.5866 10.7536 10.7536 10.7989 10.7989 10.8343 10.8343 11.1641 11.1641 11.7081 11.7081 11.9988 11.9988 12.0502 12.0502 12.0697 12.0697 12.0793 12.0793 12.1069 12.1069 12.5976 12.5976 12.6436 12.6436 13.2256 13.2256 13.3177 13.3177 15.7938 15.7938 16.4717 16.4717 k = 0.3214 0.5000-0.0000 ( 1640 PWs) bands (ev): 7.5174 7.5174 7.7470 7.7470 8.6708 8.6708 9.1091 9.1091 9.4819 9.4819 9.5608 9.5608 10.1229 10.1229 10.6023 10.6023 10.7497 10.7497 10.8044 10.8044 10.8334 10.8334 11.1509 11.1509 11.6713 11.6713 11.9913 11.9913 12.0424 12.0424 12.0618 12.0618 12.0787 12.0787 12.1001 12.1001 12.5670 12.5670 12.6159 12.6159 13.2703 13.2703 13.3690 13.3690 15.6534 15.6534 16.3363 16.3363 k = 0.3333 0.5000-0.0000 ( 1648 PWs) bands (ev): 7.5821 7.5821 7.7508 7.7508 8.6964 8.6964 9.1263 9.1263 9.5012 9.5012 9.5589 9.5589 10.0935 10.0935 10.6153 10.6153 10.7496 10.7496 10.8100 10.8100 10.8326 10.8326 11.1385 11.1385 11.6326 11.6326 11.9817 11.9817 12.0328 12.0328 12.0525 12.0525 12.0804 12.0804 12.0969 12.0969 12.5362 12.5362 12.5895 12.5895 13.3161 13.3161 13.4207 13.4207 15.5184 15.5184 16.2057 16.2057 k = 0.3452 0.5000-0.0000 ( 1638 PWs) bands (ev): 7.6456 7.6456 7.7546 7.7546 8.7222 8.7222 9.1442 9.1442 9.5197 9.5197 9.5569 9.5569 10.0649 10.0649 10.6254 10.6254 10.7542 10.7542 10.8155 10.8155 10.8319 10.8319 11.1270 11.1270 11.5922 11.5922 11.9707 11.9707 12.0218 12.0218 12.0423 12.0423 12.0823 12.0823 12.0981 12.0981 12.5058 12.5058 12.5641 12.5641 13.3628 13.3628 13.4728 13.4728 15.3889 15.3889 16.0802 16.0802 k = 0.3571 0.5000-0.0000 ( 1642 PWs) bands (ev): 7.7054 7.7054 7.7604 7.7604 8.7481 8.7481 9.1625 9.1625 9.5368 9.5368 9.5545 9.5545 10.0366 10.0366 10.6324 10.6324 10.7634 10.7634 10.8207 10.8207 10.8311 10.8311 11.1163 11.1163 11.5500 11.5500 11.9588 11.9588 12.0097 12.0097 12.0310 12.0310 12.0845 12.0845 12.1030 12.1030 12.4758 12.4758 12.5392 12.5392 13.4103 13.4103 13.5250 13.5250 15.2649 15.2649 15.9598 15.9598 k = 0.3690 0.5000-0.0000 ( 1642 PWs) bands (ev): 7.7445 7.7445 7.7849 7.7849 8.7742 8.7742 9.1808 9.1808 9.5504 9.5504 9.5535 9.5535 10.0092 10.0092 10.6373 10.6373 10.7764 10.7764 10.8257 10.8257 10.8305 10.8305 11.1064 11.1064 11.5064 11.5064 11.9466 11.9466 11.9974 11.9974 12.0189 12.0189 12.0874 12.0874 12.1102 12.1102 12.4467 12.4467 12.5147 12.5147 13.4588 13.4588 13.5773 13.5773 15.1464 15.1464 15.8448 15.8448 k = 0.3810 0.5000-0.0000 ( 1638 PWs) bands (ev): 7.7527 7.7527 7.8375 7.8375 8.8006 8.8006 9.1989 9.1989 9.5480 9.5480 9.5655 9.5655 9.9831 9.9831 10.6414 10.6414 10.7923 10.7923 10.8291 10.8291 10.8311 10.8311 11.0975 11.0975 11.4617 11.4617 11.9346 11.9346 11.9853 11.9853 12.0066 12.0066 12.0913 12.0913 12.1190 12.1190 12.4188 12.4188 12.4907 12.4907 13.5081 13.5081 13.6294 13.6294 15.0333 15.0333 15.7355 15.7355 k = 0.3929 0.5000-0.0000 ( 1638 PWs) bands (ev): 7.7552 7.7552 7.8926 7.8926 8.8274 8.8274 9.2165 9.2165 9.5440 9.5440 9.5755 9.5755 9.9590 9.9590 10.6456 10.6456 10.8099 10.8099 10.8289 10.8289 10.8354 10.8354 11.0892 11.0892 11.4160 11.4160 11.9229 11.9229 11.9734 11.9734 11.9943 11.9943 12.0959 12.0959 12.1289 12.1289 12.3921 12.3921 12.4671 12.4671 13.5581 13.5581 13.6809 13.6809 14.9257 14.9257 15.6323 15.6323 k = 0.4048 0.5000-0.0000 ( 1634 PWs) bands (ev): 7.7564 7.7564 7.9450 7.9450 8.8547 8.8547 9.2330 9.2330 9.5390 9.5390 9.5823 9.5823 9.9378 9.9378 10.6507 10.6507 10.8255 10.8255 10.8308 10.8308 10.8405 10.8405 11.0818 11.0818 11.3699 11.3699 11.9119 11.9119 11.9621 11.9621 11.9824 11.9824 12.1014 12.1014 12.1399 12.1399 12.3669 12.3669 12.4440 12.4440 13.6088 13.6088 13.7316 13.7316 14.8236 14.8236 15.5356 15.5356 k = 0.4167 0.5000-0.0000 ( 1638 PWs) bands (ev): 7.7572 7.7572 7.9934 7.9934 8.8823 8.8823 9.2479 9.2479 9.5329 9.5329 9.5855 9.5855 9.9198 9.9198 10.6569 10.6569 10.8266 10.8266 10.8401 10.8401 10.8531 10.8531 11.0752 11.0752 11.3235 11.3235 11.9016 11.9016 11.9515 11.9515 11.9712 11.9712 12.1075 12.1075 12.1514 12.1514 12.3432 12.3432 12.4213 12.4213 13.6600 13.6600 13.7809 13.7809 14.7268 14.7268 15.4460 15.4460 k = 0.4286 0.5000-0.0000 ( 1636 PWs) bands (ev): 7.7576 7.7576 8.0369 8.0369 8.9101 8.9101 9.2608 9.2608 9.5257 9.5257 9.5855 9.5855 9.9055 9.9055 10.6642 10.6642 10.8259 10.8259 10.8440 10.8440 10.8733 10.8733 11.0693 11.0693 11.2775 11.2775 11.8923 11.8923 11.9419 11.9419 11.9611 11.9611 12.1145 12.1145 12.1637 12.1637 12.3214 12.3214 12.3992 12.3992 13.7114 13.7114 13.8284 13.8284 14.6355 14.6355 15.3643 15.3643 k = 0.4405 0.5000-0.0000 ( 1640 PWs) bands (ev): 7.7578 7.7578 8.0749 8.0749 8.9377 8.9377 9.2710 9.2710 9.5176 9.5176 9.5830 9.5830 9.8949 9.8949 10.6724 10.6724 10.8252 10.8252 10.8466 10.8466 10.8953 10.8953 11.0643 11.0643 11.2323 11.2323 11.8842 11.8842 11.9332 11.9332 11.9521 11.9521 12.1220 12.1220 12.1762 12.1762 12.3017 12.3017 12.3778 12.3778 13.7623 13.7623 13.8734 13.8734 14.5497 14.5497 15.2914 15.2914 k = 0.4524 0.5000-0.0000 ( 1640 PWs) bands (ev): 7.7579 7.7579 8.1067 8.1067 8.9642 8.9642 9.2781 9.2781 9.5089 9.5089 9.5792 9.5792 9.8876 9.8876 10.6808 10.6808 10.8245 10.8245 10.8486 10.8486 10.9186 10.9186 11.0600 11.0600 11.1883 11.1883 11.8774 11.8774 11.9257 11.9257 11.9447 11.9447 12.1300 12.1300 12.1885 12.1885 12.2847 12.2847 12.3571 12.3571 13.8116 13.8116 13.9156 13.9156 14.4700 14.4700 15.2286 15.2286 k = 0.4643 0.5000-0.0000 ( 1640 PWs) bands (ev): 7.7579 7.7579 8.1319 8.1319 8.9883 8.9883 9.2818 9.2818 9.5007 9.5007 9.5751 9.5751 9.8830 9.8830 10.6888 10.6888 10.8238 10.8238 10.8500 10.8500 10.9436 10.9436 11.0566 11.0566 11.1461 11.1461 11.8720 11.8720 11.9197 11.9197 11.9388 11.9388 12.1381 12.1381 12.1993 12.1993 12.2720 12.2720 12.3375 12.3375 13.8568 13.8568 13.9546 13.9546 14.3974 14.3974 15.1773 15.1773 k = 0.4762 0.5000-0.0000 ( 1632 PWs) bands (ev): 7.7579 7.7579 8.1501 8.1501 9.0081 9.0081 9.2827 9.2827 9.4941 9.4941 9.5716 9.5716 9.8802 9.8802 10.6954 10.6954 10.8233 10.8233 10.8510 10.8510 10.9705 10.9705 11.0541 11.0541 11.1064 11.1064 11.8681 11.8681 11.9152 11.9152 11.9346 11.9346 12.1458 12.1458 12.2066 12.2066 12.2657 12.2657 12.3193 12.3193 13.8940 13.8940 13.9902 13.9902 14.3346 14.3346 15.1391 15.1391 k = 0.4881 0.5000-0.0000 ( 1632 PWs) bands (ev): 7.7579 7.7579 8.1612 8.1612 9.0214 9.0214 9.2822 9.2822 9.4897 9.4897 9.5693 9.5693 9.8789 9.8789 10.6998 10.6998 10.8230 10.8230 10.8516 10.8516 10.9995 10.9995 11.0513 11.0513 11.0704 11.0704 11.8657 11.8657 11.9125 11.9125 11.9320 11.9320 12.1516 12.1516 12.2089 12.2089 12.2671 12.2671 12.3040 12.3040 13.9183 13.9183 14.0194 14.0194 14.2878 14.2878 15.1155 15.1155 k = 0.5000 0.5000-0.0000 ( 1628 PWs) bands (ev): 7.7579 7.7579 8.1649 8.1649 9.0261 9.0261 9.2817 9.2817 9.4883 9.4883 9.5685 9.5685 9.8785 9.8785 10.7014 10.7014 10.8229 10.8229 10.8517 10.8517 11.0262 11.0262 11.0356 11.0356 11.0561 11.0561 11.8650 11.8650 11.9116 11.9116 11.9312 11.9312 12.1539 12.1539 12.2089 12.2089 12.2704 12.2704 12.2966 12.2966 13.9267 13.9267 14.0319 14.0319 14.2693 14.2693 15.1074 15.1074 k = 0.5000 0.5000-0.0000 ( 1628 PWs) bands (ev): 7.7579 7.7579 8.1649 8.1649 9.0261 9.0261 9.2817 9.2817 9.4883 9.4883 9.5685 9.5685 9.8785 9.8785 10.7014 10.7014 10.8229 10.8229 10.8517 10.8517 11.0262 11.0262 11.0356 11.0356 11.0561 11.0561 11.8650 11.8650 11.9116 11.9116 11.9312 11.9312 12.1539 12.1539 12.2089 12.2089 12.2704 12.2704 12.2966 12.2966 13.9267 13.9267 14.0319 14.0319 14.2693 14.2693 15.1074 15.1074 k = 0.4917 0.4917-0.0000 ( 1636 PWs) bands (ev): 7.7579 7.7579 8.1612 8.1612 9.0215 9.0215 9.2822 9.2822 9.4897 9.4897 9.5693 9.5693 9.8788 9.8788 10.6998 10.6998 10.8229 10.8229 10.8516 10.8516 10.9996 10.9996 11.0522 11.0522 11.0694 11.0694 11.8656 11.8656 11.9124 11.9124 11.9319 11.9319 12.1515 12.1515 12.2092 12.2092 12.2669 12.2669 12.3038 12.3038 13.9178 13.9178 14.0207 14.0207 14.2870 14.2870 15.1153 15.1153 k = 0.4833 0.4833-0.0000 ( 1638 PWs) bands (ev): 7.7577 7.7577 8.1506 8.1506 9.0085 9.0085 9.2828 9.2828 9.4939 9.4939 9.5716 9.5716 9.8801 9.8801 10.6954 10.6954 10.8231 10.8231 10.8513 10.8513 10.9702 10.9702 11.0572 11.0572 11.1031 11.1031 11.8680 11.8680 11.9151 11.9151 11.9345 11.9345 12.1444 12.1444 12.2102 12.2102 12.2629 12.2629 12.3195 12.3195 13.8869 13.8869 14.0030 14.0030 14.3282 14.3282 15.1393 15.1393 k = 0.4750 0.4750-0.0000 ( 1638 PWs) bands (ev): 7.7568 7.7568 8.1334 8.1334 8.9893 8.9893 9.2821 9.2821 9.5002 9.5002 9.5752 9.5752 9.8821 9.8821 10.6887 10.6887 10.8227 10.8227 10.8515 10.8515 10.9429 10.9429 11.0635 11.0635 11.1398 11.1398 11.8720 11.8720 11.9193 11.9193 11.9389 11.9389 12.1329 12.1329 12.2126 12.2126 12.2628 12.2628 12.3382 12.3382 13.8343 13.8343 13.9944 13.9944 14.3766 14.3766 15.1797 15.1797 k = 0.4667 0.4667-0.0000 ( 1638 PWs) bands (ev): 7.7542 7.7542 8.1108 8.1108 8.9663 8.9663 9.2789 9.2789 9.5078 9.5078 9.5798 9.5798 9.8852 9.8852 10.6802 10.6802 10.8209 10.8209 10.8530 10.8530 10.9178 10.9178 11.0718 11.0718 11.1778 11.1778 11.8775 11.8775 11.9250 11.9250 11.9453 11.9453 12.1178 12.1178 12.2166 12.2166 12.2668 12.2668 12.3584 12.3584 13.7701 13.7701 13.9929 13.9929 14.4237 14.4237 15.2368 15.2368 k = 0.4583 0.4583-0.0000 ( 1638 PWs) bands (ev): 7.7483 7.7483 8.0845 8.0845 8.9416 8.9416 9.2726 9.2726 9.5154 9.5154 9.5851 9.5851 9.8891 9.8891 10.6709 10.6709 10.8172 10.8172 10.8565 10.8565 10.8950 10.8950 11.0817 11.0817 11.2167 11.2167 11.8846 11.8846 11.9319 11.9319 11.9539 11.9539 12.1001 12.1001 12.2223 12.2223 12.2743 12.2743 12.3795 12.3795 13.7011 13.7011 13.9953 13.9953 14.4661 14.4661 15.3104 15.3104 k = 0.4500 0.4500-0.0000 ( 1638 PWs) bands (ev): 7.7365 7.7365 8.0574 8.0574 8.9165 8.9165 9.2631 9.2631 9.5219 9.5219 9.5906 9.5906 9.8940 9.8940 10.6615 10.6615 10.8116 10.8116 10.8622 10.8622 10.8744 10.8744 11.0930 11.0930 11.2561 11.2561 11.8932 11.8932 11.9398 11.9398 11.9646 11.9646 12.0809 12.0809 12.2297 12.2297 12.2846 12.2846 12.4011 12.4011 13.6308 13.6308 14.0000 14.0000 14.5026 14.5026 15.3997 15.3997 k = 0.4417 0.4417-0.0000 ( 1636 PWs) bands (ev): 7.7156 7.7156 8.0330 8.0330 8.8920 8.8920 9.2506 9.2506 9.5263 9.5263 9.5958 9.5958 9.8995 9.8995 10.6528 10.6528 10.8047 10.8047 10.8558 10.8558 10.8697 10.8697 11.1054 11.1054 11.2956 11.2956 11.9034 11.9034 11.9490 11.9490 11.9773 11.9773 12.0609 12.0609 12.2388 12.2388 12.2974 12.2974 12.4231 12.4231 13.5606 13.5606 14.0064 14.0064 14.5336 14.5336 15.5034 15.5034 k = 0.4333 0.4333-0.0000 ( 1636 PWs) bands (ev): 7.6826 7.6826 8.0150 8.0150 8.8687 8.8687 9.2357 9.2357 9.5281 9.5281 9.6005 9.6005 9.9056 9.9056 10.6456 10.6456 10.7967 10.7967 10.8396 10.8396 10.8790 10.8790 11.1188 11.1188 11.3349 11.3349 11.9148 11.9148 11.9592 11.9592 11.9918 11.9918 12.0407 12.0407 12.2492 12.2492 12.3120 12.3120 12.4453 12.4453 13.4915 13.4915 14.0143 14.0143 14.5598 14.5598 15.6197 15.6197 k = 0.4250 0.4250-0.0000 ( 1636 PWs) bands (ev): 7.6361 7.6361 8.0051 8.0051 8.8467 8.8467 9.2186 9.2186 9.5269 9.5269 9.6043 9.6043 9.9116 9.9116 10.6404 10.6404 10.7881 10.7881 10.8254 10.8254 10.8897 10.8897 11.1327 11.1327 11.3738 11.3738 11.9269 11.9269 11.9707 11.9707 12.0067 12.0067 12.0222 12.0222 12.2611 12.2611 12.3283 12.3283 12.4675 12.4675 13.4238 13.4238 14.0235 14.0235 14.5822 14.5822 15.7472 15.7472 k = 0.4167 0.4167-0.0000 ( 1636 PWs) bands (ev): 7.5771 7.5771 8.0030 8.0030 8.8260 8.8260 9.1997 9.1997 9.5226 9.5226 9.6071 9.6071 9.9173 9.9173 10.6376 10.6376 10.7794 10.7794 10.8134 10.8134 10.9020 10.9020 11.1471 11.1471 11.4119 11.4119 11.9386 11.9386 11.9838 11.9838 12.0006 12.0006 12.0281 12.0281 12.2743 12.2743 12.3461 12.3461 12.4898 12.4898 13.3578 13.3578 14.0341 14.0341 14.6019 14.6019 15.8847 15.8847 k = 0.4083 0.4083-0.0000 ( 1640 PWs) bands (ev): 7.5077 7.5077 8.0072 8.0072 8.8063 8.8063 9.1793 9.1793 9.5151 9.5151 9.6088 9.6088 9.9221 9.9221 10.6373 10.6373 10.7709 10.7709 10.8038 10.8038 10.9158 10.9158 11.1617 11.1617 11.4490 11.4490 11.9447 11.9447 11.9887 11.9887 11.9994 11.9994 12.0470 12.0470 12.2886 12.2886 12.3651 12.3651 12.5121 12.5121 13.2937 13.2937 14.0458 14.0458 14.6195 14.6195 16.0311 16.0311 k = 0.4000 0.4000-0.0000 ( 1636 PWs) bands (ev): 7.4302 7.4302 8.0158 8.0158 8.7876 8.7876 9.1580 9.1580 9.5049 9.5049 9.6094 9.6094 9.9258 9.9258 10.6397 10.6397 10.7632 10.7632 10.7970 10.7970 10.9311 10.9311 11.1765 11.1765 11.4849 11.4849 11.9372 11.9372 11.9915 11.9915 12.0165 12.0165 12.0675 12.0675 12.3044 12.3044 12.3852 12.3852 12.5344 12.5344 13.2316 13.2316 14.0588 14.0588 14.6357 14.6357 16.1854 16.1854 k = 0.3917 0.3917-0.0000 ( 1636 PWs) bands (ev): 7.3464 7.3464 8.0273 8.0273 8.7694 8.7694 9.1359 9.1359 9.4920 9.4920 9.6088 9.6088 9.9280 9.9280 10.6440 10.6440 10.7565 10.7565 10.7930 10.7930 10.9480 10.9480 11.1912 11.1912 11.5192 11.5192 11.9204 11.9204 12.0039 12.0039 12.0364 12.0364 12.0892 12.0892 12.3212 12.3212 12.4062 12.4062 12.5567 12.5567 13.1715 13.1715 14.0730 14.0730 14.6509 14.6509 16.3471 16.3471 k = 0.3833 0.3833-0.0000 ( 1632 PWs) bands (ev): 7.2578 7.2578 8.0405 8.0405 8.7515 8.7515 9.1135 9.1135 9.4767 9.4767 9.6069 9.6069 9.9286 9.9286 10.6498 10.6498 10.7511 10.7511 10.7930 10.7930 10.9662 10.9662 11.2057 11.2057 11.5520 11.5520 11.9010 11.9010 12.0195 12.0195 12.0588 12.0588 12.1120 12.1120 12.3392 12.3392 12.4279 12.4279 12.5788 12.5788 13.1135 13.1135 14.0885 14.0885 14.6654 14.6654 16.5154 16.5154 k = 0.3750 0.3750-0.0000 ( 1632 PWs) bands (ev): 7.1656 7.1656 8.0546 8.0546 8.7335 8.7335 9.0913 9.0913 9.4595 9.4595 9.6036 9.6036 9.9274 9.9274 10.6564 10.6564 10.7474 10.7474 10.7978 10.7978 10.9859 10.9859 11.2200 11.2200 11.5830 11.5830 11.8810 11.8810 12.0363 12.0363 12.0835 12.0835 12.1356 12.1356 12.3581 12.3581 12.4502 12.4502 12.6009 12.6009 13.0577 13.0577 14.1052 14.1052 14.6795 14.6795 16.6900 16.6900 k = 0.3667 0.3667-0.0000 ( 1632 PWs) bands (ev): 7.0707 7.0707 8.0687 8.0687 8.7150 8.7150 9.0697 9.0697 9.4404 9.4404 9.5989 9.5989 9.9244 9.9244 10.6627 10.6627 10.7454 10.7454 10.8085 10.8085 11.0072 11.0072 11.2339 11.2339 11.6122 11.6122 11.8611 11.8611 12.0540 12.0540 12.1102 12.1102 12.1599 12.1599 12.3781 12.3781 12.4728 12.4728 12.6229 12.6229 13.0040 13.0040 14.1230 14.1230 14.6933 14.6933 16.8704 16.8704 k = 0.3583 0.3583-0.0000 ( 1624 PWs) bands (ev): 6.9738 6.9738 8.0823 8.0823 8.6957 8.6957 9.0492 9.0492 9.4200 9.4200 9.5927 9.5927 9.9199 9.9199 10.6685 10.6685 10.7455 10.7455 10.8254 10.8254 11.0303 11.0303 11.2474 11.2474 11.6395 11.6395 11.8420 11.8420 12.0726 12.0726 12.1387 12.1387 12.1847 12.1847 12.3989 12.3989 12.4958 12.4958 12.6447 12.6447 12.9526 12.9526 14.1420 14.1420 14.7071 14.7071 17.0563 17.0563 k = 0.3500 0.3500-0.0000 ( 1618 PWs) bands (ev): 6.8754 6.8754 8.0947 8.0947 8.6752 8.6752 9.0304 9.0304 9.3982 9.3982 9.5850 9.5850 9.9138 9.9138 10.6738 10.6738 10.7475 10.7475 10.8487 10.8487 11.0548 11.0548 11.2602 11.2602 11.6643 11.6643 11.8242 11.8242 12.0918 12.0918 12.1686 12.1686 12.2101 12.2101 12.4205 12.4205 12.5187 12.5187 12.6665 12.6665 12.9037 12.9037 14.1622 14.1622 14.7209 14.7209 17.2473 17.2473 k = 0.3417 0.3417-0.0000 ( 1614 PWs) bands (ev): 6.7761 6.7761 8.1054 8.1054 8.6532 8.6532 9.0135 9.0135 9.3756 9.3756 9.5757 9.5757 9.9064 9.9064 10.6790 10.6790 10.7518 10.7518 10.8776 10.8776 11.0810 11.0810 11.2724 11.2724 11.6859 11.6859 11.8083 11.8083 12.1116 12.1116 12.1996 12.1996 12.2360 12.2360 12.4428 12.4428 12.5415 12.5415 12.6879 12.6879 12.8575 12.8575 14.1835 14.1835 14.7347 14.7347 17.4432 17.4432 k = 0.3333 0.3333-0.0000 ( 1614 PWs) bands (ev): 6.6763 6.6763 8.1142 8.1142 8.6294 8.6294 8.9988 8.9988 9.3520 9.3520 9.5649 9.5649 9.8979 9.8979 10.6846 10.6846 10.7586 10.7586 10.9116 10.9116 11.1088 11.1088 11.2838 11.2838 11.7024 11.7024 11.7968 11.7968 12.1321 12.1321 12.2312 12.2312 12.2619 12.2619 12.4656 12.4656 12.5636 12.5636 12.7086 12.7086 12.8147 12.8147 14.2060 14.2060 14.7487 14.7487 17.6436 17.6436 k = 0.3250 0.3250-0.0000 ( 1616 PWs) bands (ev): 6.5764 6.5764 8.1207 8.1207 8.6036 8.6036 8.9865 8.9865 9.3279 9.3279 9.5526 9.5526 9.8883 9.8883 10.6910 10.6910 10.7682 10.7682 10.9501 10.9501 11.1383 11.1383 11.2943 11.2943 11.7100 11.7100 11.7933 11.7933 12.1532 12.1532 12.2634 12.2634 12.2881 12.2881 12.4888 12.4888 12.5845 12.5845 12.7266 12.7266 12.7783 12.7783 14.2296 14.2296 14.7629 14.7629 17.8482 17.8482 k = 0.3167 0.3167-0.0000 ( 1620 PWs) bands (ev): 6.4767 6.4767 8.1246 8.1246 8.5759 8.5759 8.9765 8.9765 9.3032 9.3032 9.5389 9.5389 9.8779 9.8779 10.6984 10.6984 10.7809 10.7809 10.9926 10.9926 11.1697 11.1697 11.3041 11.3041 11.7069 11.7069 11.8001 11.8001 12.1749 12.1749 12.2957 12.2957 12.3143 12.3143 12.5119 12.5119 12.6024 12.6024 12.7259 12.7259 12.7660 12.7660 14.2542 14.2542 14.7772 14.7772 18.0568 18.0568 k = 0.3083 0.3083-0.0000 ( 1622 PWs) bands (ev): 6.3774 6.3774 8.1260 8.1260 8.5464 8.5464 8.9685 8.9685 9.2782 9.2782 9.5237 9.5237 9.8668 9.8668 10.7073 10.7073 10.7971 10.7971 11.0386 11.0386 11.2030 11.2030 11.3129 11.3129 11.6965 11.6965 11.8139 11.8139 12.1972 12.1972 12.3279 12.3279 12.3407 12.3407 12.5345 12.5345 12.6130 12.6130 12.7078 12.7078 12.7817 12.7817 14.2799 14.2799 14.7917 14.7917 18.2688 18.2688 k = 0.3000 0.3000-0.0000 ( 1624 PWs) bands (ev): 6.2790 6.2790 8.1248 8.1248 8.5151 8.5151 8.9620 8.9620 9.2530 9.2530 9.5073 9.5073 9.8551 9.8551 10.7176 10.7176 10.8170 10.8170 11.0876 11.0876 11.2379 11.2379 11.3213 11.3213 11.6828 11.6828 11.8309 11.8309 12.2200 12.2200 12.3597 12.3597 12.3671 12.3671 12.5537 12.5537 12.6111 12.6111 12.7029 12.7029 12.8023 12.8023 14.3066 14.3066 14.8064 14.8064 18.4836 18.4836 k = 0.2917 0.2917-0.0000 ( 1624 PWs) bands (ev): 6.1814 6.1814 8.1211 8.1211 8.4825 8.4825 8.9568 8.9568 9.2277 9.2277 9.4896 9.4896 9.8429 9.8429 10.7292 10.7292 10.8410 10.8410 11.1393 11.1393 11.2741 11.2741 11.3295 11.3295 11.6680 11.6680 11.8490 11.8490 12.2433 12.2433 12.3899 12.3899 12.3945 12.3945 12.5591 12.5591 12.6092 12.6092 12.7134 12.7134 12.8238 12.8238 14.3342 14.3342 14.8213 14.8213 18.6999 18.6999 k = 0.2833 0.2833-0.0000 ( 1618 PWs) bands (ev): 6.0851 6.0851 8.1150 8.1150 8.4487 8.4487 8.9523 8.9523 9.2023 9.2023 9.4709 9.4709 9.8303 9.8303 10.7422 10.7422 10.8692 10.8692 11.1933 11.1933 11.3087 11.3087 11.3409 11.3409 11.6530 11.6530 11.8676 11.8676 12.2670 12.2670 12.4170 12.4170 12.4239 12.4239 12.5431 12.5431 12.6239 12.6239 12.7312 12.7312 12.8458 12.8458 14.3626 14.3626 14.8364 14.8364 18.9110 18.9110 k = 0.2750 0.2750-0.0000 ( 1622 PWs) bands (ev): 5.9901 5.9901 8.1067 8.1067 8.4140 8.4140 8.9479 8.9479 9.1769 9.1769 9.4512 9.4512 9.8173 9.8173 10.7561 10.7561 10.9018 10.9018 11.2493 11.2493 11.3291 11.3291 11.3678 11.3678 11.6381 11.6381 11.8861 11.8861 12.2909 12.2909 12.4421 12.4421 12.4525 12.4525 12.5207 12.5207 12.6453 12.6453 12.7517 12.7517 12.8681 12.8681 14.3919 14.3919 14.8516 14.8516 19.0384 19.0384 k = 0.2667 0.2667-0.0000 ( 1628 PWs) bands (ev): 5.8966 5.8966 8.0963 8.0963 8.3786 8.3786 8.9434 8.9434 9.1516 9.1516 9.4307 9.4307 9.8039 9.8039 10.7711 10.7711 10.9384 10.9384 11.3066 11.3066 11.3373 11.3373 11.4091 11.4091 11.6241 11.6241 11.9045 11.9045 12.3147 12.3147 12.4622 12.4622 12.4749 12.4749 12.5074 12.5074 12.6683 12.6683 12.7734 12.7734 12.8906 12.8906 14.4219 14.4219 14.8669 14.8669 18.9265 18.9265 k = 0.2583 0.2583-0.0000 ( 1628 PWs) bands (ev): 5.8048 5.8048 8.0842 8.0842 8.3428 8.3428 8.9383 8.9383 9.1265 9.1265 9.4094 9.4094 9.7902 9.7902 10.7869 10.7869 10.9789 10.9789 11.3426 11.3426 11.3649 11.3649 11.4558 11.4558 11.6111 11.6111 11.9226 11.9226 12.3391 12.3391 12.4543 12.4543 12.4957 12.4957 12.5234 12.5234 12.6915 12.6915 12.7956 12.7956 12.9134 12.9134 14.4526 14.4526 14.8824 14.8824 18.7724 18.7724 k = 0.2500 0.2500-0.0000 ( 1628 PWs) bands (ev): 5.7149 5.7149 8.0705 8.0705 8.3069 8.3069 8.9325 8.9325 9.1016 9.1016 9.3876 9.3876 9.7761 9.7761 10.8034 10.8034 11.0224 11.0224 11.3478 11.3478 11.4229 11.4229 11.5063 11.5063 11.6000 11.6000 11.9405 11.9405 12.3635 12.3635 12.4334 12.4334 12.5194 12.5194 12.5497 12.5497 12.7144 12.7144 12.8181 12.8181 12.9365 12.9365 14.4837 14.4837 14.8979 14.8979 18.6145 18.6145 k = 0.2417 0.2417-0.0000 ( 1628 PWs) bands (ev): 5.6269 5.6269 8.0554 8.0554 8.2710 8.2710 8.9259 8.9259 9.0770 9.0770 9.3654 9.3654 9.7617 9.7617 10.8205 10.8205 11.0676 11.0676 11.3542 11.3542 11.4788 11.4788 11.5603 11.5603 11.5926 11.5926 11.9582 11.9582 12.3880 12.3880 12.4118 12.4118 12.5431 12.5431 12.5771 12.5771 12.7368 12.7368 12.8406 12.8406 12.9599 12.9599 14.5153 14.5153 14.9136 14.9136 18.4566 18.4566 k = 0.2333 0.2333-0.0000 ( 1638 PWs) bands (ev): 5.5409 5.5409 8.0391 8.0391 8.2352 8.2352 8.9182 8.9182 9.0526 9.0526 9.3429 9.3429 9.7470 9.7470 10.8378 10.8378 11.1121 11.1121 11.3633 11.3633 11.5252 11.5252 11.5962 11.5962 11.6179 11.6179 11.9755 11.9755 12.3914 12.3914 12.4123 12.4123 12.5662 12.5662 12.6039 12.6039 12.7583 12.7583 12.8631 12.8631 12.9835 12.9835 14.5472 14.5472 14.9292 14.9292 18.2997 18.2997 k = 0.2250 0.2250-0.0000 ( 1636 PWs) bands (ev): 5.4572 5.4572 8.0219 8.0219 8.1998 8.1998 8.9096 8.9096 9.0287 9.0287 9.3202 9.3202 9.7322 9.7322 10.8555 10.8555 11.1525 11.1525 11.3776 11.3776 11.5457 11.5457 11.6294 11.6294 11.6785 11.6785 11.9927 11.9927 12.3724 12.3724 12.4365 12.4365 12.5890 12.5890 12.6304 12.6304 12.7793 12.7793 12.8856 12.8856 13.0075 13.0075 14.5793 14.5793 14.9448 14.9448 18.1442 18.1442 k = 0.2167 0.2167-0.0000 ( 1632 PWs) bands (ev): 5.3758 5.3758 8.0038 8.0038 8.1648 8.1648 8.9001 8.9001 9.0052 9.0052 9.2976 9.2976 9.7171 9.7171 10.8735 10.8735 11.1847 11.1847 11.3980 11.3980 11.5520 11.5520 11.6828 11.6828 11.7418 11.7418 12.0096 12.0096 12.3552 12.3552 12.4604 12.4604 12.6113 12.6113 12.6562 12.6562 12.7995 12.7995 12.9079 12.9079 13.0316 13.0316 14.6114 14.6114 14.9605 14.9605 17.9904 17.9904 k = 0.2083 0.2083-0.0000 ( 1638 PWs) bands (ev): 5.2967 5.2967 7.9852 7.9852 8.1304 8.1304 8.8897 8.8897 8.9821 8.9821 9.2749 9.2749 9.7019 9.7019 10.8913 10.8913 11.2062 11.2062 11.4210 11.4210 11.5642 11.5642 11.7420 11.7420 11.8068 11.8068 12.0264 12.0264 12.3396 12.3396 12.4837 12.4837 12.6329 12.6329 12.6812 12.6812 12.8190 12.8190 12.9299 12.9299 13.0559 13.0559 14.6434 14.6434 14.9762 14.9762 17.8382 17.8382 k = 0.2000 0.2000-0.0000 ( 1630 PWs) bands (ev): 5.2202 5.2202 7.9661 7.9661 8.0967 8.0967 8.8786 8.8786 8.9597 8.9597 9.2526 9.2526 9.6868 9.6868 10.9090 10.9090 11.2181 11.2181 11.4377 11.4377 11.5937 11.5937 11.8043 11.8043 11.8733 11.8733 12.0431 12.0431 12.3256 12.3256 12.5069 12.5069 12.6540 12.6540 12.7056 12.7056 12.8378 12.8378 12.9518 12.9518 13.0804 13.0804 14.6751 14.6751 14.9919 14.9919 17.6880 17.6880 k = 0.1917 0.1917-0.0000 ( 1638 PWs) bands (ev): 5.1462 5.1462 7.9467 7.9467 8.0638 8.0638 8.8669 8.8669 8.9377 8.9377 9.2306 9.2306 9.6716 9.6716 10.9262 10.9262 11.2228 11.2228 11.4433 11.4433 11.6428 11.6428 11.8688 11.8688 11.9399 11.9399 12.0598 12.0598 12.3131 12.3131 12.5294 12.5294 12.6743 12.6743 12.7291 12.7291 12.8559 12.8559 12.9732 12.9732 13.1049 13.1049 14.7062 14.7062 15.0076 15.0076 17.5399 17.5399 k = 0.1833 0.1833-0.0000 ( 1642 PWs) bands (ev): 5.0748 5.0748 7.9272 7.9272 8.0317 8.0317 8.8546 8.8546 8.9163 8.9163 9.2090 9.2090 9.6565 9.6565 10.9432 10.9432 11.2230 11.2230 11.4413 11.4413 11.7056 11.7056 11.9354 11.9354 12.0050 12.0050 12.0784 12.0784 12.3022 12.3022 12.5514 12.5514 12.6939 12.6939 12.7519 12.7519 12.8732 12.8732 12.9944 12.9944 13.1294 13.1294 14.7364 14.7364 15.0235 15.0235 17.3938 17.3938 k = 0.1750 0.1750-0.0000 ( 1642 PWs) bands (ev): 5.0062 5.0062 7.9076 7.9076 8.0006 8.0006 8.8420 8.8420 8.8955 8.8955 9.1879 9.1879 9.6416 9.6416 10.9598 10.9598 11.2202 11.2202 11.4353 11.4353 11.7762 11.7762 12.0040 12.0040 12.0619 12.0619 12.1052 12.1052 12.2927 12.2927 12.5727 12.5727 12.7129 12.7129 12.7740 12.7740 12.8902 12.8902 13.0152 13.0152 13.1538 13.1538 14.7655 14.7655 15.0395 15.0395 17.2501 17.2501 k = 0.1667 0.1667-0.0000 ( 1647 PWs) bands (ev): 4.9403 4.9403 7.8881 7.8881 7.9705 7.9705 8.8292 8.8292 8.8754 8.8754 9.1675 9.1675 9.6269 9.6269 10.9758 10.9758 11.2155 11.2155 11.4273 11.4273 11.8508 11.8508 12.0739 12.0739 12.0951 12.0951 12.1563 12.1563 12.2845 12.2845 12.5932 12.5932 12.7311 12.7311 12.7952 12.7952 12.9068 12.9068 13.0357 13.0357 13.1779 13.1779 14.7931 14.7931 15.0559 15.0559 17.1087 17.1087 k = 0.1583 0.1583-0.0000 ( 1643 PWs) bands (ev): 4.8773 4.8773 7.8688 7.8688 7.9416 7.9416 8.8162 8.8162 8.8560 8.8560 9.1477 9.1477 9.6126 9.6126 10.9914 10.9914 11.2098 11.2098 11.4187 11.4187 11.9266 11.9266 12.1137 12.1137 12.1483 12.1483 12.2193 12.2193 12.2780 12.2780 12.6129 12.6129 12.7486 12.7486 12.8157 12.8157 12.9232 12.9232 13.0560 13.0560 13.2019 13.2019 14.8188 14.8188 15.0727 15.0727 16.9700 16.9700 k = 0.1500 0.1500-0.0000 ( 1643 PWs) bands (ev): 4.8172 4.8172 7.8498 7.8498 7.9137 7.9137 8.8032 8.8032 8.8374 8.8374 9.1287 9.1287 9.5986 9.5986 11.0062 11.0062 11.2032 11.2032 11.4097 11.4097 12.0003 12.0003 12.1345 12.1345 12.2201 12.2201 12.2745 12.2745 12.2839 12.2839 12.6318 12.6318 12.7653 12.7653 12.8353 12.8353 12.9396 12.9396 13.0761 13.0761 13.2255 13.2255 14.8423 14.8423 15.0902 15.0902 16.8340 16.8340 k = 0.1417 0.1417-0.0000 ( 1647 PWs) bands (ev): 4.7600 4.7600 7.8313 7.8313 7.8871 7.8871 8.7903 8.7903 8.8195 8.8195 9.1104 9.1104 9.5851 9.5851 11.0201 11.0201 11.1962 11.1962 11.4007 11.4007 12.0654 12.0654 12.1614 12.1614 12.2615 12.2615 12.3045 12.3045 12.3476 12.3476 12.6499 12.6499 12.7813 12.7813 12.8539 12.8539 12.9562 12.9562 13.0960 13.0960 13.2487 13.2487 14.8629 14.8629 15.1085 15.1085 16.7011 16.7011 k = 0.1333 0.1333-0.0000 ( 1647 PWs) bands (ev): 4.7059 4.7059 7.8133 7.8133 7.8617 7.8617 8.7777 8.7777 8.8025 8.8025 9.0931 9.0931 9.5721 9.5721 11.0332 11.0332 11.1890 11.1890 11.3920 11.3920 12.1105 12.1105 12.2042 12.2042 12.2645 12.2645 12.3773 12.3773 12.4098 12.4098 12.6671 12.6671 12.7966 12.7966 12.8716 12.8716 12.9733 12.9733 13.1160 13.1160 13.2715 13.2715 14.8804 14.8804 15.1278 15.1278 16.5714 16.5714 k = 0.1250 0.1250-0.0000 ( 1643 PWs) bands (ev): 4.6548 4.6548 7.7959 7.7959 7.8377 7.8377 8.7654 8.7654 8.7863 8.7863 9.0766 9.0766 9.5597 9.5597 11.0455 11.0455 11.1818 11.1818 11.3839 11.3839 12.1360 12.1360 12.2410 12.2410 12.2894 12.2894 12.4522 12.4522 12.4700 12.4700 12.6837 12.6837 12.8111 12.8111 12.8882 12.8882 12.9912 12.9912 13.1361 13.1361 13.2939 13.2939 14.8943 14.8943 15.1480 15.1480 16.4453 16.4453 k = 0.1167 0.1167-0.0000 ( 1645 PWs) bands (ev): 4.6068 4.6068 7.7793 7.7793 7.8150 7.8150 8.7534 8.7534 8.7710 8.7710 9.0611 9.0611 9.5479 9.5479 11.0566 11.0566 11.1745 11.1745 11.3761 11.3761 12.1527 12.1527 12.2459 12.2459 12.3525 12.3525 12.5245 12.5245 12.5289 12.5289 12.6997 12.6997 12.8248 12.8248 12.9038 12.9038 13.0104 13.0104 13.1565 13.1565 13.3159 13.3159 14.9044 14.9044 15.1691 15.1691 16.3232 16.3232 k = 0.1083 0.1083-0.0000 ( 1649 PWs) bands (ev): 4.5620 4.5620 7.7634 7.7634 7.7937 7.7937 8.7420 8.7420 8.7566 8.7566 9.0465 9.0465 9.5367 9.5367 11.0666 11.0666 11.1674 11.1674 11.3690 11.3690 12.1657 12.1657 12.2452 12.2452 12.4226 12.4226 12.5808 12.5808 12.5971 12.5971 12.7158 12.7158 12.8377 12.8377 12.9183 12.9183 13.0313 13.0313 13.1775 13.1775 13.3376 13.3376 14.9105 14.9105 15.1909 15.1909 16.2056 16.2056 k = 0.1000 0.1000-0.0000 ( 1657 PWs) bands (ev): 4.5203 4.5203 7.7484 7.7484 7.7738 7.7738 8.7310 8.7310 8.7431 8.7431 9.0329 9.0329 9.5259 9.5259 11.0757 11.0757 11.1605 11.1605 11.3626 11.3626 12.1770 12.1770 12.2438 12.2438 12.4923 12.4923 12.6304 12.6304 12.6622 12.6622 12.7331 12.7331 12.8499 12.8499 12.9318 12.9318 13.0545 13.0545 13.1992 13.1992 13.3591 13.3591 14.9125 14.9125 15.2132 15.2132 16.0929 16.0929 k = 0.0917 0.0917-0.0000 ( 1645 PWs) bands (ev): 4.4819 4.4819 7.7343 7.7343 7.7554 7.7554 8.7209 8.7209 8.7307 8.7307 9.0205 9.0205 9.5162 9.5162 11.0839 11.0839 11.1541 11.1541 11.3571 11.3571 12.1870 12.1870 12.2425 12.2425 12.5598 12.5598 12.6733 12.6733 12.7185 12.7185 12.7558 12.7558 12.8615 12.8615 12.9444 12.9444 13.0805 13.0805 13.2218 13.2218 13.3808 13.3808 14.9103 14.9103 15.2355 15.2355 15.9859 15.9859 k = 0.0833 0.0833-0.0000 ( 1645 PWs) bands (ev): 4.4466 4.4466 7.7213 7.7213 7.7385 7.7385 8.7114 8.7114 8.7192 8.7192 9.0091 9.0091 9.5072 9.5072 11.0908 11.0908 11.1481 11.1481 11.3524 11.3524 12.1959 12.1959 12.2414 12.2414 12.6235 12.6235 12.7061 12.7061 12.7598 12.7598 12.7913 12.7913 12.8724 12.8724 12.9560 12.9560 13.1095 13.1095 13.2450 13.2450 13.4030 13.4030 14.9039 14.9039 15.2575 15.2575 15.8853 15.8853 k = 0.0750 0.0750-0.0000 ( 1645 PWs) bands (ev): 4.4147 4.4147 7.7093 7.7093 7.7231 7.7231 8.7026 8.7026 8.7087 8.7087 8.9986 8.9986 9.4990 9.4990 11.0968 11.0968 11.1424 11.1424 11.3484 11.3484 12.2038 12.2038 12.2404 12.2404 12.6819 12.6819 12.7286 12.7286 12.7931 12.7931 12.8325 12.8325 12.8829 12.8829 12.9668 12.9668 13.1415 13.1415 13.2687 13.2687 13.4261 13.4261 14.8932 14.8932 15.2788 15.2788 15.7921 15.7921 k = 0.0667 0.0667-0.0000 ( 1651 PWs) bands (ev): 4.3861 4.3861 7.6984 7.6984 7.7092 7.7092 8.6945 8.6945 8.6993 8.6993 8.9892 8.9892 9.4915 9.4915 11.1018 11.1018 11.1372 11.1372 11.3450 11.3450 12.2109 12.2109 12.2396 12.2396 12.7290 12.7290 12.7493 12.7493 12.8240 12.8240 12.8686 12.8686 12.8943 12.8943 12.9769 12.9769 13.1758 13.1758 13.2920 13.2920 13.4504 13.4504 14.8783 14.8783 15.2990 15.2990 15.7070 15.7070 k = 0.0583 0.0583-0.0000 ( 1651 PWs) bands (ev): 4.3607 4.3607 7.6887 7.6887 7.6969 7.6969 8.6873 8.6873 8.6909 8.6909 8.9810 8.9810 9.4849 9.4849 11.1059 11.1059 11.1325 11.1325 11.3424 11.3424 12.2171 12.2171 12.2389 12.2389 12.7480 12.7480 12.7873 12.7873 12.8512 12.8512 12.8930 12.8930 12.9122 12.9122 12.9862 12.9862 13.2117 13.2117 13.3139 13.3139 13.4763 13.4763 14.8596 14.8596 15.3179 15.3179 15.6310 15.6310 k = 0.0500 0.0500-0.0000 ( 1647 PWs) bands (ev): 4.3387 4.3387 7.6803 7.6803 7.6862 7.6862 8.6811 8.6811 8.6836 8.6836 8.9738 8.9738 9.4792 9.4792 11.1092 11.1092 11.1285 11.1285 11.3404 11.3404 12.2225 12.2225 12.2385 12.2385 12.7574 12.7574 12.8250 12.8250 12.8729 12.8729 12.9062 12.9062 12.9375 12.9375 12.9947 12.9947 13.2480 13.2480 13.3334 13.3334 13.5032 13.5032 14.8378 14.8378 15.3349 15.3349 15.5650 15.5650 k = 0.0417 0.0417-0.0000 ( 1651 PWs) bands (ev): 4.3201 4.3201 7.6731 7.6731 7.6771 7.6771 8.6756 8.6756 8.6774 8.6774 8.9676 8.9676 9.4741 9.4741 11.1117 11.1117 11.1249 11.1249 11.3388 11.3388 12.2271 12.2271 12.2381 12.2381 12.7642 12.7642 12.8553 12.8553 12.8883 12.8883 12.9177 12.9177 12.9616 12.9616 13.0024 13.0024 13.2833 13.2833 13.3498 13.3498 13.5301 13.5301 14.8138 14.8138 15.3500 15.3500 15.5093 15.5093 k = 0.0333 0.0333-0.0000 ( 1643 PWs) bands (ev): 4.3048 4.3048 7.6671 7.6671 7.6697 7.6697 8.6712 8.6712 8.6724 8.6724 8.9627 8.9627 9.4702 9.4702 11.1137 11.1137 11.1221 11.1221 11.3378 11.3378 12.2308 12.2308 12.2379 12.2379 12.7694 12.7694 12.8781 12.8781 12.8983 12.8983 12.9291 12.9291 12.9825 12.9825 13.0090 13.0090 13.3161 13.3161 13.3630 13.3630 13.5554 13.5554 14.7896 14.7896 15.3627 15.3627 15.4643 15.4643 k = 0.0250 0.0250-0.0000 ( 1641 PWs) bands (ev): 4.2929 4.2929 7.6625 7.6625 7.6639 7.6639 8.6678 8.6678 8.6684 8.6684 8.9588 8.9588 9.4669 9.4669 11.1151 11.1151 11.1198 11.1198 11.3370 11.3370 12.2337 12.2337 12.2377 12.2377 12.7733 12.7733 12.8939 12.8939 12.9047 12.9047 12.9396 12.9396 12.9994 12.9994 13.0144 13.0144 13.3445 13.3445 13.3730 13.3730 13.5773 13.5773 14.7671 14.7671 15.3729 15.3729 15.4297 15.4297 k = 0.0167 0.0167-0.0000 ( 1647 PWs) bands (ev): 4.2844 4.2844 7.6591 7.6591 7.6597 7.6597 8.6652 8.6652 8.6655 8.6655 8.9560 8.9560 9.4645 9.4645 11.1161 11.1161 11.1181 11.1181 11.3365 11.3365 12.2358 12.2358 12.2375 12.2375 12.7760 12.7760 12.9040 12.9040 12.9086 12.9086 12.9476 12.9476 13.0117 13.0117 13.0184 13.0184 13.3665 13.3665 13.3800 13.3800 13.5941 13.5941 14.7488 14.7488 15.3803 15.3803 15.4055 15.4055 k = 0.0083 0.0083-0.0000 ( 1647 PWs) bands (ev): 4.2793 4.2793 7.6571 7.6571 7.6572 7.6572 8.6637 8.6637 8.6638 8.6638 8.9543 8.9543 9.4631 9.4631 11.1166 11.1166 11.1171 11.1171 11.3362 11.3362 12.2370 12.2370 12.2375 12.2375 12.7776 12.7776 12.9096 12.9096 12.9107 12.9107 12.9527 12.9527 13.0192 13.0192 13.0209 13.0209 13.3806 13.3806 13.3841 13.3841 13.6048 13.6048 14.7368 14.7368 15.3848 15.3848 15.3911 15.3911 k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): 4.2776 4.2776 7.6564 7.6564 7.6564 7.6564 8.6632 8.6632 8.6632 8.6632 8.9538 8.9538 9.4627 9.4627 11.1168 11.1168 11.1168 11.1168 11.3361 11.3361 12.2374 12.2374 12.2374 12.2374 12.7781 12.7781 12.9114 12.9114 12.9114 12.9114 12.9544 12.9544 13.0217 13.0217 13.0217 13.0217 13.3854 13.3854 13.3854 13.3854 13.6085 13.6085 14.7326 14.7326 15.3863 15.3863 15.3863 15.3863 k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): 4.2776 4.2776 7.6564 7.6564 7.6564 7.6564 8.6632 8.6632 8.6632 8.6632 8.9538 8.9538 9.4627 9.4627 11.1168 11.1168 11.1168 11.1168 11.3361 11.3361 12.2374 12.2374 12.2374 12.2374 12.7781 12.7781 12.9114 12.9114 12.9114 12.9114 12.9544 12.9544 13.0217 13.0217 13.0217 13.0217 13.3854 13.3854 13.3854 13.3854 13.6085 13.6085 14.7326 14.7326 15.3863 15.3863 15.3863 15.3863 k = 0.0068 0.0068 0.0068 ( 1647 PWs) bands (ev): 4.2794 4.2794 7.6571 7.6571 7.6572 7.6572 8.6637 8.6637 8.6638 8.6638 8.9543 8.9543 9.4632 9.4632 11.1166 11.1166 11.1171 11.1171 11.3362 11.3362 12.2372 12.2372 12.2373 12.2373 12.7775 12.7775 12.9097 12.9097 12.9107 12.9107 12.9527 12.9527 13.0194 13.0194 13.0207 13.0207 13.3807 13.3807 13.3839 13.3839 13.6048 13.6048 14.7369 14.7369 15.3876 15.3876 15.3883 15.3883 k = 0.0137 0.0137 0.0137 ( 1647 PWs) bands (ev): 4.2845 4.2845 7.6591 7.6591 7.6598 7.6598 8.6652 8.6652 8.6656 8.6656 8.9560 8.9560 9.4645 9.4645 11.1161 11.1161 11.1181 11.1181 11.3365 11.3365 12.2363 12.2363 12.2370 12.2370 12.7759 12.7759 12.9043 12.9043 12.9082 12.9082 12.9474 12.9474 13.0124 13.0124 13.0176 13.0176 13.3669 13.3669 13.3792 13.3792 13.5939 13.5939 14.7494 14.7494 15.3914 15.3914 15.3942 15.3942 k = 0.0205 0.0205 0.0205 ( 1641 PWs) bands (ev): 4.2931 4.2931 7.6625 7.6625 7.6640 7.6640 8.6678 8.6678 8.6686 8.6686 8.9589 8.9589 9.4669 9.4669 11.1153 11.1153 11.1197 11.1197 11.3370 11.3370 12.2348 12.2348 12.2365 12.2365 12.7733 12.7733 12.8948 12.8948 12.9040 12.9040 12.9386 12.9386 13.0010 13.0010 13.0127 13.0127 13.3449 13.3449 13.3718 13.3718 13.5765 13.5765 14.7695 14.7695 15.3976 15.3976 15.4037 15.4037 k = 0.0274 0.0274 0.0274 ( 1635 PWs) bands (ev): 4.3052 4.3052 7.6673 7.6673 7.6700 7.6700 8.6713 8.6713 8.6726 8.6726 8.9629 8.9629 9.4704 9.4704 11.1139 11.1139 11.1219 11.1219 11.3378 11.3378 12.2328 12.2328 12.2358 12.2358 12.7695 12.7695 12.8803 12.8803 12.8973 12.8973 12.9263 12.9263 12.9857 12.9857 13.0061 13.0061 13.3160 13.3160 13.3616 13.3616 13.5535 13.5535 14.7961 14.7961 15.4060 15.4060 15.4164 15.4164 k = 0.0342 0.0342 0.0342 ( 1641 PWs) bands (ev): 4.3207 4.3207 7.6733 7.6733 7.6775 7.6775 8.6757 8.6757 8.6778 8.6778 8.9679 8.9679 9.4744 9.4744 11.1120 11.1120 11.1247 11.1247 11.3389 11.3389 12.2302 12.2302 12.2349 12.2349 12.7641 12.7641 12.8596 12.8596 12.8872 12.8872 12.9105 12.9105 12.9675 12.9675 12.9982 12.9982 13.2818 13.2818 13.3491 13.3491 13.5263 13.5263 14.8279 14.8279 15.4164 15.4164 15.4318 15.4318 k = 0.0411 0.0411 0.0411 ( 1650 PWs) bands (ev): 4.3395 4.3395 7.6806 7.6806 7.6867 7.6867 8.6810 8.6810 8.6841 8.6841 8.9740 8.9740 9.4793 9.4793 11.1095 11.1095 11.1281 11.1281 11.3404 11.3404 12.2270 12.2270 12.2339 12.2339 12.7574 12.7574 12.8318 12.8318 12.8720 12.8720 12.8911 12.8911 12.9481 12.9481 12.9892 12.9892 13.2442 13.2442 13.3346 13.3346 13.4961 13.4961 14.8638 14.8638 15.4285 15.4285 15.4492 15.4492 k = 0.0479 0.0479 0.0479 ( 1644 PWs) bands (ev): 4.3618 4.3618 7.6892 7.6892 7.6977 7.6977 8.6872 8.6872 8.6916 8.6916 8.9813 8.9813 9.4854 9.4854 11.1062 11.1062 11.1320 11.1320 11.3424 11.3424 12.2233 12.2233 12.2327 12.2327 12.7493 12.7493 12.7963 12.7963 12.8500 12.8500 12.8680 12.8680 12.9296 12.9296 12.9793 12.9793 13.2049 13.2049 13.3187 13.3187 13.4645 13.4645 14.9026 14.9026 15.4420 15.4420 15.4682 15.4682 k = 0.0548 0.0548 0.0548 ( 1656 PWs) bands (ev): 4.3875 4.3875 7.6990 7.6990 7.7102 7.7102 8.6942 8.6942 8.7002 8.7002 8.9897 8.9897 9.4920 9.4920 11.1021 11.1021 11.1365 11.1365 11.3451 11.3451 12.2190 12.2190 12.2314 12.2314 12.7387 12.7387 12.7529 12.7529 12.8200 12.8200 12.8409 12.8409 12.9126 12.9126 12.9682 12.9682 13.1652 13.1652 13.3015 13.3015 13.4329 13.4329 14.9432 14.9432 15.4567 15.4567 15.4880 15.4880 k = 0.0616 0.0616 0.0616 ( 1656 PWs) bands (ev): 4.4165 4.4165 7.7101 7.7101 7.7244 7.7244 8.7020 8.7020 8.7099 8.7099 8.9992 8.9992 9.4995 9.4995 11.0971 11.0971 11.1414 11.1414 11.3484 11.3484 12.2141 12.2141 12.2300 12.2300 12.7006 12.7006 12.7269 12.7269 12.7828 12.7828 12.8101 12.8101 12.8971 12.8971 12.9560 12.9560 13.1267 13.1267 13.2836 13.2836 13.4026 13.4026 14.9848 14.9848 15.4721 15.4721 15.5082 15.5082 k = 0.0685 0.0685 0.0685 ( 1656 PWs) bands (ev): 4.4489 4.4489 7.7223 7.7223 7.7403 7.7403 8.7106 8.7106 8.7207 8.7207 9.0098 9.0098 9.5079 9.5079 11.0911 11.0911 11.1469 11.1469 11.3525 11.3525 12.2086 12.2086 12.2287 12.2287 12.6424 12.6424 12.7095 12.7095 12.7398 12.7398 12.7768 12.7768 12.8818 12.8818 12.9419 12.9419 13.0905 13.0905 13.2653 13.2653 13.3745 13.3745 15.0268 15.0268 15.4879 15.4879 15.5283 15.5283 k = 0.0753 0.0753 0.0753 ( 1650 PWs) bands (ev): 4.4846 4.4846 7.7356 7.7356 7.7577 7.7577 8.7198 8.7198 8.7327 8.7327 9.0216 9.0216 9.5171 9.5171 11.0841 11.0841 11.1529 11.1529 11.3576 11.3576 12.2026 12.2026 12.2275 12.2275 12.5781 12.5781 12.6837 12.6837 12.6919 12.6919 12.7446 12.7446 12.8655 12.8655 12.9249 12.9249 13.0580 13.0580 13.2470 13.2470 13.3491 13.3491 15.0684 15.0684 15.5040 15.5040 15.5479 15.5479 k = 0.0822 0.0822 0.0822 ( 1650 PWs) bands (ev): 4.5236 4.5236 7.7499 7.7499 7.7768 7.7768 8.7295 8.7295 8.7457 8.7457 9.0345 9.0345 9.5270 9.5270 11.0757 11.0757 11.1591 11.1591 11.3634 11.3634 12.1956 12.1956 12.2261 12.2261 12.5093 12.5093 12.6401 12.6401 12.6451 12.6451 12.7182 12.7182 12.8480 12.8480 12.9039 12.9039 13.0304 13.0304 13.2290 13.2290 13.3267 13.3267 15.1092 15.1092 15.5199 15.5199 15.5668 15.5668 k = 0.0890 0.0890 0.0890 ( 1650 PWs) bands (ev): 4.5658 4.5658 7.7653 7.7653 7.7974 7.7974 8.7397 8.7397 8.7598 8.7598 9.0485 9.0485 9.5376 9.5376 11.0661 11.0661 11.1657 11.1657 11.3699 11.3699 12.1873 12.1873 12.2249 12.2249 12.4375 12.4375 12.5850 12.5850 12.5949 12.5949 12.6966 12.6966 12.8286 12.8286 12.8783 12.8783 13.0084 13.0084 13.2116 13.2116 13.3072 13.3072 15.1488 15.1488 15.5355 15.5355 15.5845 15.5845 k = 0.0959 0.0959 0.0959 ( 1650 PWs) bands (ev): 4.6113 4.6113 7.7815 7.7815 7.8196 7.8196 8.7502 8.7502 8.7750 8.7750 9.0636 9.0636 9.5490 9.5490 11.0552 11.0552 11.1725 11.1725 11.3773 11.3773 12.1769 12.1769 12.2238 12.2238 12.3648 12.3648 12.5273 12.5273 12.5369 12.5369 12.6764 12.6764 12.8071 12.8071 12.8486 12.8486 12.9913 12.9913 13.1950 13.1950 13.2902 13.2902 15.1870 15.1870 15.5505 15.5505 15.6010 15.6010 k = 0.1027 0.1027 0.1027 ( 1650 PWs) bands (ev): 4.6599 4.6599 7.7986 7.7986 7.8433 7.8433 8.7610 8.7610 8.7912 8.7912 9.0799 9.0799 9.5609 9.5609 11.0429 11.0429 11.1795 11.1795 11.3854 11.3854 12.1613 12.1613 12.2228 12.2228 12.2950 12.2950 12.4675 12.4675 12.4737 12.4737 12.6562 12.6562 12.7834 12.7834 12.8157 12.8157 12.9781 12.9781 13.1793 13.1793 13.2755 13.2755 15.2234 15.2234 15.5647 15.5647 15.6161 15.6161 k = 0.1096 0.1096 0.1096 ( 1653 PWs) bands (ev): 4.7116 4.7116 7.8164 7.8164 7.8685 7.8685 8.7718 8.7718 8.8085 8.8085 9.0973 9.0973 9.5735 9.5735 11.0290 11.0290 11.1867 11.1867 11.3941 11.3941 12.1321 12.1321 12.2217 12.2217 12.2374 12.2374 12.4061 12.4061 12.4067 12.4067 12.6352 12.6352 12.7574 12.7574 12.7805 12.7805 12.9676 12.9676 13.1647 13.1647 13.2627 13.2627 15.2578 15.2578 15.5779 15.5779 15.6295 15.6295 k = 0.1164 0.1164 0.1164 ( 1653 PWs) bands (ev): 4.7664 4.7664 7.8349 7.8349 7.8952 7.8952 8.7826 8.7826 8.8268 8.8268 9.1159 9.1159 9.5866 9.5866 11.0140 11.0140 11.1940 11.1940 11.4035 11.4035 12.0795 12.0795 12.2029 12.2029 12.2204 12.2204 12.3372 12.3372 12.3441 12.3441 12.6132 12.6132 12.7291 12.7291 12.7438 12.7438 12.9590 12.9590 13.1513 13.1513 13.2515 13.2515 15.2902 15.2902 15.5901 15.5901 15.6414 15.6414 k = 0.1233 0.1233 0.1233 ( 1653 PWs) bands (ev): 4.8243 4.8243 7.8539 7.8539 7.9234 7.9234 8.7932 8.7932 8.8461 8.8461 9.1357 9.1357 9.6000 9.6000 10.9976 10.9976 11.2013 11.2013 11.4134 11.4134 12.0107 12.0107 12.1844 12.1844 12.2167 12.2167 12.2664 12.2664 12.2840 12.2840 12.5901 12.5901 12.6987 12.6987 12.7060 12.7060 12.9517 12.9517 13.1390 13.1390 13.2417 13.2417 15.3203 15.3203 15.6010 15.6010 15.6515 15.6515 k = 0.1301 0.1301 0.1301 ( 1653 PWs) bands (ev): 4.8851 4.8851 7.8733 7.8733 7.9529 7.9529 8.8034 8.8034 8.8664 8.8664 9.1567 9.1567 9.6139 9.6139 10.9797 10.9797 11.2085 11.2085 11.4236 11.4236 11.9366 11.9366 12.1688 12.1688 12.1949 12.1949 12.1981 12.1981 12.2419 12.2419 12.5660 12.5660 12.6662 12.6662 12.6673 12.6673 12.9454 12.9454 13.1277 13.1277 13.2329 13.2329 15.3480 15.3480 15.6105 15.6105 15.6599 15.6599 k = 0.1370 0.1370 0.1370 ( 1647 PWs) bands (ev): 4.9488 4.9488 7.8930 7.8930 7.9839 7.9839 8.8131 8.8131 8.8878 8.8878 9.1788 9.1788 9.6279 9.6279 10.9604 10.9604 11.2157 11.2157 11.4341 11.4341 11.8617 11.8617 12.1167 12.1167 12.1398 12.1398 12.1689 12.1689 12.2336 12.2336 12.5409 12.5409 12.6280 12.6280 12.6319 12.6319 12.9398 12.9398 13.1175 13.1175 13.2251 13.2251 15.3732 15.3732 15.6186 15.6186 15.6665 15.6665 k = 0.1438 0.1438 0.1438 ( 1644 PWs) bands (ev): 5.0154 5.0154 7.9129 7.9129 8.0162 8.0162 8.8221 8.8221 8.9102 8.9102 9.2022 9.2022 9.6421 9.6421 10.9394 10.9394 11.2226 11.2226 11.4447 11.4447 11.7879 11.7879 12.0458 12.0458 12.0771 12.0771 12.1599 12.1599 12.2335 12.2335 12.5148 12.5148 12.5882 12.5882 12.5960 12.5960 12.9347 12.9347 13.1082 13.1082 13.2180 13.2180 15.3960 15.3960 15.6251 15.6251 15.6714 15.6714 k = 0.1507 0.1507 0.1507 ( 1644 PWs) bands (ev): 5.0847 5.0847 7.9328 7.9328 8.0498 8.0498 8.8301 8.8301 8.9336 8.9336 9.2267 9.2267 9.6562 9.6562 10.9168 10.9168 11.2292 11.2292 11.4551 11.4551 11.7163 11.7163 11.9746 11.9746 12.0134 12.0134 12.1530 12.1530 12.2355 12.2355 12.4877 12.4877 12.5481 12.5481 12.5587 12.5587 12.9302 12.9302 13.0996 13.0996 13.2115 13.2115 15.4161 15.4161 15.6300 15.6300 15.6745 15.6745 k = 0.1575 0.1575 0.1575 ( 1644 PWs) bands (ev): 5.1566 5.1566 7.9525 7.9525 8.0846 8.0846 8.8370 8.8370 8.9581 8.9581 9.2524 9.2524 9.6700 9.6700 10.8925 10.8925 11.2355 11.2355 11.4652 11.4652 11.6477 11.6477 11.9045 11.9045 11.9499 11.9499 12.1471 12.1471 12.2387 12.2387 12.4598 12.4598 12.5079 12.5079 12.5203 12.5203 12.9259 12.9259 13.0919 13.0919 13.2055 13.2055 15.4336 15.4336 15.6333 15.6333 15.6759 15.6759 k = 0.1644 0.1644 0.1644 ( 1650 PWs) bands (ev): 5.2311 5.2311 7.9718 7.9718 8.1206 8.1206 8.8425 8.8425 8.9835 8.9835 9.2793 9.2793 9.6832 9.6832 10.8666 10.8666 11.2412 11.2412 11.4746 11.4746 11.5829 11.5829 11.8361 11.8361 11.8873 11.8873 12.1419 12.1419 12.2428 12.2428 12.4312 12.4312 12.4677 12.4677 12.4810 12.4810 12.9219 12.9219 13.0846 13.0846 13.2000 13.2000 15.4483 15.4483 15.6348 15.6348 15.6755 15.6755 k = 0.1712 0.1712 0.1712 ( 1644 PWs) bands (ev): 5.3081 5.3081 7.9907 7.9907 8.1579 8.1579 8.8468 8.8468 9.0100 9.0100 9.3074 9.3074 9.6959 9.6959 10.8395 10.8395 11.2465 11.2465 11.4821 11.4821 11.5234 11.5234 11.7700 11.7700 11.8260 11.8260 12.1374 12.1374 12.2476 12.2476 12.4020 12.4020 12.4280 12.4280 12.4412 12.4412 12.9183 12.9183 13.0781 13.0781 13.1949 13.1949 15.4601 15.4601 15.6345 15.6345 15.6735 15.6735 k = 0.1781 0.1781 0.1781 ( 1644 PWs) bands (ev): 5.3874 5.3874 8.0089 8.0089 8.1962 8.1962 8.8492 8.8492 9.0376 9.0376 9.3366 9.3366 9.7076 9.7076 10.8111 10.8111 11.2512 11.2512 11.4612 11.4612 11.4960 11.4960 11.7067 11.7067 11.7664 11.7664 12.1331 12.1331 12.2527 12.2527 12.3721 12.3721 12.3891 12.3891 12.4015 12.4015 12.9148 12.9148 13.0719 13.0719 13.1901 13.1901 15.4691 15.4691 15.6324 15.6324 15.6698 15.6698 k = 0.1849 0.1849 0.1849 ( 1644 PWs) bands (ev): 5.4690 5.4690 8.0262 8.0262 8.2355 8.2355 8.8498 8.8498 9.0662 9.0662 9.3667 9.3667 9.7179 9.7179 10.7819 10.7819 11.2551 11.2551 11.4115 11.4115 11.5009 11.5009 11.6471 11.6471 11.7088 11.7088 12.1287 12.1287 12.2570 12.2570 12.3417 12.3417 12.3516 12.3516 12.3631 12.3631 12.9115 12.9115 13.0662 13.0662 13.1855 13.1855 15.4749 15.4749 15.6284 15.6284 15.6647 15.6647 k = 0.1918 0.1918 0.1918 ( 1644 PWs) bands (ev): 5.5526 5.5526 8.0425 8.0425 8.2758 8.2758 8.8483 8.8483 9.0958 9.0958 9.3976 9.3976 9.7266 9.7266 10.7526 10.7526 11.2583 11.2583 11.3650 11.3650 11.5044 11.5044 11.5925 11.5925 11.6535 11.6535 12.1234 12.1234 12.2570 12.2570 12.3109 12.3109 12.3165 12.3165 12.3298 12.3298 12.9084 12.9084 13.0609 13.0609 13.1812 13.1812 15.4776 15.4776 15.6225 15.6225 15.6580 15.6580 k = 0.1986 0.1986 0.1986 ( 1638 PWs) bands (ev): 5.6382 5.6382 8.0574 8.0574 8.3170 8.3170 8.8447 8.8447 9.1266 9.1266 9.4292 9.4292 9.7333 9.7333 10.7240 10.7240 11.2604 11.2604 11.3231 11.3231 11.4990 11.4990 11.5499 11.5499 11.6012 11.6012 12.1160 12.1160 12.2428 12.2428 12.2803 12.2803 12.2850 12.2850 12.3117 12.3117 12.9054 12.9054 13.0558 13.0558 13.1772 13.1772 15.4771 15.4771 15.6146 15.6146 15.6499 15.6499 k = 0.2055 0.2055 0.2055 ( 1638 PWs) bands (ev): 5.7255 5.7255 8.0710 8.0710 8.3589 8.3589 8.8387 8.8387 9.1584 9.1584 9.4611 9.4611 9.7380 9.7380 10.6970 10.6970 11.2613 11.2613 11.2857 11.2857 11.4693 11.4693 11.5340 11.5340 11.5520 11.5520 12.1043 12.1043 12.2116 12.2116 12.2492 12.2492 12.2596 12.2596 12.3116 12.3116 12.9025 12.9025 13.0511 13.0511 13.1733 13.1733 15.4730 15.4730 15.6047 15.6047 15.6405 15.6405 k = 0.2123 0.2123 0.2123 ( 1632 PWs) bands (ev): 5.8144 5.8144 8.0829 8.0829 8.4015 8.4015 8.8304 8.8304 9.1913 9.1913 9.4925 9.4925 9.7407 9.7407 10.6727 10.6727 11.2527 11.2527 11.2606 11.2606 11.4284 11.4284 11.5067 11.5067 11.5324 11.5324 12.0865 12.0865 12.1734 12.1734 12.2179 12.2179 12.2428 12.2428 12.3197 12.3197 12.8998 12.8998 13.0467 13.0467 13.1697 13.1697 15.4654 15.4654 15.5928 15.5928 15.6298 15.6298 k = 0.2192 0.2192 0.2192 ( 1632 PWs) bands (ev): 5.9046 5.9046 8.0930 8.0930 8.4447 8.4447 8.8196 8.8196 9.2251 9.2251 9.5223 9.5223 9.7423 9.7423 10.6520 10.6520 11.2236 11.2236 11.2579 11.2579 11.3885 11.3885 11.4659 11.4659 11.5328 11.5328 12.0621 12.0621 12.1330 12.1330 12.1863 12.1863 12.2347 12.2347 12.3313 12.3313 12.8971 12.8971 13.0424 13.0424 13.1662 13.1662 15.4541 15.4541 15.5788 15.5788 15.6179 15.6179 k = 0.2260 0.2260 0.2260 ( 1634 PWs) bands (ev): 5.9961 5.9961 8.1012 8.1012 8.4882 8.4882 8.8064 8.8064 9.2600 9.2600 9.5484 9.5484 9.7445 9.7445 10.6359 10.6359 11.1981 11.1981 11.2523 11.2523 11.3522 11.3522 11.4306 11.4306 11.5329 11.5329 12.0325 12.0325 12.0919 12.0919 12.1546 12.1546 12.2340 12.2340 12.3448 12.3448 12.8945 12.8945 13.0384 13.0384 13.1628 13.1628 15.4391 15.4391 15.5626 15.5626 15.6046 15.6046 k = 0.2329 0.2329 0.2329 ( 1631 PWs) bands (ev): 6.0884 6.0884 8.1073 8.1073 8.5318 8.5318 8.7908 8.7908 9.2958 9.2958 9.5674 9.5674 9.7507 9.7507 10.6249 10.6249 11.1762 11.1762 11.2432 11.2432 11.3202 11.3202 11.4018 11.4018 11.5320 11.5320 11.9997 11.9997 12.0508 12.0508 12.1229 12.1229 12.2390 12.2390 12.3600 12.3600 12.8920 12.8920 13.0345 13.0345 13.1596 13.1596 15.4203 15.4203 15.5442 15.5442 15.5899 15.5899 k = 0.2397 0.2397 0.2397 ( 1637 PWs) bands (ev): 6.1813 6.1813 8.1112 8.1112 8.5752 8.5752 8.7731 8.7731 9.3325 9.3325 9.5753 9.5753 9.7650 9.7650 10.6194 10.6194 11.1574 11.1574 11.2301 11.2301 11.2927 11.2927 11.3801 11.3801 11.5301 11.5301 11.9651 11.9651 12.0099 12.0099 12.0913 12.0913 12.2479 12.2479 12.3763 12.3763 12.8895 12.8895 13.0308 13.0308 13.1565 13.1565 15.3979 15.3979 15.5236 15.5236 15.5736 15.5736 k = 0.2466 0.2466 0.2466 ( 1637 PWs) bands (ev): 6.2746 6.2746 8.1128 8.1128 8.6175 8.6175 8.7540 8.7540 9.3701 9.3701 9.5711 9.5711 9.7892 9.7892 10.6198 10.6198 11.1415 11.1415 11.2136 11.2136 11.2698 11.2698 11.3651 11.3651 11.5271 11.5271 11.9297 11.9297 11.9695 11.9695 12.0600 12.0600 12.2600 12.2600 12.3937 12.3937 12.8871 12.8871 13.0274 13.0274 13.1535 13.1535 15.3718 15.3718 15.5007 15.5007 15.5556 15.5556 k = 0.2534 0.2534 0.2534 ( 1637 PWs) bands (ev): 6.3680 6.3680 8.1122 8.1122 8.6559 8.6559 8.7360 8.7360 9.4083 9.4083 9.5566 9.5566 9.8221 9.8221 10.6259 10.6259 11.1286 11.1286 11.1951 11.1951 11.2513 11.2513 11.3556 11.3556 11.5230 11.5230 11.8943 11.8943 11.9297 11.9297 12.0288 12.0288 12.2744 12.2744 12.4121 12.4121 12.8848 12.8848 13.0240 13.0240 13.1507 13.1507 15.3421 15.3421 15.4755 15.4755 15.5357 15.5357 k = 0.2603 0.2603 0.2603 ( 1637 PWs) bands (ev): 6.4610 6.4610 8.1092 8.1092 8.6763 8.6763 8.7332 8.7332 9.4471 9.4471 9.5354 9.5354 9.8611 9.8611 10.6371 10.6371 11.1185 11.1185 11.1763 11.1763 11.2372 11.2372 11.3502 11.3502 11.5181 11.5181 11.8591 11.8591 11.8907 11.8907 11.9980 11.9980 12.2908 12.2908 12.4314 12.4314 12.8825 12.8825 13.0209 13.0209 13.1480 13.1480 15.3089 15.3089 15.4478 15.4478 15.5135 15.5135 k = 0.2671 0.2671 0.2671 ( 1643 PWs) bands (ev): 6.5532 6.5532 8.1040 8.1040 8.6630 8.6630 8.7607 8.7607 9.4863 9.4863 9.5104 9.5104 9.9046 9.9046 10.6533 10.6533 11.1112 11.1112 11.1584 11.1584 11.2271 11.2271 11.3475 11.3475 11.5124 11.5124 11.8244 11.8244 11.8526 11.8526 11.9675 11.9675 12.3086 12.3086 12.4511 12.4511 12.8803 12.8803 13.0179 13.0179 13.1454 13.1454 15.2723 15.2723 15.4177 15.4177 15.4890 15.4890 k = 0.2740 0.2740 0.2740 ( 1637 PWs) bands (ev): 6.6444 6.6444 8.0965 8.0965 8.6375 8.6375 8.7965 8.7965 9.4843 9.4843 9.5259 9.5259 9.9516 9.9516 10.6737 10.6737 11.1069 11.1069 11.1424 11.1424 11.2210 11.2210 11.3470 11.3470 11.5060 11.5060 11.7906 11.7906 11.8156 11.8156 11.9378 11.9378 12.3281 12.3281 12.4719 12.4719 12.8782 12.8782 13.0151 13.0151 13.1429 13.1429 15.2324 15.2324 15.3851 15.3851 15.4619 15.4619 k = 0.2808 0.2808 0.2808 ( 1637 PWs) bands (ev): 6.7340 6.7340 8.0868 8.0868 8.6084 8.6084 8.8315 8.8315 9.4591 9.4591 9.5654 9.5654 10.0014 10.0014 10.6981 10.6981 11.1057 11.1057 11.1288 11.1288 11.2186 11.2186 11.3480 11.3480 11.4991 11.4991 11.7576 11.7576 11.7796 11.7796 11.9082 11.9082 12.3487 12.3487 12.4932 12.4932 12.8761 12.8761 13.0125 13.0125 13.1406 13.1406 15.1891 15.1891 15.3499 15.3499 15.4320 15.4320 k = 0.2877 0.2877 0.2877 ( 1637 PWs) bands (ev): 6.8216 6.8216 8.0751 8.0751 8.5774 8.5774 8.8626 8.8626 9.4374 9.4374 9.6049 9.6049 10.0538 10.0538 10.7259 10.7259 11.1074 11.1074 11.1179 11.1179 11.2197 11.2197 11.3504 11.3504 11.4917 11.4917 11.7257 11.7257 11.7450 11.7450 11.8792 11.8792 12.3702 12.3702 12.5149 12.5149 12.8741 12.8741 13.0100 13.0100 13.1384 13.1384 15.1426 15.1426 15.3121 15.3121 15.3992 15.3992 k = 0.2945 0.2945 0.2945 ( 1631 PWs) bands (ev): 6.9068 6.9068 8.0614 8.0614 8.5452 8.5452 8.8880 8.8880 9.4214 9.4214 9.6440 9.6440 10.1084 10.1084 10.7566 10.7566 11.1100 11.1100 11.1123 11.1123 11.2243 11.2243 11.3541 11.3541 11.4844 11.4844 11.6950 11.6950 11.7119 11.7119 11.8508 11.8508 12.3926 12.3926 12.5371 12.5371 12.8721 12.8721 13.0077 13.0077 13.1363 13.1363 15.0930 15.0930 15.2717 15.2717 15.3632 15.3632 k = 0.3014 0.3014 0.3014 ( 1622 PWs) bands (ev): 6.9889 6.9889 8.0459 8.0459 8.5122 8.5122 8.9057 8.9057 9.4135 9.4135 9.6825 9.6825 10.1653 10.1653 10.7900 10.7900 11.1049 11.1049 11.1203 11.1203 11.2321 11.2321 11.3588 11.3588 11.4767 11.4767 11.6657 11.6657 11.6808 11.6808 11.8234 11.8234 12.4155 12.4155 12.5595 12.5595 12.8702 12.8702 13.0056 13.0056 13.1344 13.1344 15.0403 15.0403 15.2286 15.2286 15.3240 15.3240 k = 0.3082 0.3082 0.3082 ( 1628 PWs) bands (ev): 7.0675 7.0675 8.0288 8.0288 8.4786 8.4786 8.9143 8.9143 9.4153 9.4153 9.7201 9.7201 10.2242 10.2242 10.8252 10.8252 11.1024 11.1024 11.1313 11.1313 11.2431 11.2431 11.3641 11.3641 11.4689 11.4689 11.6378 11.6378 11.6517 11.6517 11.7963 11.7963 12.4388 12.4388 12.5821 12.5821 12.8683 12.8683 13.0038 13.0038 13.1325 13.1325 14.9845 14.9845 15.1828 15.1828 15.2813 15.2813 k = 0.3151 0.3151 0.3151 ( 1628 PWs) bands (ev): 7.1422 7.1422 8.0103 8.0103 8.4450 8.4450 8.9137 8.9137 9.4276 9.4276 9.7566 9.7566 10.2849 10.2849 10.8621 10.8621 11.1026 11.1026 11.1458 11.1458 11.2573 11.2573 11.3701 11.3701 11.4613 11.4613 11.6115 11.6115 11.6255 11.6255 11.7702 11.7702 12.4623 12.4623 12.6046 12.6046 12.8665 12.8665 13.0021 13.0021 13.1308 13.1308 14.9258 14.9258 15.1343 15.1343 15.2352 15.2352 k = 0.3219 0.3219 0.3219 ( 1628 PWs) bands (ev): 7.2124 7.2124 7.9905 7.9905 8.4115 8.4115 8.9049 8.9049 9.4494 9.4494 9.7919 9.7919 10.3473 10.3473 10.9003 10.9003 11.1052 11.1052 11.1637 11.1637 11.2747 11.2747 11.3760 11.3760 11.4539 11.4539 11.5872 11.5872 11.6031 11.6031 11.7451 11.7451 12.4861 12.4861 12.6271 12.6271 12.8647 12.8647 13.0007 13.0007 13.1292 13.1292 14.8642 14.8642 15.0830 15.0830 15.1855 15.1855 k = 0.3288 0.3288 0.3288 ( 1634 PWs) bands (ev): 7.2776 7.2776 7.9696 7.9696 8.3783 8.3783 8.8897 8.8897 9.4790 9.4790 9.8255 9.8255 10.4111 10.4111 10.9394 10.9394 11.1099 11.1099 11.1851 11.1851 11.2951 11.2951 11.3808 11.3808 11.4466 11.4466 11.5651 11.5651 11.5859 11.5859 11.7210 11.7210 12.5096 12.5096 12.6492 12.6492 12.8630 12.8630 12.9995 12.9995 13.1277 13.1277 14.7999 14.7999 15.0291 15.0291 15.1321 15.1321 k = 0.3356 0.3356 0.3356 ( 1634 PWs) bands (ev): 7.3376 7.3376 7.9479 7.9479 8.3459 8.3459 8.8702 8.8702 9.5147 9.5147 9.8574 9.8574 10.4757 10.4757 10.9792 10.9792 11.1164 11.1164 11.2100 11.2100 11.3184 11.3184 11.3829 11.3829 11.4398 11.4398 11.5460 11.5460 11.5758 11.5758 11.6983 11.6983 12.5333 12.5333 12.6712 12.6712 12.8613 12.8613 12.9987 12.9987 13.1264 13.1264 14.7329 14.7329 14.9724 14.9724 15.0751 15.0751 k = 0.3425 0.3425 0.3425 ( 1634 PWs) bands (ev): 7.3918 7.3918 7.9255 7.9255 8.3144 8.3144 8.8481 8.8481 9.5544 9.5544 9.8874 9.8874 10.5405 10.5405 11.0196 11.0196 11.1244 11.1244 11.2383 11.2383 11.3439 11.3439 11.3809 11.3809 11.4332 11.4332 11.5311 11.5311 11.5745 11.5745 11.6771 11.6771 12.5569 12.5569 12.6928 12.6928 12.8597 12.8597 12.9982 12.9982 13.1252 13.1252 14.6634 14.6634 14.9131 14.9131 15.0144 15.0144 k = 0.3493 0.3493 0.3493 ( 1634 PWs) bands (ev): 7.4401 7.4401 7.9026 7.9026 8.2840 8.2840 8.8250 8.8250 9.5968 9.5968 9.9154 9.9154 10.6046 10.6046 11.0609 11.0609 11.1333 11.1333 11.2693 11.2693 11.3704 11.3704 11.3742 11.3742 11.4265 11.4265 11.5226 11.5226 11.5831 11.5831 11.6582 11.6582 12.5801 12.5801 12.7138 12.7138 12.8582 12.8582 12.9981 12.9981 13.1242 13.1242 14.5915 14.5915 14.8512 14.8512 14.9502 14.9502 k = 0.3562 0.3562 0.3562 ( 1628 PWs) bands (ev): 7.4823 7.4823 7.8795 7.8795 8.2549 8.2549 8.8019 8.8019 9.6405 9.6405 9.9413 9.9413 10.6671 10.6671 11.1034 11.1034 11.1429 11.1429 11.3016 11.3016 11.3637 11.3637 11.3961 11.3961 11.4193 11.4193 11.5238 11.5238 11.6012 11.6012 11.6428 11.6428 12.6029 12.6029 12.7341 12.7341 12.8567 12.8567 12.9984 12.9984 13.1233 13.1233 14.5174 14.5174 14.7867 14.7867 14.8825 14.8825 k = 0.3630 0.3630 0.3630 ( 1634 PWs) bands (ev): 7.5183 7.5183 7.8563 7.8563 8.2272 8.2272 8.7796 8.7796 9.6846 9.6846 9.9649 9.9649 10.7264 10.7264 11.1472 11.1472 11.1525 11.1525 11.3324 11.3324 11.3506 11.3506 11.4089 11.4089 11.4219 11.4219 11.5368 11.5368 11.6275 11.6275 11.6333 11.6333 12.6252 12.6252 12.7535 12.7535 12.8553 12.8553 12.9993 12.9993 13.1225 13.1225 14.4412 14.4412 14.7197 14.7197 14.8115 14.8115 k = 0.3699 0.3699 0.3699 ( 1628 PWs) bands (ev): 7.5482 7.5482 7.8331 7.8331 8.2010 8.2010 8.7588 8.7588 9.7282 9.7282 9.9864 9.9864 10.7816 10.7816 11.1617 11.1617 11.1926 11.1926 11.3366 11.3366 11.3575 11.3575 11.3995 11.3995 11.4461 11.4461 11.5577 11.5577 11.6374 11.6374 11.6610 11.6610 12.6470 12.6470 12.7720 12.7720 12.8539 12.8539 13.0007 13.0007 13.1218 13.1218 14.3632 14.3632 14.6504 14.6504 14.7374 14.7374 k = 0.3767 0.3767 0.3767 ( 1640 PWs) bands (ev): 7.5722 7.5722 7.8102 7.8102 8.1764 8.1764 8.7398 8.7398 9.7707 9.7707 10.0057 10.0057 10.8316 10.8316 11.1699 11.1699 11.2385 11.2385 11.3226 11.3226 11.3747 11.3747 11.3894 11.3894 11.4708 11.4708 11.5794 11.5794 11.6639 11.6639 11.7004 11.7004 12.6680 12.6680 12.7892 12.7892 12.8526 12.8526 13.0027 13.0027 13.1213 13.1213 14.2833 14.2833 14.5788 14.5788 14.6602 14.6602 k = 0.3836 0.3836 0.3836 ( 1640 PWs) bands (ev): 7.5906 7.5906 7.7877 7.7877 8.1533 8.1533 8.7228 8.7228 9.8115 9.8115 10.0230 10.0230 10.8758 10.8758 11.1769 11.1769 11.2824 11.2824 11.3099 11.3099 11.3757 11.3757 11.3928 11.3928 11.4874 11.4874 11.6101 11.6101 11.7118 11.7118 11.7455 11.7455 12.6884 12.6884 12.8052 12.8052 12.8514 12.8514 13.0055 13.0055 13.1210 13.1210 14.2021 14.2021 14.5050 14.5050 14.5803 14.5803 k = 0.3904 0.3904 0.3904 ( 1640 PWs) bands (ev): 7.6040 7.6040 7.7658 7.7658 8.1318 8.1318 8.7078 8.7078 9.8502 9.8502 10.0383 10.0383 10.9143 10.9143 11.1817 11.1817 11.2995 11.2995 11.3177 11.3177 11.3660 11.3660 11.4127 11.4127 11.4930 11.4930 11.6574 11.6574 11.7732 11.7732 11.7954 11.7954 12.7079 12.7079 12.8198 12.8198 12.8502 12.8502 13.0090 13.0090 13.1207 13.1207 14.1195 14.1195 14.4292 14.4292 14.4979 14.4979 k = 0.3973 0.3973 0.3973 ( 1634 PWs) bands (ev): 7.6128 7.6128 7.7445 7.7445 8.1117 8.1117 8.6951 8.6951 9.8864 9.8864 10.0518 10.0518 10.9475 10.9475 11.1837 11.1837 11.2921 11.2921 11.3379 11.3379 11.3572 11.3572 11.4405 11.4405 11.4982 11.4982 11.7168 11.7168 11.8441 11.8441 11.8499 11.8499 12.7266 12.7266 12.8329 12.8329 12.8492 12.8492 13.0133 13.0133 13.1206 13.1206 14.0359 14.0359 14.3516 14.3516 14.4134 14.4134 k = 0.4041 0.4041 0.4041 ( 1634 PWs) bands (ev): 7.6177 7.6177 7.7241 7.7241 8.0930 8.0930 8.6842 8.6842 9.9200 9.9200 10.0636 10.0636 10.9760 10.9760 11.1826 11.1826 11.2881 11.2881 11.3419 11.3419 11.3539 11.3539 11.4568 11.4568 11.5241 11.5241 11.7835 11.7835 11.9083 11.9083 11.9229 11.9229 12.7444 12.7444 12.8445 12.8445 12.8482 12.8482 13.0184 13.0184 13.1206 13.1206 13.9515 13.9515 14.2722 14.2722 14.3269 14.3269 k = 0.4110 0.4110 0.4110 ( 1640 PWs) bands (ev): 7.6193 7.6193 7.7045 7.7045 8.0755 8.0755 8.6753 8.6753 9.9507 9.9507 10.0738 10.0738 11.0003 11.0003 11.1786 11.1786 11.2874 11.2874 11.3358 11.3358 11.3556 11.3556 11.4563 11.4563 11.5724 11.5724 11.8544 11.8544 11.9704 11.9704 12.0081 12.0081 12.7612 12.7612 12.8471 12.8471 12.8545 12.8545 13.0241 13.0241 13.1206 13.1206 13.8665 13.8665 14.1913 14.1913 14.2387 14.2387 k = 0.4178 0.4178 0.4178 ( 1640 PWs) bands (ev): 7.6184 7.6184 7.6860 7.6860 8.0592 8.0592 8.6680 8.6680 9.9785 9.9785 10.0825 10.0825 11.0211 11.0211 11.1724 11.1724 11.2892 11.2892 11.3289 11.3289 11.3562 11.3562 11.4517 11.4517 11.6289 11.6289 11.9282 11.9282 12.0358 12.0358 12.0982 12.0982 12.7770 12.7770 12.8462 12.8462 12.8630 12.8630 13.0305 13.0305 13.1207 13.1207 13.7813 13.7813 14.1090 14.1090 14.1492 14.1492 k = 0.4247 0.4247 0.4247 ( 1640 PWs) bands (ev): 7.6156 7.6156 7.6686 7.6686 8.0440 8.0440 8.6622 8.6622 10.0035 10.0035 10.0901 10.0901 11.0388 11.0388 11.1650 11.1650 11.2927 11.2927 11.3227 11.3227 11.3554 11.3554 11.4468 11.4468 11.6889 11.6889 12.0039 12.0039 12.1041 12.1041 12.1916 12.1916 12.7918 12.7918 12.8454 12.8454 12.8702 12.8702 13.0372 13.0372 13.1208 13.1208 13.6962 13.6962 14.0256 14.0256 14.0587 14.0587 k = 0.4315 0.4315 0.4315 ( 1634 PWs) bands (ev): 7.6113 7.6113 7.6525 7.6525 8.0300 8.0300 8.6576 8.6576 10.0257 10.0257 10.0964 10.0964 11.0539 11.0539 11.1570 11.1570 11.2973 11.2973 11.3175 11.3175 11.3535 11.3535 11.4427 11.4427 11.7511 11.7511 12.0811 12.0811 12.1750 12.1750 12.2864 12.2864 12.8057 12.8057 12.8449 12.8449 12.8762 12.8762 13.0442 13.0442 13.1209 13.1209 13.6115 13.6115 13.9412 13.9412 13.9675 13.9675 k = 0.4384 0.4384 0.4384 ( 1628 PWs) bands (ev): 7.6062 7.6062 7.6377 7.6377 8.0171 8.0171 8.6541 8.6541 10.0451 10.0451 10.1018 10.1018 11.0667 11.0667 11.1492 11.1492 11.3022 11.3022 11.3132 11.3132 11.3508 11.3508 11.4398 11.4398 11.8145 11.8145 12.1595 12.1595 12.2480 12.2480 12.3803 12.3803 12.8185 12.8185 12.8447 12.8447 12.8811 12.8811 13.0513 13.0513 13.1209 13.1209 13.5278 13.5278 13.8562 13.8562 13.8760 13.8760 k = 0.4452 0.4452 0.4452 ( 1628 PWs) bands (ev): 7.6006 7.6006 7.6243 7.6243 8.0054 8.0054 8.6514 8.6514 10.0620 10.0620 10.1062 10.1062 11.0773 11.0773 11.1416 11.1416 11.3070 11.3070 11.3096 11.3096 11.3475 11.3475 11.4378 11.4378 11.8787 11.8787 12.2387 12.2387 12.3228 12.3228 12.4712 12.4712 12.8295 12.8295 12.8458 12.8458 12.8850 12.8850 13.0582 13.0582 13.1207 13.1207 13.4456 13.4456 13.7708 13.7708 13.7846 13.7846 k = 0.4521 0.4521 0.4521 ( 1625 PWs) bands (ev): 7.5950 7.5950 7.6122 7.6122 7.9948 7.9948 8.6495 8.6495 10.0764 10.0764 10.1099 10.1099 11.0861 11.0861 11.1346 11.1346 11.3069 11.3069 11.3117 11.3117 11.3440 11.3440 11.4366 11.4366 11.9430 11.9430 12.3186 12.3186 12.3989 12.3989 12.5566 12.5566 12.8363 12.8363 12.8512 12.8512 12.8883 12.8883 13.0647 13.0647 13.1202 13.1202 13.3659 13.3659 13.6854 13.6854 13.6938 13.6938 k = 0.4589 0.4589 0.4589 ( 1625 PWs) bands (ev): 7.5896 7.5896 7.6017 7.6017 7.9856 7.9856 8.6480 8.6480 10.0886 10.0886 10.1129 10.1129 11.0932 11.0932 11.1284 11.1284 11.3048 11.3048 11.3160 11.3160 11.3405 11.3405 11.4361 11.4361 12.0065 12.0065 12.3986 12.3986 12.4757 12.4757 12.6334 12.6334 12.8379 12.8379 12.8626 12.8626 12.8909 12.8909 13.0708 13.0708 13.1190 13.1190 13.2897 13.2897 13.6004 13.6004 13.6041 13.6041 k = 0.4658 0.4658 0.4658 ( 1631 PWs) bands (ev): 7.5846 7.5846 7.5927 7.5927 7.9776 7.9776 8.6468 8.6468 10.0985 10.0985 10.1153 10.1153 11.0988 11.0988 11.1229 11.1229 11.3032 11.3032 11.3197 11.3197 11.3371 11.3371 11.4360 11.4360 12.0679 12.0679 12.4782 12.4782 12.5524 12.5524 12.6979 12.6979 12.8379 12.8379 12.8780 12.8780 12.8932 12.8932 13.0764 13.0764 13.1166 13.1166 13.2193 13.2193 13.5164 13.5164 13.5165 13.5165 k = 0.4726 0.4726 0.4726 ( 1637 PWs) bands (ev): 7.5802 7.5802 7.5853 7.5853 7.9710 7.9710 8.6460 8.6460 10.1065 10.1065 10.1171 10.1171 11.1031 11.1031 11.1183 11.1183 11.3021 11.3021 11.3228 11.3228 11.3341 11.3341 11.4361 11.4361 12.1255 12.1255 12.5562 12.5562 12.6275 12.6275 12.7461 12.7461 12.8374 12.8374 12.8952 12.8952 12.8971 12.8971 13.0814 13.0814 13.1103 13.1103 13.1599 13.1599 13.4321 13.4321 13.4348 13.4348 k = 0.4795 0.4795 0.4795 ( 1640 PWs) bands (ev): 7.5767 7.5767 7.5795 7.5795 7.9658 7.9658 8.6455 8.6455 10.1125 10.1125 10.1185 10.1185 11.1063 11.1063 11.1148 11.1148 11.3014 11.3014 11.3254 11.3254 11.3318 11.3318 11.4364 11.4364 12.1768 12.1768 12.6311 12.6311 12.6988 12.6988 12.7762 12.7762 12.8367 12.8367 12.8973 12.8973 12.9166 12.9166 13.0861 13.0861 13.0891 13.0891 13.1278 13.1278 13.3532 13.3532 13.3571 13.3571 k = 0.4863 0.4863 0.4863 ( 1640 PWs) bands (ev): 7.5741 7.5741 7.5753 7.5753 7.9620 7.9620 8.6451 8.6451 10.1168 10.1168 10.1194 10.1194 11.1085 11.1085 11.1122 11.1122 11.3009 11.3009 11.3272 11.3272 11.3301 11.3301 11.4367 11.4367 12.2183 12.2183 12.6999 12.6999 12.7615 12.7615 12.7917 12.7917 12.8352 12.8352 12.9001 12.9001 12.9247 12.9247 13.0681 13.0681 13.0908 13.0908 13.1177 13.1177 13.2839 13.2839 13.2874 13.2874 k = 0.4932 0.4932 0.4932 ( 1640 PWs) bands (ev): 7.5725 7.5725 7.5728 7.5728 7.9598 7.9598 8.6449 8.6449 10.1194 10.1194 10.1200 10.1200 11.1097 11.1097 11.1107 11.1107 11.3007 11.3007 11.3283 11.3283 11.3290 11.3290 11.4369 11.4369 12.2458 12.2458 12.7572 12.7572 12.7978 12.7978 12.8066 12.8066 12.8306 12.8306 12.9040 12.9040 12.9152 12.9152 13.0719 13.0719 13.0957 13.0957 13.1088 13.1088 13.2320 13.2320 13.2336 13.2336 k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): 7.5720 7.5720 7.5720 7.5720 7.9590 7.9590 8.6449 8.6449 10.1202 10.1202 10.1202 10.1202 11.1102 11.1102 11.1102 11.1102 11.3006 11.3006 11.3287 11.3287 11.3287 11.3287 11.4370 11.4370 12.2555 12.2555 12.7864 12.7864 12.7993 12.7993 12.8231 12.8231 12.8231 12.8231 12.9066 12.9066 12.9066 12.9066 13.0846 13.0846 13.0987 13.0987 13.0987 13.0987 13.2116 13.2116 13.2116 13.2116 k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): 7.5720 7.5720 7.5720 7.5720 7.9590 7.9590 8.6449 8.6449 10.1202 10.1202 10.1202 10.1202 11.1102 11.1102 11.1102 11.1102 11.3006 11.3006 11.3287 11.3287 11.3287 11.3287 11.4370 11.4370 12.2555 12.2555 12.7864 12.7864 12.7993 12.7993 12.8231 12.8231 12.8231 12.8231 12.9066 12.9066 12.9066 12.9066 13.0846 13.0846 13.0987 13.0987 13.0987 13.0987 13.2116 13.2116 13.2116 13.2116 k = 0.4917 0.5000 0.4917 ( 1640 PWs) bands (ev): 7.5725 7.5725 7.5729 7.5729 7.9598 7.9598 8.6449 8.6449 10.1191 10.1191 10.1203 10.1203 11.1098 11.1098 11.1106 11.1106 11.3007 11.3007 11.3283 11.3283 11.3290 11.3290 11.4369 11.4369 12.2460 12.2460 12.7573 12.7573 12.7976 12.7976 12.8085 12.8085 12.8290 12.8290 12.9042 12.9042 12.9154 12.9154 13.0708 13.0708 13.0930 13.0930 13.1133 13.1133 13.2269 13.2269 13.2373 13.2373 k = 0.4833 0.5000 0.4833 ( 1640 PWs) bands (ev): 7.5740 7.5740 7.5754 7.5754 7.9620 7.9620 8.6451 8.6451 10.1157 10.1157 10.1206 10.1206 11.1087 11.1087 11.1119 11.1119 11.3009 11.3009 11.3273 11.3273 11.3300 11.3300 11.4367 11.4367 12.2188 12.2188 12.7001 12.7001 12.7677 12.7677 12.7875 12.7875 12.8311 12.8311 12.8973 12.8973 12.9359 12.9359 13.0471 13.0471 13.1034 13.1034 13.1258 13.1258 13.2678 13.2678 13.2970 13.2970 k = 0.4750 0.5000 0.4750 ( 1640 PWs) bands (ev): 7.5764 7.5764 7.5797 7.5797 7.9657 7.9657 8.6454 8.6454 10.1102 10.1102 10.1210 10.1210 11.1069 11.1069 11.1141 11.1141 11.3013 11.3013 11.3256 11.3256 11.3316 11.3316 11.4364 11.4364 12.1778 12.1778 12.6317 12.6317 12.7106 12.7106 12.7594 12.7594 12.8316 12.8316 12.8884 12.8884 12.9605 12.9605 13.0285 13.0285 13.1291 13.1291 13.1316 13.1316 13.3227 13.3227 13.3751 13.3751 k = 0.4667 0.5000 0.4667 ( 1640 PWs) bands (ev): 7.5798 7.5798 7.5855 7.5855 7.9708 7.9708 8.6459 8.6459 10.1023 10.1023 10.1217 10.1217 11.1042 11.1042 11.1172 11.1172 11.3019 11.3019 11.3234 11.3234 11.3337 11.3337 11.4361 11.4361 12.1272 12.1272 12.5575 12.5575 12.6451 12.6451 12.7113 12.7113 12.8323 12.8323 12.8811 12.8811 12.9809 12.9809 13.0242 13.0242 13.1341 13.1341 13.1595 13.1595 13.3860 13.3860 13.4642 13.4642 k = 0.4583 0.5000 0.4583 ( 1634 PWs) bands (ev): 7.5840 7.5840 7.5930 7.5930 7.9774 7.9774 8.6466 8.6466 10.0920 10.0920 10.1225 10.1225 11.1006 11.1006 11.1211 11.1211 11.3026 11.3026 11.3207 11.3207 11.3364 11.3364 11.4359 11.4359 12.0702 12.0702 12.4806 12.4806 12.5749 12.5749 12.6482 12.6482 12.8328 12.8328 12.8759 12.8759 12.9860 12.9860 13.0398 13.0398 13.1363 13.1363 13.1879 13.1879 13.4566 13.4566 13.5603 13.5603 k = 0.4500 0.5000 0.4500 ( 1626 PWs) bands (ev): 7.5891 7.5891 7.6020 7.6020 7.9854 7.9854 8.6476 8.6476 10.0794 10.0794 10.1235 10.1235 11.0960 11.0960 11.1257 11.1257 11.3032 11.3032 11.3180 11.3180 11.3395 11.3395 11.4359 11.4359 12.0095 12.0095 12.4027 12.4027 12.5019 12.5019 12.5752 12.5752 12.8328 12.8328 12.8720 12.8720 12.9833 12.9833 13.0624 13.0624 13.1397 13.1397 13.2122 13.2122 13.5342 13.5342 13.6613 13.6613 k = 0.4417 0.5000 0.4417 ( 1622 PWs) bands (ev): 7.5949 7.5949 7.6124 7.6124 7.9947 7.9947 8.6488 8.6488 10.0643 10.0643 10.1245 10.1245 11.0903 11.0903 11.1310 11.1310 11.3028 11.3028 11.3161 11.3161 11.3428 11.3428 11.4363 11.4363 11.9467 11.9467 12.3248 12.3248 12.4270 12.4270 12.4959 12.4959 12.8324 12.8324 12.8687 12.8687 12.9794 12.9794 13.0809 13.0809 13.1463 13.1463 13.2316 13.2316 13.6181 13.6181 13.7661 13.7661 k = 0.4333 0.5000 0.4333 ( 1626 PWs) bands (ev): 7.6013 7.6013 7.6240 7.6240 8.0052 8.0052 8.6503 8.6503 10.0466 10.0466 10.1256 10.1256 11.0832 11.0832 11.1368 11.1368 11.3003 11.3003 11.3162 11.3162 11.3460 11.3460 11.4370 11.4370 11.8831 11.8831 12.2474 12.2474 12.3510 12.3510 12.4125 12.4125 12.8315 12.8315 12.8656 12.8656 12.9752 12.9752 13.0919 13.0919 13.1570 13.1570 13.2461 13.2461 13.7079 13.7079 13.8741 13.8741 k = 0.4250 0.5000 0.4250 ( 1634 PWs) bands (ev): 7.6083 7.6083 7.6368 7.6368 8.0169 8.0169 8.6521 8.6521 10.0262 10.0262 10.1267 10.1267 11.0746 11.0746 11.1430 11.1430 11.2954 11.2954 11.3184 11.3184 11.3491 11.3491 11.4387 11.4387 11.8196 11.8196 12.1709 12.1709 12.2747 12.2747 12.3267 12.3267 12.8302 12.8302 12.8624 12.8624 12.9708 12.9708 13.0961 13.0961 13.1703 13.1703 13.2560 13.2560 13.8027 13.8027 13.9848 13.9848 k = 0.4167 0.5000 0.4167 ( 1630 PWs) bands (ev): 7.6159 7.6159 7.6506 7.6506 8.0296 8.0296 8.6547 8.6547 10.0033 10.0033 10.1277 10.1277 11.0647 11.0647 11.1495 11.1495 11.2890 11.2890 11.3221 11.3221 11.3518 11.3518 11.4414 11.4414 11.7572 11.7572 12.0956 12.0956 12.1987 12.1987 12.2403 12.2403 12.8287 12.8287 12.8593 12.8593 12.9663 12.9663 13.0964 13.0964 13.1834 13.1834 13.2619 13.2619 13.9019 13.9019 14.0979 14.0979 k = 0.4083 0.5000 0.4083 ( 1630 PWs) bands (ev): 7.6238 7.6238 7.6653 7.6653 8.0431 8.0431 8.6580 8.6580 9.9777 9.9777 10.1286 10.1286 11.0531 11.0531 11.1559 11.1559 11.2808 11.2808 11.3269 11.3269 11.3538 11.3538 11.4451 11.4451 11.6968 11.6968 12.0216 12.0216 12.1228 12.1228 12.1549 12.1549 12.8269 12.8269 12.8560 12.8560 12.9615 12.9615 13.0945 13.0945 13.1945 13.1945 13.2640 13.2640 14.0049 14.0049 14.2134 14.2134 k = 0.4000 0.5000 0.4000 ( 1636 PWs) bands (ev): 7.6320 7.6320 7.6805 7.6805 8.0572 8.0572 8.6621 8.6621 9.9495 9.9495 10.1293 10.1293 11.0398 11.0398 11.1616 11.1616 11.2707 11.2707 11.3325 11.3325 11.3548 11.3548 11.4495 11.4495 11.6399 11.6399 11.9489 11.9489 12.0455 12.0455 12.0741 12.0741 12.8248 12.8248 12.8524 12.8524 12.9564 12.9564 13.0911 13.0911 13.2028 13.2028 13.2627 13.2627 14.1113 14.1113 14.3310 14.3310 k = 0.3917 0.5000 0.3917 ( 1636 PWs) bands (ev): 7.6405 7.6405 7.6961 7.6961 8.0718 8.0718 8.6674 8.6674 9.9189 9.9189 10.1298 10.1298 11.0246 11.0246 11.1658 11.1658 11.2583 11.2583 11.3387 11.3387 11.3550 11.3550 11.4540 11.4540 11.5891 11.5891 11.8778 11.8778 11.9653 11.9653 12.0011 12.0011 12.8225 12.8225 12.8487 12.8487 12.9510 12.9510 13.0868 13.0868 13.2082 13.2082 13.2586 13.2586 14.2207 14.2207 14.4507 14.4507 k = 0.3833 0.5000 0.3833 ( 1636 PWs) bands (ev): 7.6490 7.6490 7.7118 7.7118 8.0866 8.0866 8.6740 8.6740 9.8859 9.8859 10.1297 10.1297 11.0075 11.0075 11.1665 11.1665 11.2433 11.2433 11.3454 11.3454 11.3544 11.3544 11.4561 11.4561 11.5487 11.5487 11.8084 11.8084 11.8844 11.8844 11.9353 11.9353 12.8200 12.8200 12.8448 12.8448 12.9451 12.9451 13.0819 13.0819 13.2106 13.2106 13.2519 13.2519 14.3327 14.3327 14.5722 14.5722 k = 0.3750 0.5000 0.3750 ( 1636 PWs) bands (ev): 7.6576 7.6576 7.7272 7.7272 8.1014 8.1014 8.6821 8.6821 9.8507 9.8507 10.1291 10.1291 10.9884 10.9884 11.1595 11.1595 11.2277 11.2277 11.3505 11.3505 11.3545 11.3545 11.4513 11.4513 11.5253 11.5253 11.7412 11.7412 11.8059 11.8059 11.8753 11.8753 12.8173 12.8173 12.8406 12.8406 12.9388 12.9388 13.0763 13.0763 13.2101 13.2101 13.2429 13.2429 14.4473 14.4473 14.6957 14.6957 k = 0.3667 0.5000 0.3667 ( 1632 PWs) bands (ev): 7.6661 7.6661 7.7418 7.7418 8.1161 8.1161 8.6919 8.6919 9.8138 9.8138 10.1277 10.1277 10.9670 10.9670 11.1392 11.1392 11.2148 11.2148 11.3491 11.3491 11.3598 11.3598 11.4397 11.4397 11.5203 11.5203 11.6766 11.6766 11.7322 11.7322 11.8207 11.8207 12.8143 12.8143 12.8361 12.8361 12.9321 12.9321 13.0703 13.0703 13.2068 13.2068 13.2320 13.2320 14.5641 14.5641 14.8209 14.8209 k = 0.3583 0.5000 0.3583 ( 1634 PWs) bands (ev): 7.6744 7.6744 7.7552 7.7552 8.1304 8.1304 8.7036 8.7036 9.7753 9.7753 10.1252 10.1252 10.9432 10.9432 11.1053 11.1053 11.2041 11.2041 11.3460 11.3460 11.3652 11.3652 11.4287 11.4287 11.5246 11.5246 11.6157 11.6157 11.6662 11.6662 11.7715 11.7715 12.8112 12.8112 12.8314 12.8314 12.9248 12.9248 13.0638 13.0638 13.2005 13.2005 13.2195 13.2195 14.6830 14.6830 14.9477 14.9477 k = 0.3500 0.5000 0.3500 ( 1630 PWs) bands (ev): 7.6825 7.6825 7.7667 7.7667 8.1445 8.1445 8.7173 8.7173 9.7357 9.7357 10.1215 10.1215 10.9169 10.9169 11.0628 11.0628 11.1905 11.1905 11.3424 11.3424 11.3693 11.3693 11.4221 11.4221 11.5293 11.5293 11.5598 11.5598 11.6124 11.6124 11.7285 11.7285 12.8078 12.8078 12.8264 12.8264 12.9171 12.9171 13.0569 13.0569 13.1916 13.1916 13.2061 13.2061 14.8039 14.8039 15.0763 15.0763 k = 0.3417 0.5000 0.3417 ( 1630 PWs) bands (ev): 7.6902 7.6902 7.7756 7.7756 8.1585 8.1585 8.7329 8.7329 9.6955 9.6955 10.1162 10.1162 10.8879 10.8879 11.0161 11.0161 11.1698 11.1698 11.3378 11.3378 11.3725 11.3725 11.4170 11.4170 11.5067 11.5067 11.5303 11.5303 11.5789 11.5789 11.6935 11.6935 12.8041 12.8041 12.8213 12.8213 12.9087 12.9087 13.0497 13.0497 13.1795 13.1795 13.1920 13.1920 14.9266 14.9266 15.2064 15.2064 k = 0.3333 0.5000 0.3333 ( 1626 PWs) bands (ev): 7.6976 7.6976 7.7813 7.7813 8.1727 8.1727 8.7503 8.7503 9.6552 9.6552 10.1091 10.1091 10.8566 10.8566 10.9677 10.9677 11.1404 11.1404 11.3315 11.3315 11.3761 11.3761 11.4037 11.4037 11.4709 11.4709 11.5179 11.5179 11.5664 11.5664 11.6705 11.6705 12.8002 12.8002 12.8159 12.8159 12.8998 12.8998 13.0421 13.0421 13.1648 13.1648 13.1776 13.1776 15.0513 15.0513 15.3380 15.3380 k = 0.3250 0.5000 0.3250 ( 1642 PWs) bands (ev): 7.7043 7.7043 7.7830 7.7830 8.1874 8.1874 8.7690 8.7690 9.6154 9.6154 10.0998 10.0998 10.8234 10.8234 10.9187 10.9187 11.1031 11.1031 11.3217 11.3217 11.3708 11.3708 11.3832 11.3832 11.4557 11.4557 11.5091 11.5091 11.5572 11.5572 11.6629 11.6629 12.7958 12.7958 12.8103 12.8103 12.8901 12.8901 13.0342 13.0342 13.1479 13.1479 13.1624 13.1624 15.1775 15.1775 15.4710 15.4710 k = 0.3167 0.5000 0.3167 ( 1642 PWs) bands (ev): 7.7104 7.7104 7.7801 7.7801 8.2031 8.2031 8.7887 8.7887 9.5768 9.5768 10.0882 10.0882 10.7893 10.7893 10.8697 10.8697 11.0614 11.0614 11.3018 11.3018 11.3410 11.3410 11.3879 11.3879 11.4506 11.4506 11.5076 11.5076 11.5482 11.5482 11.6695 11.6695 12.7909 12.7909 12.8046 12.8046 12.8799 12.8799 13.0259 13.0259 13.1299 13.1299 13.1462 13.1462 15.3055 15.3055 15.6054 15.6054 k = 0.3083 0.5000 0.3083 ( 1642 PWs) bands (ev): 7.7156 7.7156 7.7724 7.7724 8.2201 8.2201 8.8085 8.8085 9.5401 9.5401 10.0739 10.0739 10.7545 10.7545 10.8213 10.8213 11.0185 11.0185 11.2656 11.2656 11.3252 11.3252 11.3917 11.3917 11.4472 11.4472 11.5094 11.5094 11.5468 11.5468 11.6844 11.6844 12.7855 12.7855 12.7989 12.7989 12.8690 12.8690 13.0172 13.0172 13.1113 13.1113 13.1289 13.1289 15.4350 15.4350 15.7411 15.7411 k = 0.3000 0.5000 0.3000 ( 1642 PWs) bands (ev): 7.7191 7.7191 7.7603 7.7603 8.2387 8.2387 8.8277 8.8277 9.5062 9.5062 10.0572 10.0572 10.7172 10.7172 10.7763 10.7763 10.9766 10.9766 11.2241 11.2241 11.3156 11.3156 11.3890 11.3890 11.4469 11.4469 11.5131 11.5131 11.5557 11.5557 11.7036 11.7036 12.7793 12.7793 12.7930 12.7930 12.8577 12.8577 13.0079 13.0079 13.0924 13.0924 13.1105 13.1105 15.5661 15.5661 15.8780 15.8780 k = 0.2917 0.5000 0.2917 ( 1642 PWs) bands (ev): 7.7179 7.7179 7.7466 7.7466 8.2588 8.2588 8.8452 8.8452 9.4758 9.4758 10.0381 10.0381 10.6737 10.6737 10.7399 10.7399 10.9367 10.9367 11.1830 11.1830 11.3069 11.3069 11.3780 11.3780 11.4530 11.4530 11.5202 11.5202 11.5716 11.5716 11.7254 11.7254 12.7721 12.7721 12.7868 12.7868 12.8460 12.8460 12.9979 12.9979 13.0739 13.0739 13.0912 13.0912 15.6986 15.6986 16.0162 16.0162 k = 0.2833 0.5000 0.2833 ( 1650 PWs) bands (ev): 7.7034 7.7034 7.7400 7.7400 8.2803 8.2803 8.8598 8.8598 9.4499 9.4499 10.0171 10.0171 10.6233 10.6233 10.7139 10.7139 10.8987 10.8987 11.1437 11.1437 11.2968 11.2968 11.3628 11.3628 11.4641 11.4641 11.5306 11.5306 11.5916 11.5916 11.7487 11.7487 12.7640 12.7640 12.7802 12.7802 12.8342 12.8342 12.9867 12.9867 13.0561 13.0561 13.0712 13.0712 15.8326 15.8326 16.1554 16.1554 k = 0.2750 0.5000 0.2750 ( 1650 PWs) bands (ev): 7.6766 7.6766 7.7399 7.7399 8.3030 8.3030 8.8706 8.8706 9.4292 9.4292 9.9946 9.9946 10.5696 10.5696 10.6959 10.6959 10.8630 10.8630 11.1065 11.1065 11.2840 11.2840 11.3485 11.3485 11.4781 11.4781 11.5434 11.5434 11.6145 11.6145 11.7732 11.7732 12.7545 12.7545 12.7726 12.7726 12.8230 12.8230 12.9740 12.9740 13.0400 13.0400 13.0509 13.0509 15.9680 15.9680 16.2957 16.2957 k = 0.2667 0.5000 0.2667 ( 1650 PWs) bands (ev): 7.6429 7.6429 7.7410 7.7410 8.3265 8.3265 8.8768 8.8768 9.4139 9.4139 9.9715 9.9715 10.5156 10.5156 10.6839 10.6839 10.8290 10.8290 11.0717 11.0717 11.2674 11.2674 11.3376 11.3376 11.4939 11.4939 11.5579 11.5579 11.6395 11.6395 11.7984 11.7984 12.7434 12.7434 12.7637 12.7637 12.8129 12.8129 12.9591 12.9591 13.0259 13.0259 13.0306 13.0306 16.1048 16.1048 16.4369 16.4369 k = 0.2583 0.5000 0.2583 ( 1658 PWs) bands (ev): 7.6045 7.6045 7.7420 7.7420 8.3504 8.3504 8.8781 8.8781 9.4039 9.4039 9.9482 9.9482 10.4631 10.4631 10.6765 10.6765 10.7966 10.7966 11.0391 11.0391 11.2477 11.2477 11.3300 11.3300 11.5107 11.5107 11.5735 11.5735 11.6662 11.6662 11.8239 11.8239 12.7302 12.7302 12.7533 12.7533 12.8046 12.8046 12.9419 12.9419 13.0104 13.0104 13.0142 13.0142 16.2428 16.2428 16.5791 16.5791 k = 0.2500 0.5000 0.2500 ( 1666 PWs) bands (ev): 7.5620 7.5620 7.7424 7.7424 8.3742 8.3742 8.8748 8.8748 9.3984 9.3984 9.9254 9.9254 10.4135 10.4135 10.6724 10.6724 10.7659 10.7659 11.0088 11.0088 11.2261 11.2261 11.3252 11.3252 11.5284 11.5284 11.5901 11.5901 11.6944 11.6944 11.8496 11.8496 12.7142 12.7142 12.7420 12.7420 12.7979 12.7979 12.9226 12.9226 12.9909 12.9909 13.0049 13.0049 16.3821 16.3821 16.7220 16.7220 k = 0.2417 0.5000 0.2417 ( 1646 PWs) bands (ev): 7.5164 7.5164 7.7420 7.7420 8.3973 8.3973 8.8678 8.8678 9.3963 9.3963 9.9036 9.9036 10.3682 10.3682 10.6703 10.6703 10.7380 10.7380 10.9809 10.9809 11.2037 11.2037 11.3228 11.3228 11.5473 11.5473 11.6079 11.6079 11.7240 11.7240 11.8752 11.8752 12.6961 12.6961 12.7301 12.7301 12.7928 12.7928 12.9020 12.9020 12.9724 12.9724 12.9978 12.9978 16.5225 16.5225 16.8657 16.8657 k = 0.2333 0.5000 0.2333 ( 1646 PWs) bands (ev): 7.4681 7.4681 7.7407 7.7407 8.4191 8.4191 8.8582 8.8582 9.3958 9.3958 9.8829 9.8829 10.3281 10.3281 10.6656 10.6656 10.7160 10.7160 10.9549 10.9549 11.1810 11.1810 11.3216 11.3216 11.5665 11.5665 11.6259 11.6259 11.7543 11.7543 11.9006 11.9006 12.6753 12.6753 12.7171 12.7171 12.7886 12.7886 12.8803 12.8803 12.9547 12.9547 12.9925 12.9925 16.6640 16.6640 17.0100 17.0100 k = 0.2250 0.5000 0.2250 ( 1638 PWs) bands (ev): 7.4177 7.4177 7.7387 7.7387 8.4388 8.4388 8.8477 8.8477 9.3957 9.3957 9.8633 9.8633 10.2944 10.2944 10.6518 10.6518 10.7066 10.7066 10.9311 10.9311 11.1584 11.1584 11.3219 11.3219 11.5862 11.5862 11.6446 11.6446 11.7853 11.7853 11.9254 11.9254 12.6527 12.6527 12.7030 12.7030 12.7850 12.7850 12.8585 12.8585 12.9383 12.9383 12.9890 12.9890 16.8065 16.8065 17.1549 17.1549 k = 0.2167 0.5000 0.2167 ( 1634 PWs) bands (ev): 7.3656 7.3656 7.7357 7.7357 8.4554 8.4554 8.8377 8.8377 9.3946 9.3946 9.8443 9.8443 10.2681 10.2681 10.6295 10.6295 10.7084 10.7084 10.9091 10.9091 11.1363 11.1363 11.3231 11.3231 11.6061 11.6061 11.6635 11.6635 11.8165 11.8165 11.9497 11.9497 12.6285 12.6285 12.6874 12.6874 12.7815 12.7815 12.8373 12.8373 12.9230 12.9230 12.9872 12.9872 16.9499 16.9499 17.3003 17.3003 k = 0.2083 0.5000 0.2083 ( 1634 PWs) bands (ev): 7.3123 7.3123 7.7318 7.7318 8.4681 8.4681 8.8296 8.8296 9.3916 9.3916 9.8253 9.8253 10.2502 10.2502 10.6042 10.6042 10.7155 10.7155 10.8889 10.8889 11.1145 11.1145 11.3254 11.3254 11.6264 11.6264 11.6828 11.6828 11.8476 11.8476 11.9730 11.9730 12.6031 12.6031 12.6697 12.6697 12.7771 12.7771 12.8181 12.8181 12.9091 12.9091 12.9871 12.9871 17.0939 17.0939 17.4460 17.4460 k = 0.2000 0.5000 0.2000 ( 1634 PWs) bands (ev): 7.2584 7.2584 7.7271 7.7271 8.4761 8.4761 8.8248 8.8248 9.3863 9.3863 9.8060 9.8060 10.2409 10.2409 10.5784 10.5784 10.7249 10.7249 10.8708 10.8708 11.0932 11.0932 11.3288 11.3288 11.6468 11.6468 11.7024 11.7024 11.8784 11.8784 11.9952 11.9952 12.5768 12.5768 12.6497 12.6497 12.7703 12.7703 12.8026 12.8026 12.8969 12.8969 12.9889 12.9889 17.2385 17.2385 17.5920 17.5920 k = 0.1917 0.5000 0.1917 ( 1638 PWs) bands (ev): 7.2042 7.2042 7.7216 7.7216 8.4788 8.4788 8.8240 8.8240 9.3787 9.3787 9.7861 9.7861 10.2401 10.2401 10.5529 10.5529 10.7354 10.7354 10.8547 10.8547 11.0725 11.0725 11.3331 11.3331 11.6672 11.6672 11.7221 11.7221 11.9083 11.9083 12.0162 12.0162 12.5499 12.5499 12.6273 12.6273 12.7595 12.7595 12.7922 12.7922 12.8866 12.8866 12.9927 12.9927 17.3834 17.3834 17.7381 17.7381 k = 0.1833 0.5000 0.1833 ( 1626 PWs) bands (ev): 7.1501 7.1501 7.7152 7.7152 8.4763 8.4763 8.8274 8.8274 9.3691 9.3691 9.7657 9.7657 10.2471 10.2471 10.5284 10.5284 10.7459 10.7459 10.8412 10.8412 11.0528 11.0528 11.3387 11.3387 11.6877 11.6877 11.7422 11.7422 11.9371 11.9371 12.0360 12.0360 12.5227 12.5227 12.6025 12.6025 12.7462 12.7462 12.7854 12.7854 12.8788 12.8788 12.9988 12.9988 17.5282 17.5282 17.8843 17.8843 k = 0.1750 0.5000 0.1750 ( 1622 PWs) bands (ev): 7.0965 7.0965 7.7082 7.7082 8.4691 8.4691 8.8347 8.8347 9.3577 9.3577 9.7452 9.7452 10.2609 10.2609 10.5044 10.5044 10.7548 10.7548 10.8313 10.8313 11.0335 11.0335 11.3453 11.3453 11.7080 11.7080 11.7623 11.7623 11.9644 11.9644 12.0541 12.0541 12.4953 12.4953 12.5755 12.5755 12.7324 12.7324 12.7793 12.7793 12.8737 12.8737 13.0070 13.0070 17.6726 17.6726 18.0305 18.0305 k = 0.1667 0.5000 0.1667 ( 1622 PWs) bands (ev): 7.0436 7.0436 7.7005 7.7005 8.4580 8.4580 8.8451 8.8451 9.3450 9.3450 9.7250 9.7250 10.2801 10.2801 10.4814 10.4814 10.7603 10.7603 10.8264 10.8264 11.0149 11.0149 11.3530 11.3530 11.7281 11.7281 11.7825 11.7825 11.9898 11.9898 12.0705 12.0705 12.4680 12.4680 12.5466 12.5466 12.7188 12.7188 12.7725 12.7725 12.8717 12.8717 13.0176 13.0176 17.8161 17.8161 18.1766 18.1766 k = 0.1583 0.5000 0.1583 ( 1622 PWs) bands (ev): 6.9919 6.9919 7.6923 7.6923 8.4439 8.4439 8.8575 8.8575 9.3315 9.3315 9.7058 9.7058 10.3037 10.3037 10.4593 10.4593 10.7606 10.7606 10.8280 10.8280 10.9971 10.9971 11.3619 11.3619 11.7479 11.7479 11.8028 11.8028 12.0130 12.0130 12.0853 12.0853 12.4408 12.4408 12.5161 12.5161 12.7058 12.7058 12.7646 12.7646 12.8725 12.8725 13.0307 13.0307 17.9579 17.9579 18.3225 18.3225 k = 0.1500 0.5000 0.1500 ( 1628 PWs) bands (ev): 6.9415 6.9415 7.6836 7.6836 8.4279 8.4279 8.8711 8.8711 9.3174 9.3174 9.6879 9.6879 10.3306 10.3306 10.4380 10.4380 10.7564 10.7564 10.8349 10.8349 10.9800 10.9800 11.3719 11.3719 11.7674 11.7674 11.8229 11.8229 12.0338 12.0338 12.0983 12.0983 12.4140 12.4140 12.4845 12.4845 12.6934 12.6934 12.7557 12.7557 12.8760 12.8760 13.0461 13.0461 18.0972 18.0972 18.4683 18.4683 k = 0.1417 0.5000 0.1417 ( 1634 PWs) bands (ev): 6.8926 6.8926 7.6744 7.6744 8.4106 8.4106 8.8850 8.8850 9.3031 9.3031 9.6718 9.6718 10.3600 10.3600 10.4180 10.4180 10.7500 10.7500 10.8448 10.8448 10.9639 10.9639 11.3829 11.3829 11.7863 11.7863 11.8427 11.8427 12.0519 12.0519 12.1096 12.1096 12.3878 12.3878 12.4520 12.4520 12.6814 12.6814 12.7461 12.7461 12.8816 12.8816 13.0638 13.0638 18.2330 18.2330 18.6139 18.6139 k = 0.1333 0.5000 0.1333 ( 1634 PWs) bands (ev): 6.8456 6.8456 7.6651 7.6651 8.3928 8.3928 8.8988 8.8988 9.2890 9.2890 9.6576 9.6576 10.3909 10.3909 10.3991 10.3991 10.7428 10.7428 10.8558 10.8558 10.9487 10.9487 11.3953 11.3953 11.8050 11.8050 11.8624 11.8624 12.0673 12.0673 12.1192 12.1192 12.3625 12.3625 12.4188 12.4188 12.6699 12.6699 12.7359 12.7359 12.8889 12.8889 13.0837 13.0837 18.3641 18.3641 18.7596 18.7596 k = 0.1250 0.5000 0.1250 ( 1626 PWs) bands (ev): 6.8006 6.8006 7.6555 7.6555 8.3747 8.3747 8.9118 8.9118 9.2752 9.2752 9.6455 9.6455 10.3812 10.3812 10.4234 10.4234 10.7355 10.7355 10.8668 10.8668 10.9350 10.9350 11.4089 11.4089 11.8231 11.8231 11.8818 11.8818 12.0800 12.0800 12.1273 12.1273 12.3381 12.3381 12.3854 12.3854 12.6587 12.6587 12.7256 12.7256 12.8975 12.8975 13.1054 13.1054 18.4895 18.4895 18.9054 18.9054 k = 0.1167 0.5000 0.1167 ( 1630 PWs) bands (ev): 6.7578 6.7578 7.6459 7.6459 8.3569 8.3569 8.9238 8.9238 9.2620 9.2620 9.6354 9.6354 10.3643 10.3643 10.4562 10.4562 10.7286 10.7286 10.8766 10.8766 10.9224 10.9224 11.4235 11.4235 11.8405 11.8405 11.9007 11.9007 12.0900 12.0900 12.1338 12.1338 12.3149 12.3149 12.3516 12.3516 12.6478 12.6478 12.7151 12.7151 12.9070 12.9070 13.1285 13.1285 18.6084 18.6084 19.0515 19.0515 k = 0.1083 0.5000 0.1083 ( 1630 PWs) bands (ev): 6.7173 6.7173 7.6363 7.6363 8.3396 8.3396 8.9345 8.9345 9.2494 9.2494 9.6274 9.6274 10.3485 10.3485 10.4894 10.4894 10.7221 10.7221 10.8835 10.8835 10.9129 10.9129 11.4393 11.4393 11.8573 11.8573 11.9190 11.9190 12.0974 12.0974 12.1389 12.1389 12.2931 12.2931 12.3178 12.3178 12.6372 12.6372 12.7048 12.7048 12.9171 12.9171 13.1528 13.1528 18.7204 18.7204 19.1971 19.1971 k = 0.1000 0.5000 0.1000 ( 1626 PWs) bands (ev): 6.6793 6.6793 7.6269 7.6269 8.3230 8.3230 8.9438 8.9438 9.2377 9.2377 9.6214 9.6214 10.3341 10.3341 10.5225 10.5225 10.7161 10.7161 10.8837 10.8837 10.9099 10.9099 11.4560 11.4560 11.8734 11.8734 11.9365 11.9365 12.1023 12.1023 12.1429 12.1429 12.2729 12.2729 12.2843 12.2843 12.6270 12.6270 12.6946 12.6946 12.9277 12.9277 13.1777 13.1777 18.8257 18.8257 19.3375 19.3375 k = 0.0917 0.5000 0.0917 ( 1630 PWs) bands (ev): 6.6440 6.6440 7.6178 7.6178 8.3073 8.3073 8.9516 8.9516 9.2270 9.2270 9.6172 9.6172 10.3206 10.3206 10.5553 10.5553 10.7107 10.7107 10.8771 10.8771 10.9131 10.9131 11.4736 11.4736 11.8886 11.8886 11.9532 11.9532 12.1050 12.1050 12.1457 12.1457 12.2508 12.2508 12.2547 12.2547 12.6170 12.6170 12.6846 12.6846 12.9383 12.9383 13.2027 13.2027 18.9251 18.9251 19.4630 19.4630 k = 0.0833 0.5000 0.0833 ( 1630 PWs) bands (ev): 6.6113 6.6113 7.6091 7.6091 8.2927 8.2927 8.9580 8.9580 9.2172 9.2172 9.6145 9.6145 10.3082 10.3082 10.5876 10.5876 10.7059 10.7059 10.8686 10.8686 10.9176 10.9176 11.4921 11.4921 11.9028 11.9028 11.9688 11.9688 12.1057 12.1057 12.1476 12.1476 12.2184 12.2184 12.2379 12.2379 12.6076 12.6076 12.6751 12.6751 12.9488 12.9488 13.2274 13.2274 19.0191 19.0191 19.5798 19.5799 k = 0.0750 0.5000 0.0750 ( 1634 PWs) bands (ev): 6.5815 6.5815 7.6009 7.6009 8.2791 8.2791 8.9631 8.9631 9.2084 9.2084 9.6131 9.6131 10.2969 10.2969 10.6188 10.6188 10.7017 10.7017 10.8601 10.8601 10.9211 10.9211 11.5112 11.5112 11.9159 11.9159 11.9832 11.9832 12.1048 12.1048 12.1487 12.1487 12.1867 12.1867 12.2233 12.2233 12.5988 12.5988 12.6661 12.6661 12.9589 12.9589 13.2513 13.2513 19.1080 19.1080 19.6933 19.6933 k = 0.0667 0.5000 0.0667 ( 1644 PWs) bands (ev): 6.5546 6.5546 7.5932 7.5932 8.2668 8.2668 8.9669 8.9669 9.2006 9.2006 9.6127 9.6127 10.2868 10.2868 10.6491 10.6491 10.6979 10.6979 10.8522 10.8522 10.9231 10.9231 11.5306 11.5306 11.9277 11.9277 11.9960 11.9960 12.1025 12.1025 12.1492 12.1492 12.1563 12.1563 12.2106 12.2106 12.5903 12.5903 12.6575 12.6575 12.9685 12.9685 13.2739 13.2739 19.1919 19.1919 19.8032 19.8032 k = 0.0583 0.5000 0.0583 ( 1650 PWs) bands (ev): 6.5307 6.5307 7.5863 7.5863 8.2558 8.2558 8.9698 8.9698 9.1938 9.1938 9.6132 9.6132 10.2779 10.2779 10.6774 10.6774 10.6952 10.6952 10.8452 10.8452 10.9233 10.9233 11.5502 11.5502 11.9379 11.9379 12.0072 12.0072 12.0995 12.0995 12.1276 12.1276 12.1493 12.1493 12.1999 12.1999 12.5828 12.5828 12.6496 12.6496 12.9773 12.9773 13.2948 13.2948 19.2703 19.2703 19.9083 19.9083 k = 0.0500 0.5000 0.0500 ( 1646 PWs) bands (ev): 6.5099 6.5099 7.5800 7.5800 8.2462 8.2462 8.9718 8.9718 9.1881 9.1881 9.6142 9.6142 10.2701 10.2701 10.6895 10.6895 10.7083 10.7083 10.8392 10.8392 10.9215 10.9215 11.5697 11.5697 11.9463 11.9463 12.0165 12.0165 12.0952 12.0952 12.1031 12.1031 12.1490 12.1490 12.1911 12.1911 12.5761 12.5761 12.6425 12.6425 12.9853 12.9853 13.3138 13.3138 19.3425 19.3425 20.0070 20.0070 k = 0.0417 0.5000 0.0417 ( 1646 PWs) bands (ev): 6.4921 6.4921 7.5747 7.5747 8.2380 8.2380 8.9732 8.9732 9.1834 9.1834 9.6155 9.6155 10.2635 10.2635 10.6880 10.6880 10.7334 10.7334 10.8343 10.8343 10.9175 10.9175 11.5885 11.5885 11.9523 11.9523 12.0235 12.0235 12.0773 12.0773 12.0957 12.0957 12.1486 12.1486 12.1838 12.1838 12.5703 12.5703 12.6363 12.6363 12.9924 12.9924 13.3304 13.3304 19.4072 19.4072 20.0974 20.0974 k = 0.0333 0.5000 0.0333 ( 1642 PWs) bands (ev): 6.4776 6.4776 7.5702 7.5702 8.2313 8.2313 8.9740 8.9740 9.1795 9.1795 9.6169 9.6169 10.2581 10.2581 10.6866 10.6866 10.7571 10.7571 10.8308 10.8308 10.9117 10.9117 11.6060 11.6060 11.9553 11.9553 12.0281 12.0281 12.0594 12.0594 12.0938 12.0938 12.1480 12.1480 12.1780 12.1780 12.5655 12.5655 12.6310 12.6310 12.9982 12.9982 13.3444 13.3444 19.4632 19.4632 20.1773 20.1773 k = 0.0250 0.5000 0.0250 ( 1642 PWs) bands (ev): 6.4662 6.4662 7.5667 7.5667 8.2260 8.2260 8.9745 8.9745 9.1766 9.1766 9.6181 9.6181 10.2539 10.2539 10.6852 10.6852 10.7777 10.7777 10.8291 10.8291 10.9041 10.9041 11.6213 11.6213 11.9551 11.9551 12.0302 12.0302 12.0471 12.0471 12.0930 12.0930 12.1474 12.1474 12.1736 12.1736 12.5616 12.5616 12.6268 12.6268 13.0029 13.0029 13.3555 13.3555 19.5087 19.5087 20.2441 20.2441 k = 0.0167 0.5000 0.0167 ( 1646 PWs) bands (ev): 6.4580 6.4580 7.5641 7.5641 8.2222 8.2222 8.9748 8.9748 9.1745 9.1745 9.6191 9.6191 10.2507 10.2507 10.6842 10.6842 10.7934 10.7934 10.8302 10.8302 10.8954 10.8954 11.6333 11.6333 11.9523 11.9523 12.0299 12.0299 12.0409 12.0409 12.0929 12.0929 12.1469 12.1469 12.1704 12.1704 12.5588 12.5588 12.6236 12.6236 13.0062 13.0062 13.3635 13.3635 19.5425 19.5425 20.2948 20.2948 k = 0.0083 0.5000 0.0083 ( 1654 PWs) bands (ev): 6.4532 6.4532 7.5626 7.5626 8.2199 8.2199 8.9749 8.9749 9.1732 9.1732 9.6197 9.6197 10.2486 10.2486 10.6836 10.6836 10.8019 10.8019 10.8344 10.8344 10.8873 10.8873 11.6411 11.6411 11.9492 11.9492 12.0288 12.0288 12.0387 12.0387 12.0931 12.0931 12.1465 12.1465 12.1685 12.1685 12.5571 12.5571 12.6217 12.6217 13.0081 13.0081 13.3683 13.3683 19.5633 19.5633 20.3267 20.3267 k = 0.0000 0.5000-0.0000 ( 1654 PWs) bands (ev): 6.4515 6.4515 7.5620 7.5620 8.2191 8.2191 8.9750 8.9750 9.1728 9.1728 9.6200 9.6200 10.2480 10.2480 10.6834 10.6834 10.8043 10.8043 10.8374 10.8374 10.8835 10.8835 11.6439 11.6439 11.9479 11.9479 12.0283 12.0283 12.0382 12.0382 12.0932 12.0932 12.1464 12.1464 12.1679 12.1679 12.5565 12.5565 12.6211 12.6211 13.0088 13.0088 13.3699 13.3699 19.5704 19.5704 20.3376 20.3376 k = 0.5000 0.5000-0.0000 ( 1628 PWs) bands (ev): 7.7579 7.7579 8.1649 8.1649 9.0261 9.0261 9.2817 9.2817 9.4883 9.4883 9.5685 9.5685 9.8785 9.8785 10.7014 10.7014 10.8229 10.8229 10.8517 10.8517 11.0262 11.0262 11.0356 11.0356 11.0561 11.0561 11.8650 11.8650 11.9116 11.9116 11.9312 11.9312 12.1539 12.1539 12.2089 12.2089 12.2704 12.2704 12.2966 12.2966 13.9267 13.9267 14.0319 14.0319 14.2693 14.2693 15.1074 15.1074 k = 0.5000 0.5000 0.0119 ( 1632 PWs) bands (ev): 7.7577 7.7577 8.1657 8.1657 9.0141 9.0141 9.2928 9.2928 9.4481 9.4481 9.6095 9.6095 9.8802 9.8802 10.7007 10.7007 10.8243 10.8243 10.8531 10.8531 11.0255 11.0255 11.0358 11.0358 11.0567 11.0567 11.8634 11.8634 11.9088 11.9088 11.9283 11.9283 12.1556 12.1556 12.2121 12.2121 12.2736 12.2736 12.2982 12.2982 13.9263 13.9263 14.0316 14.0316 14.2691 14.2691 15.1063 15.1063 k = 0.5000 0.5000 0.0238 ( 1640 PWs) bands (ev): 7.7572 7.7572 8.1681 8.1681 8.9830 8.9830 9.3207 9.3207 9.3845 9.3845 9.6754 9.6754 9.8857 9.8857 10.6990 10.6990 10.8288 10.8288 10.8574 10.8574 11.0235 11.0235 11.0368 11.0368 11.0587 11.0587 11.8585 11.8585 11.9006 11.9006 11.9196 11.9196 12.1603 12.1603 12.2211 12.2211 12.2828 12.2828 12.3029 12.3029 13.9251 13.9251 14.0308 14.0308 14.2687 14.2687 15.1029 15.1029 k = 0.5000 0.5000 0.0357 ( 1640 PWs) bands (ev): 7.7564 7.7564 8.1722 8.1722 8.9414 8.9414 9.3186 9.3186 9.3568 9.3568 9.7451 9.7451 9.8953 9.8953 10.6964 10.6964 10.8362 10.8362 10.8645 10.8645 11.0207 11.0207 11.0385 11.0385 11.0618 11.0618 11.8507 11.8507 11.8882 11.8882 11.9064 11.9064 12.1683 12.1683 12.2352 12.2352 12.2974 12.2974 12.3107 12.3107 13.9232 13.9232 14.0295 14.0295 14.2680 14.2680 15.0972 15.0972 k = 0.5000 0.5000 0.0476 ( 1640 PWs) bands (ev): 7.7552 7.7552 8.1776 8.1776 8.8947 8.8947 9.2529 9.2529 9.3949 9.3949 9.8160 9.8160 9.9099 9.9099 10.6929 10.6929 10.8465 10.8465 10.8741 10.8741 11.0174 11.0174 11.0408 11.0408 11.0657 11.0657 11.8403 11.8403 11.8725 11.8725 11.8894 11.8894 12.1793 12.1793 12.2533 12.2533 12.3161 12.3161 12.3212 12.3212 13.9204 13.9204 14.0277 14.0277 14.2669 14.2669 15.0892 15.0892 k = 0.5000 0.5000 0.0595 ( 1640 PWs) bands (ev): 7.7537 7.7537 8.1842 8.1842 8.8460 8.8460 9.1879 9.1879 9.4313 9.4313 9.8874 9.8874 9.9303 9.9303 10.6889 10.6889 10.8595 10.8595 10.8863 10.8863 11.0139 11.0139 11.0438 11.0438 11.0703 11.0703 11.8275 11.8275 11.8548 11.8548 11.8698 11.8698 12.1931 12.1931 12.2744 12.2744 12.3340 12.3340 12.3381 12.3381 13.9168 13.9168 14.0253 14.0253 14.2655 14.2655 15.0789 15.0789 k = 0.5000 0.5000 0.0714 ( 1640 PWs) bands (ev): 7.7518 7.7518 8.1917 8.1917 8.7969 8.7969 9.1240 9.1240 9.4641 9.4641 9.9574 9.9574 9.9587 9.9587 10.6846 10.6846 10.8752 10.8752 10.9010 10.9010 11.0107 11.0107 11.0473 11.0473 11.0755 11.0755 11.8125 11.8125 11.8357 11.8357 11.8482 11.8482 12.2096 12.2096 12.2976 12.2976 12.3488 12.3488 12.3624 12.3624 13.9124 13.9124 14.0224 14.0224 14.2638 14.2638 15.0663 15.0663 k = 0.5000 0.5000 0.0833 ( 1640 PWs) bands (ev): 7.7497 7.7497 8.1996 8.1996 8.7488 8.7488 9.0612 9.0612 9.4919 9.4919 9.9915 9.9915 10.0294 10.0294 10.6804 10.6804 10.8934 10.8934 10.9179 10.9179 11.0078 11.0078 11.0515 11.0515 11.0813 11.0813 11.7957 11.7957 11.8162 11.8162 11.8254 11.8254 12.2285 12.2285 12.3224 12.3224 12.3651 12.3651 12.3885 12.3885 13.9070 13.9070 14.0188 14.0188 14.2617 14.2617 15.0513 15.0513 k = 0.5000 0.5000 0.0952 ( 1648 PWs) bands (ev): 7.7472 7.7472 8.2072 8.2072 8.7026 8.7026 8.9996 8.9996 9.5144 9.5144 10.0328 10.0328 10.0986 10.0986 10.6772 10.6772 10.9140 10.9140 10.9370 10.9370 11.0054 11.0054 11.0563 11.0563 11.0876 11.0876 11.7774 11.7774 11.7966 11.7966 11.8019 11.8019 12.2492 12.2492 12.3481 12.3481 12.3825 12.3825 12.4157 12.4157 13.9008 13.9008 14.0146 14.0146 14.2591 14.2591 15.0338 15.0338 k = 0.5000 0.5000 0.1071 ( 1648 PWs) bands (ev): 7.7444 7.7444 8.2139 8.2139 8.6593 8.6593 8.9394 8.9394 9.5322 9.5322 10.0806 10.0806 10.1654 10.1654 10.6758 10.6758 10.9368 10.9368 10.9583 10.9583 11.0039 11.0039 11.0616 11.0616 11.0947 11.0947 11.7579 11.7579 11.7773 11.7773 11.7780 11.7780 12.2721 12.2721 12.3746 12.3746 12.4012 12.4012 12.4439 12.4439 13.8936 13.8936 14.0097 14.0097 14.2560 14.2560 15.0139 15.0139 k = 0.5000 0.5000 0.1190 ( 1640 PWs) bands (ev): 7.7412 7.7412 8.2184 8.2184 8.6202 8.6202 8.8807 8.8807 9.5460 9.5460 10.1342 10.1342 10.2281 10.2281 10.6781 10.6781 10.9617 10.9617 10.9815 10.9815 11.0035 11.0035 11.0675 11.0675 11.1024 11.1024 11.7380 11.7380 11.7542 11.7542 11.7583 11.7583 12.2968 12.2968 12.4014 12.4014 12.4209 12.4209 12.4728 12.4728 13.8854 13.8854 14.0042 14.0042 14.2524 14.2524 14.9915 14.9915 k = 0.5000 0.5000 0.1310 ( 1640 PWs) bands (ev): 7.7378 7.7378 8.2193 8.2193 8.5866 8.5866 8.8233 8.8233 9.5569 9.5569 10.1924 10.1924 10.2841 10.2841 10.6863 10.6863 10.9884 10.9884 11.0010 11.0010 11.0095 11.0095 11.0739 11.0739 11.1110 11.1110 11.7178 11.7178 11.7303 11.7303 11.7393 11.7393 12.3226 12.3226 12.4280 12.4280 12.4415 12.4415 12.5020 12.5020 13.8761 13.8761 13.9979 13.9979 14.2482 14.2482 14.9664 14.9664 k = 0.5000 0.5000 0.1429 ( 1632 PWs) bands (ev): 7.7340 7.7340 8.2151 8.2151 8.5600 8.5600 8.7675 8.7675 9.5658 9.5658 10.2544 10.2544 10.3304 10.3304 10.7036 10.7036 11.0038 11.0038 11.0167 11.0167 11.0352 11.0352 11.0814 11.0814 11.1209 11.1209 11.6979 11.6979 11.7069 11.7069 11.7205 11.7205 12.3497 12.3497 12.4532 12.4532 12.4640 12.4640 12.5315 12.5315 13.8658 13.8658 13.9908 13.9908 14.2433 14.2433 14.9389 14.9389 k = 0.5000 0.5000 0.1548 ( 1640 PWs) bands (ev): 7.7299 7.7299 8.2044 8.2044 8.5415 8.5415 8.7133 8.7133 9.5737 9.5737 10.3193 10.3193 10.3641 10.3641 10.7328 10.7328 11.0061 11.0061 11.0457 11.0457 11.0629 11.0629 11.0897 11.0897 11.1321 11.1321 11.6786 11.6786 11.6839 11.6839 11.7019 11.7019 12.3775 12.3775 12.4761 12.4761 12.4890 12.4890 12.5610 12.5610 13.8542 13.8542 13.9828 13.9828 14.2376 14.2376 14.9085 14.9085 k = 0.5000 0.5000 0.1667 ( 1640 PWs) bands (ev): 7.7255 7.7255 8.1870 8.1870 8.5313 8.5313 8.6607 8.6607 9.5813 9.5813 10.3845 10.3845 10.3863 10.3863 10.7748 10.7748 11.0091 11.0091 11.0728 11.0728 11.0905 11.0905 11.1023 11.1023 11.1468 11.1468 11.6602 11.6602 11.6618 11.6618 11.6836 11.6836 12.4061 12.4061 12.4974 12.4974 12.5155 12.5155 12.5905 12.5905 13.8413 13.8413 13.9739 13.9739 14.2310 14.2310 14.8755 14.8755 k = 0.5000 0.5000 0.1786 ( 1640 PWs) bands (ev): 7.7208 7.7208 8.1634 8.1634 8.5286 8.5286 8.6098 8.6098 9.5894 9.5894 10.3932 10.3932 10.4549 10.4549 10.8278 10.8278 11.0131 11.0131 11.0911 11.0911 11.1146 11.1146 11.1255 11.1255 11.1676 11.1676 11.6406 11.6406 11.6428 11.6428 11.6657 11.6657 12.4352 12.4352 12.5181 12.5181 12.5424 12.5424 12.6198 12.6198 13.8272 13.8272 13.9639 13.9639 14.2235 14.2235 14.8397 14.8397 k = 0.5000 0.5000 0.1905 ( 1632 PWs) bands (ev): 7.7159 7.7159 8.1351 8.1351 8.5317 8.5317 8.5606 8.5606 9.5985 9.5985 10.3932 10.3932 10.5245 10.5245 10.8886 10.8886 11.0180 11.0180 11.1021 11.1021 11.1333 11.1333 11.1578 11.1578 11.1967 11.1967 11.6207 11.6207 11.6270 11.6270 11.6485 11.6485 12.4646 12.4646 12.5384 12.5384 12.5692 12.5692 12.6489 12.6489 13.8116 13.8116 13.9530 13.9530 14.2149 14.2149 14.8010 14.8010 k = 0.5000 0.5000 0.2024 ( 1632 PWs) bands (ev): 7.7106 7.7106 8.1036 8.1036 8.5132 8.5132 8.5390 8.5390 9.6090 9.6090 10.3872 10.3872 10.5944 10.5944 10.9537 10.9537 11.0243 11.0243 11.1111 11.1111 11.1478 11.1478 11.1934 11.1934 11.2326 11.2326 11.6023 11.6023 11.6126 11.6126 11.6322 11.6322 12.4941 12.4941 12.5584 12.5584 12.5958 12.5958 12.6776 12.6776 13.7945 13.7945 13.9409 13.9409 14.2051 14.2051 14.7596 14.7596 k = 0.5000 0.5000 0.2143 ( 1640 PWs) bands (ev): 7.7050 7.7050 8.0700 8.0700 8.4676 8.4676 8.5488 8.5488 9.6213 9.6213 10.3772 10.3772 10.6643 10.6643 11.0130 11.0130 11.0393 11.0393 11.1195 11.1195 11.1604 11.1604 11.2305 11.2305 11.2729 11.2729 11.5858 11.5858 11.5996 11.5996 11.6173 11.6173 12.5234 12.5234 12.5780 12.5780 12.6219 12.6219 12.7059 12.7059 13.7758 13.7758 13.9275 13.9275 14.1939 14.1939 14.7152 14.7152 k = 0.5000 0.5000 0.2262 ( 1632 PWs) bands (ev): 7.6992 7.6992 8.0356 8.0356 8.4240 8.4240 8.5601 8.5601 9.6358 9.6358 10.3647 10.3647 10.7335 10.7335 11.0305 11.0305 11.0967 11.0967 11.1280 11.1280 11.1729 11.1729 11.2683 11.2683 11.3167 11.3167 11.5724 11.5724 11.5878 11.5878 11.6059 11.6059 12.5527 12.5527 12.5973 12.5973 12.6477 12.6477 12.7338 12.7338 13.7555 13.7555 13.9130 13.9130 14.1814 14.1814 14.6680 14.6680 k = 0.5000 0.5000 0.2381 ( 1632 PWs) bands (ev): 7.6932 7.6932 8.0009 8.0009 8.3822 8.3822 8.5718 8.5718 9.6524 9.6524 10.3504 10.3504 10.8011 10.8011 11.0381 11.0381 11.1369 11.1369 11.1580 11.1580 11.1897 11.1897 11.3053 11.3053 11.3634 11.3634 11.5635 11.5635 11.5756 11.5756 11.6004 11.6004 12.5815 12.5815 12.6160 12.6160 12.6727 12.6727 12.7610 12.7610 13.7334 13.7334 13.8969 13.8969 14.1670 14.1670 14.6179 14.6179 k = 0.5000 0.5000 0.2500 ( 1624 PWs) bands (ev): 7.6869 7.6869 7.9664 7.9664 8.3424 8.3424 8.5834 8.5834 9.6713 9.6713 10.3352 10.3352 10.8664 10.8664 11.0452 11.0452 11.1469 11.1469 11.1872 11.1872 11.2347 11.2347 11.3401 11.3401 11.4127 11.4127 11.5615 11.5615 11.5632 11.5632 11.6030 11.6030 12.6099 12.6099 12.6343 12.6343 12.6972 12.6972 12.7877 12.7877 13.7094 13.7094 13.8794 13.8794 14.1509 14.1509 14.5650 14.5650 k = 0.5000 0.5000 0.2619 ( 1624 PWs) bands (ev): 7.6803 7.6803 7.9326 7.9326 8.3046 8.3046 8.5944 8.5944 9.6925 9.6925 10.3193 10.3193 10.9277 10.9277 11.0519 11.0519 11.1585 11.1585 11.1999 11.1999 11.2867 11.2867 11.3702 11.3702 11.4645 11.4645 11.5513 11.5513 11.5707 11.5707 11.6155 11.6155 12.6376 12.6376 12.6520 12.6520 12.7210 12.7210 12.8136 12.8136 13.6834 13.6834 13.8602 13.8602 14.1327 14.1327 14.5092 14.5092 k = 0.5000 0.5000 0.2738 ( 1632 PWs) bands (ev): 7.6735 7.6735 7.8997 7.8997 8.2687 8.2687 8.6043 8.6043 9.7159 9.7159 10.3031 10.3031 10.9828 10.9828 11.0583 11.0583 11.1734 11.1734 11.2107 11.2107 11.3255 11.3255 11.3938 11.3938 11.5189 11.5189 11.5406 11.5406 11.5962 11.5962 11.6396 11.6396 12.6645 12.6645 12.6691 12.6691 12.7440 12.7440 12.8387 12.8387 13.6553 13.6553 13.8394 13.8394 14.1123 14.1123 14.4506 14.4506 k = 0.5000 0.5000 0.2857 ( 1628 PWs) bands (ev): 7.6666 7.6666 7.8679 7.8679 8.2350 8.2350 8.6133 8.6133 9.7413 9.7413 10.2870 10.2870 11.0285 11.0285 11.0649 11.0649 11.1941 11.1941 11.2210 11.2210 11.3479 11.3479 11.4108 11.4108 11.5323 11.5323 11.5760 11.5760 11.6399 11.6399 11.6758 11.6758 12.6855 12.6855 12.6906 12.6906 12.7662 12.7662 12.8630 12.8630 13.6252 13.6252 13.8168 13.8168 14.0895 14.0895 14.3893 14.3893 k = 0.5000 0.5000 0.2976 ( 1644 PWs) bands (ev): 7.6595 7.6595 7.8373 7.8373 8.2032 8.2032 8.6209 8.6209 9.7683 9.7683 10.2710 10.2710 11.0622 11.0622 11.0709 11.0709 11.2213 11.2213 11.2305 11.2305 11.3570 11.3570 11.4224 11.4224 11.5274 11.5274 11.6352 11.6352 11.6984 11.6984 11.7225 11.7225 12.7012 12.7012 12.7155 12.7155 12.7875 12.7875 12.8864 12.8864 13.5927 13.5927 13.7923 13.7923 14.0639 14.0639 14.3253 14.3253 k = 0.5000 0.5000 0.3095 ( 1628 PWs) bands (ev): 7.6524 7.6524 7.8081 7.8081 8.1736 8.1736 8.6277 8.6277 9.7968 9.7968 10.2555 10.2555 11.0769 11.0769 11.0844 11.0844 11.2399 11.2399 11.2534 11.2534 11.3583 11.3583 11.4307 11.4307 11.5287 11.5287 11.6966 11.6966 11.7664 11.7664 11.7778 11.7778 12.7162 12.7162 12.7397 12.7397 12.8080 12.8080 12.9089 12.9089 13.5581 13.5581 13.7659 13.7659 14.0357 14.0357 14.2589 14.2589 k = 0.5000 0.5000 0.3214 ( 1628 PWs) bands (ev): 7.6451 7.6451 7.7804 7.7804 8.1460 8.1460 8.6331 8.6331 9.8261 9.8261 10.2405 10.2405 11.0824 11.0824 11.0980 11.0980 11.2490 11.2490 11.2845 11.2845 11.3553 11.3553 11.4360 11.4360 11.5391 11.5391 11.7599 11.7599 11.8395 11.8395 11.8397 11.8397 12.7305 12.7305 12.7626 12.7626 12.8276 12.8276 12.9304 12.9304 13.5211 13.5211 13.7374 13.7374 14.0043 14.0043 14.1902 14.1902 k = 0.5000 0.5000 0.3333 ( 1628 PWs) bands (ev): 7.6378 7.6378 7.7542 7.7542 8.1205 8.1205 8.6373 8.6373 9.8560 9.8560 10.2260 10.2260 11.0874 11.0874 11.1062 11.1062 11.2576 11.2576 11.3095 11.3095 11.3503 11.3503 11.4387 11.4387 11.5622 11.5622 11.8251 11.8251 11.9062 11.9062 11.9161 11.9161 12.7440 12.7440 12.7843 12.7843 12.8462 12.8462 12.9508 12.9508 13.4817 13.4817 13.7068 13.7068 13.9697 13.9697 14.1192 14.1192 k = 0.5000 0.5000 0.3452 ( 1628 PWs) bands (ev): 7.6306 7.6306 7.7297 7.7297 8.0971 8.0971 8.6406 8.6406 9.8861 9.8861 10.2123 10.2123 11.0919 11.0919 11.1112 11.1112 11.2658 11.2658 11.3263 11.3263 11.3446 11.3446 11.4390 11.4390 11.5983 11.5983 11.8921 11.8921 11.9768 11.9768 11.9941 11.9941 12.7566 12.7566 12.8047 12.8047 12.8638 12.8638 12.9700 12.9700 13.4400 13.4400 13.6740 13.6740 13.9316 13.9316 14.0462 14.0462 k = 0.5000 0.5000 0.3571 ( 1628 PWs) bands (ev): 7.6234 7.6234 7.7068 7.7068 8.0756 8.0756 8.6431 8.6431 9.9157 9.9157 10.1993 10.1993 11.0959 11.0959 11.1140 11.1140 11.2735 11.2735 11.3362 11.3362 11.3389 11.3389 11.4382 11.4382 11.6449 11.6449 11.9610 11.9610 12.0505 12.0505 12.0729 12.0729 12.7684 12.7684 12.8238 12.8238 12.8805 12.8805 12.9880 12.9880 13.3960 13.3960 13.6389 13.6389 13.8900 13.8900 13.9714 13.9714 k = 0.5000 0.5000 0.3690 ( 1628 PWs) bands (ev): 7.6164 7.6164 7.6855 7.6855 8.0561 8.0561 8.6447 8.6447 9.9446 9.9446 10.1872 10.1872 11.0993 11.0993 11.1155 11.1155 11.2805 11.2805 11.3335 11.3335 11.3411 11.3411 11.4370 11.4370 11.6986 11.6986 12.0316 12.0316 12.1266 12.1266 12.1518 12.1518 12.7793 12.7793 12.8414 12.8414 12.8962 12.8962 13.0048 13.0048 13.3498 13.3498 13.6016 13.6016 13.8447 13.8447 13.8950 13.8950 k = 0.5000 0.5000 0.3810 ( 1624 PWs) bands (ev): 7.6097 7.6097 7.6661 7.6661 8.0386 8.0386 8.6459 8.6459 9.9723 9.9723 10.1759 10.1759 11.1022 11.1022 11.1160 11.1160 11.2868 11.2868 11.3289 11.3289 11.3428 11.3428 11.4359 11.4359 11.7569 11.7569 12.1038 12.1038 12.2045 12.2045 12.2304 12.2304 12.7892 12.7892 12.8576 12.8576 12.9109 12.9109 13.0202 13.0202 13.3016 13.3016 13.5620 13.5620 13.7958 13.7958 13.8174 13.8174 k = 0.5000 0.5000 0.3929 ( 1624 PWs) bands (ev): 7.6033 7.6033 7.6484 7.6484 8.0230 8.0230 8.6465 8.6465 9.9984 9.9984 10.1656 10.1656 11.1045 11.1045 11.1159 11.1159 11.2923 11.2923 11.3252 11.3252 11.3426 11.3426 11.4352 11.4352 11.8181 11.8181 12.1773 12.1773 12.2835 12.2835 12.3084 12.3084 12.7980 12.7980 12.8721 12.8721 12.9248 12.9248 13.0341 13.0341 13.2516 13.2516 13.5201 13.5201 13.7388 13.7388 13.7431 13.7431 k = 0.5000 0.5000 0.4048 ( 1612 PWs) bands (ev): 7.5973 7.5973 7.6325 7.6325 8.0092 8.0092 8.6469 8.6469 10.0226 10.0226 10.1563 10.1563 11.1065 11.1065 11.1155 11.1155 11.2968 11.2968 11.3228 11.3228 11.3413 11.3413 11.4351 11.4351 11.8810 11.8810 12.2521 12.2521 12.3630 12.3630 12.3854 12.3854 12.8059 12.8059 12.8851 12.8851 12.9380 12.9380 13.0465 13.0465 13.2004 13.2004 13.4760 13.4760 13.6598 13.6598 13.6869 13.6869 k = 0.5000 0.5000 0.4167 ( 1616 PWs) bands (ev): 7.5917 7.5917 7.6184 7.6184 7.9972 7.9972 8.6468 8.6468 10.0445 10.0445 10.1480 10.1480 11.1079 11.1079 11.1147 11.1147 11.2998 11.2998 11.3217 11.3217 11.3393 11.3393 11.4351 11.4351 11.9444 11.9444 12.3277 12.3277 12.4422 12.4422 12.4609 12.4609 12.8125 12.8125 12.8963 12.8963 12.9507 12.9507 13.0571 13.0571 13.1483 13.1483 13.4298 13.4298 13.5809 13.5809 13.6274 13.6274 k = 0.5000 0.5000 0.4286 ( 1632 PWs) bands (ev): 7.5867 7.5867 7.6061 7.6061 7.9869 7.9869 8.6465 8.6465 10.0640 10.0640 10.1406 10.1406 11.1087 11.1087 11.1137 11.1137 11.3013 11.3013 11.3218 11.3218 11.3369 11.3369 11.4352 11.4352 12.0072 12.0072 12.4038 12.4038 12.5200 12.5200 12.5344 12.5344 12.8176 12.8176 12.9055 12.9055 12.9632 12.9632 13.0658 13.0658 13.0964 13.0964 13.3816 13.3816 13.5029 13.5029 13.5648 13.5648 k = 0.5000 0.5000 0.4405 ( 1640 PWs) bands (ev): 7.5823 7.5823 7.5957 7.5957 7.9782 7.9782 8.6461 8.6461 10.0808 10.0808 10.1344 10.1344 11.1093 11.1093 11.1127 11.1127 11.3017 11.3017 11.3230 11.3230 11.3346 11.3346 11.4355 11.4355 12.0682 12.0682 12.4800 12.4800 12.5952 12.5952 12.6055 12.6055 12.8213 12.8213 12.9125 12.9125 12.9762 12.9762 13.0465 13.0465 13.0724 13.0724 13.3316 13.3316 13.4273 13.4273 13.4997 13.4997 k = 0.5000 0.5000 0.4524 ( 1640 PWs) bands (ev): 7.5787 7.5787 7.5872 7.5872 7.9713 7.9713 8.6457 8.6457 10.0948 10.0948 10.1293 10.1293 11.1097 11.1097 11.1119 11.1119 11.3015 11.3015 11.3247 11.3247 11.3326 11.3326 11.4359 11.4359 12.1256 12.1256 12.5555 12.5555 12.6653 12.6653 12.6730 12.6730 12.8230 12.8230 12.9171 12.9171 12.9868 12.9868 13.0051 13.0051 13.0765 13.0765 13.2798 13.2798 13.3567 13.3567 13.4329 13.4329 k = 0.5000 0.5000 0.4643 ( 1640 PWs) bands (ev): 7.5758 7.5758 7.5806 7.5806 7.9659 7.9659 8.6454 8.6454 10.1059 10.1059 10.1253 10.1253 11.1099 11.1099 11.1112 11.1112 11.3012 11.3012 11.3263 11.3263 11.3309 11.3309 11.4364 11.4364 12.1767 12.1767 12.6289 12.6289 12.7264 12.7264 12.7349 12.7349 12.8222 12.8222 12.9184 12.9184 12.9571 12.9571 13.0152 13.0152 13.0776 13.0776 13.2262 13.2262 13.2955 13.2955 13.3655 13.3655 k = 0.5000 0.5000 0.4762 ( 1640 PWs) bands (ev): 7.5737 7.5737 7.5758 7.5758 7.9621 7.9621 8.6451 8.6451 10.1138 10.1138 10.1225 10.1225 11.1101 11.1101 11.1106 11.1106 11.3009 11.3009 11.3276 11.3276 11.3297 11.3297 11.4367 11.4367 12.2182 12.2182 12.6976 12.6976 12.7727 12.7727 12.7868 12.7868 12.8193 12.8193 12.9154 12.9154 12.9282 12.9282 13.0426 13.0426 13.0763 13.0763 13.1727 13.1727 13.2491 13.2491 13.2998 13.2998 k = 0.5000 0.5000 0.4881 ( 1640 PWs) bands (ev): 7.5724 7.5724 7.5730 7.5730 7.9598 7.9598 8.6449 8.6449 10.1186 10.1186 10.1208 10.1208 11.1101 11.1101 11.1103 11.1103 11.3007 11.3007 11.3284 11.3284 11.3289 11.3289 11.4369 11.4369 12.2458 12.2458 12.7563 12.7563 12.7962 12.7962 12.8187 12.8187 12.8194 12.8194 12.9093 12.9093 12.9117 12.9117 13.0769 13.0769 13.0770 13.0770 13.1256 13.1256 13.2209 13.2209 13.2413 13.2413 k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): 7.5720 7.5720 7.5720 7.5720 7.9590 7.9590 8.6449 8.6449 10.1202 10.1202 10.1202 10.1202 11.1102 11.1102 11.1102 11.1102 11.3006 11.3006 11.3287 11.3287 11.3287 11.3287 11.4370 11.4370 12.2555 12.2555 12.7864 12.7864 12.7993 12.7993 12.8231 12.8231 12.8231 12.8231 12.9066 12.9066 12.9066 12.9066 13.0846 13.0846 13.0987 13.0987 13.0987 13.0987 13.2116 13.2116 13.2116 13.2116 Writing output data file Ni3Pt.save init_run : 0.37s CPU 0.49s WALL ( 1 calls) electrons : 82.37s CPU 84.14s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 82.36s CPU 84.13s 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 : 0.06s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.03s WALL ( 325 calls) cegterg : 75.06s CPU 76.41s WALL ( 371 calls) Called by sum_band: Called by *egterg: h_psi : 36.87s CPU 37.83s WALL ( 5434 calls) s_psi : 3.77s CPU 3.96s WALL ( 5434 calls) g_psi : 0.10s CPU 0.09s WALL ( 4738 calls) cdiaghg : 32.96s CPU 33.37s WALL ( 5063 calls) cegterg:over : 2.89s CPU 2.91s WALL ( 4738 calls) cegterg:upda : 1.58s CPU 1.68s WALL ( 4738 calls) cegterg:last : 1.29s CPU 1.29s WALL ( 1220 calls) cdiaghg:chol : 1.77s CPU 1.80s WALL ( 5063 calls) cdiaghg:inve : 1.23s CPU 1.22s WALL ( 5063 calls) cdiaghg:para : 2.01s CPU 2.01s WALL ( 10126 calls) Called by h_psi: h_psi:vloc : 29.27s CPU 29.85s WALL ( 5434 calls) h_psi:vnl : 7.57s CPU 7.91s WALL ( 5434 calls) add_vuspsi : 4.51s CPU 4.50s WALL ( 5434 calls) General routines calbec : 3.04s CPU 3.40s WALL ( 5434 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 26.66s CPU 27.32s WALL ( 745416 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.09s CPU 0.10s WALL ( 650 calls) Parallel routines fft_scatter : 14.52s CPU 14.65s WALL ( 745439 calls) PWSCF : 1m32.95s CPU 1m43.56s WALL This run was terminated on: 20:30:33 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=