Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:56:37 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: ./ScCu.save/ file Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3P 3P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 33 16 5 875 310 55 Max 34 17 6 880 325 58 Sum 1201 609 193 31559 11459 2007 bravais-lattice index = 14 lattice parameter (alat) = 6.1529 a.u. unit-cell volume = 232.9430 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 number of electrons = 22.00 number of Kohn-Sham states= 30 kinetic-energy cutoff = 51.0000 Ry charge density cutoff = 402.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.152948 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 Sc read from file: /users/gautes/Pseudo/Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: e27f768e72ba10e20459589e24f2b6a7 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1173 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Sc 11.00 44.95590 Sc( 1.00) Cu 11.00 63.54600 Cu( 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= 375 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026667 k( 2) = ( 0.0000000 0.0102041 -0.0000000), wk = 0.0026667 k( 3) = ( 0.0000000 0.0204082 -0.0000000), wk = 0.0026667 k( 4) = ( 0.0000000 0.0306122 -0.0000000), wk = 0.0026667 k( 5) = ( 0.0000000 0.0408163 -0.0000000), wk = 0.0026667 k( 6) = ( 0.0000000 0.0510204 -0.0000000), wk = 0.0026667 k( 7) = ( 0.0000000 0.0612245 -0.0000000), wk = 0.0026667 k( 8) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0026667 k( 9) = ( 0.0000000 0.0816327 -0.0000000), wk = 0.0026667 k( 10) = ( 0.0000000 0.0918367 -0.0000000), wk = 0.0026667 k( 11) = ( 0.0000000 0.1020408 -0.0000000), wk = 0.0026667 k( 12) = ( 0.0000000 0.1122449 -0.0000000), wk = 0.0026667 k( 13) = ( 0.0000000 0.1224490 -0.0000000), wk = 0.0026667 k( 14) = ( 0.0000000 0.1326531 -0.0000000), wk = 0.0026667 k( 15) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0026667 k( 16) = ( 0.0000000 0.1530612 -0.0000000), wk = 0.0026667 k( 17) = ( 0.0000000 0.1632653 -0.0000000), wk = 0.0026667 k( 18) = ( 0.0000000 0.1734694 -0.0000000), wk = 0.0026667 k( 19) = ( 0.0000000 0.1836735 -0.0000000), wk = 0.0026667 k( 20) = ( 0.0000000 0.1938776 -0.0000000), wk = 0.0026667 k( 21) = ( 0.0000000 0.2040816 -0.0000000), wk = 0.0026667 k( 22) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0026667 k( 23) = ( 0.0000000 0.2244898 -0.0000000), wk = 0.0026667 k( 24) = ( 0.0000000 0.2346939 -0.0000000), wk = 0.0026667 k( 25) = ( 0.0000000 0.2448980 -0.0000000), wk = 0.0026667 k( 26) = ( 0.0000000 0.2551020 -0.0000000), wk = 0.0026667 k( 27) = ( 0.0000000 0.2653061 -0.0000000), wk = 0.0026667 k( 28) = ( 0.0000000 0.2755102 -0.0000000), wk = 0.0026667 k( 29) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0026667 k( 30) = ( 0.0000000 0.2959184 -0.0000000), wk = 0.0026667 k( 31) = ( 0.0000000 0.3061224 -0.0000000), wk = 0.0026667 k( 32) = ( 0.0000000 0.3163265 -0.0000000), wk = 0.0026667 k( 33) = ( 0.0000000 0.3265306 -0.0000000), wk = 0.0026667 k( 34) = ( 0.0000000 0.3367347 -0.0000000), wk = 0.0026667 k( 35) = ( 0.0000000 0.3469388 -0.0000000), wk = 0.0026667 k( 36) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0026667 k( 37) = ( 0.0000000 0.3673469 -0.0000000), wk = 0.0026667 k( 38) = ( 0.0000000 0.3775510 -0.0000000), wk = 0.0026667 k( 39) = ( 0.0000000 0.3877551 -0.0000000), wk = 0.0026667 k( 40) = ( 0.0000000 0.3979592 -0.0000000), wk = 0.0026667 k( 41) = ( 0.0000000 0.4081633 -0.0000000), wk = 0.0026667 k( 42) = ( 0.0000000 0.4183674 -0.0000000), wk = 0.0026667 k( 43) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0026667 k( 44) = ( 0.0000000 0.4387755 -0.0000000), wk = 0.0026667 k( 45) = ( 0.0000000 0.4489796 -0.0000000), wk = 0.0026667 k( 46) = ( 0.0000000 0.4591837 -0.0000000), wk = 0.0026667 k( 47) = ( 0.0000000 0.4693878 -0.0000000), wk = 0.0026667 k( 48) = ( 0.0000000 0.4795918 -0.0000000), wk = 0.0026667 k( 49) = ( 0.0000000 0.4897959 -0.0000000), wk = 0.0026667 k( 50) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026667 k( 51) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026667 k( 52) = ( 0.0102041 0.5000000 -0.0000000), wk = 0.0026667 k( 53) = ( 0.0204082 0.5000000 -0.0000000), wk = 0.0026667 k( 54) = ( 0.0306122 0.5000000 -0.0000000), wk = 0.0026667 k( 55) = ( 0.0408163 0.5000000 -0.0000000), wk = 0.0026667 k( 56) = ( 0.0510204 0.5000000 -0.0000000), wk = 0.0026667 k( 57) = ( 0.0612245 0.5000000 -0.0000000), wk = 0.0026667 k( 58) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0026667 k( 59) = ( 0.0816327 0.5000000 -0.0000000), wk = 0.0026667 k( 60) = ( 0.0918367 0.5000000 -0.0000000), wk = 0.0026667 k( 61) = ( 0.1020408 0.5000000 -0.0000000), wk = 0.0026667 k( 62) = ( 0.1122449 0.5000000 -0.0000000), wk = 0.0026667 k( 63) = ( 0.1224490 0.5000000 -0.0000000), wk = 0.0026667 k( 64) = ( 0.1326531 0.5000000 -0.0000000), wk = 0.0026667 k( 65) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0026667 k( 66) = ( 0.1530612 0.5000000 -0.0000000), wk = 0.0026667 k( 67) = ( 0.1632653 0.5000000 -0.0000000), wk = 0.0026667 k( 68) = ( 0.1734694 0.5000000 -0.0000000), wk = 0.0026667 k( 69) = ( 0.1836735 0.5000000 -0.0000000), wk = 0.0026667 k( 70) = ( 0.1938776 0.5000000 -0.0000000), wk = 0.0026667 k( 71) = ( 0.2040816 0.5000000 -0.0000000), wk = 0.0026667 k( 72) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0026667 k( 73) = ( 0.2244898 0.5000000 -0.0000000), wk = 0.0026667 k( 74) = ( 0.2346939 0.5000000 -0.0000000), wk = 0.0026667 k( 75) = ( 0.2448980 0.5000000 -0.0000000), wk = 0.0026667 k( 76) = ( 0.2551020 0.5000000 -0.0000000), wk = 0.0026667 k( 77) = ( 0.2653061 0.5000000 -0.0000000), wk = 0.0026667 k( 78) = ( 0.2755102 0.5000000 -0.0000000), wk = 0.0026667 k( 79) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0026667 k( 80) = ( 0.2959184 0.5000000 -0.0000000), wk = 0.0026667 k( 81) = ( 0.3061224 0.5000000 -0.0000000), wk = 0.0026667 k( 82) = ( 0.3163265 0.5000000 -0.0000000), wk = 0.0026667 k( 83) = ( 0.3265306 0.5000000 -0.0000000), wk = 0.0026667 k( 84) = ( 0.3367347 0.5000000 -0.0000000), wk = 0.0026667 k( 85) = ( 0.3469388 0.5000000 -0.0000000), wk = 0.0026667 k( 86) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0026667 k( 87) = ( 0.3673469 0.5000000 -0.0000000), wk = 0.0026667 k( 88) = ( 0.3775510 0.5000000 -0.0000000), wk = 0.0026667 k( 89) = ( 0.3877551 0.5000000 -0.0000000), wk = 0.0026667 k( 90) = ( 0.3979592 0.5000000 -0.0000000), wk = 0.0026667 k( 91) = ( 0.4081633 0.5000000 -0.0000000), wk = 0.0026667 k( 92) = ( 0.4183674 0.5000000 -0.0000000), wk = 0.0026667 k( 93) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0026667 k( 94) = ( 0.4387755 0.5000000 -0.0000000), wk = 0.0026667 k( 95) = ( 0.4489796 0.5000000 -0.0000000), wk = 0.0026667 k( 96) = ( 0.4591837 0.5000000 -0.0000000), wk = 0.0026667 k( 97) = ( 0.4693878 0.5000000 -0.0000000), wk = 0.0026667 k( 98) = ( 0.4795918 0.5000000 -0.0000000), wk = 0.0026667 k( 99) = ( 0.4897959 0.5000000 -0.0000000), wk = 0.0026667 k( 100) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026667 k( 101) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026667 k( 102) = ( 0.4927536 0.4927536 -0.0000000), wk = 0.0026667 k( 103) = ( 0.4855073 0.4855072 -0.0000000), wk = 0.0026667 k( 104) = ( 0.4782609 0.4782609 -0.0000000), wk = 0.0026667 k( 105) = ( 0.4710145 0.4710145 -0.0000000), wk = 0.0026667 k( 106) = ( 0.4637681 0.4637681 -0.0000000), wk = 0.0026667 k( 107) = ( 0.4565217 0.4565217 -0.0000000), wk = 0.0026667 k( 108) = ( 0.4492754 0.4492754 -0.0000000), wk = 0.0026667 k( 109) = ( 0.4420290 0.4420290 -0.0000000), wk = 0.0026667 k( 110) = ( 0.4347826 0.4347826 -0.0000000), wk = 0.0026667 k( 111) = ( 0.4275362 0.4275362 -0.0000000), wk = 0.0026667 k( 112) = ( 0.4202899 0.4202899 -0.0000000), wk = 0.0026667 k( 113) = ( 0.4130435 0.4130435 -0.0000000), wk = 0.0026667 k( 114) = ( 0.4057971 0.4057971 -0.0000000), wk = 0.0026667 k( 115) = ( 0.3985507 0.3985507 -0.0000000), wk = 0.0026667 k( 116) = ( 0.3913044 0.3913043 -0.0000000), wk = 0.0026667 k( 117) = ( 0.3840580 0.3840580 -0.0000000), wk = 0.0026667 k( 118) = ( 0.3768116 0.3768116 -0.0000000), wk = 0.0026667 k( 119) = ( 0.3695652 0.3695652 -0.0000000), wk = 0.0026667 k( 120) = ( 0.3623188 0.3623188 -0.0000000), wk = 0.0026667 k( 121) = ( 0.3550725 0.3550725 -0.0000000), wk = 0.0026667 k( 122) = ( 0.3478261 0.3478261 -0.0000000), wk = 0.0026667 k( 123) = ( 0.3405797 0.3405797 -0.0000000), wk = 0.0026667 k( 124) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0026667 k( 125) = ( 0.3260870 0.3260870 -0.0000000), wk = 0.0026667 k( 126) = ( 0.3188406 0.3188406 -0.0000000), wk = 0.0026667 k( 127) = ( 0.3115942 0.3115942 -0.0000000), wk = 0.0026667 k( 128) = ( 0.3043478 0.3043478 -0.0000000), wk = 0.0026667 k( 129) = ( 0.2971014 0.2971014 -0.0000000), wk = 0.0026667 k( 130) = ( 0.2898551 0.2898551 -0.0000000), wk = 0.0026667 k( 131) = ( 0.2826087 0.2826087 -0.0000000), wk = 0.0026667 k( 132) = ( 0.2753623 0.2753623 -0.0000000), wk = 0.0026667 k( 133) = ( 0.2681159 0.2681159 -0.0000000), wk = 0.0026667 k( 134) = ( 0.2608696 0.2608696 -0.0000000), wk = 0.0026667 k( 135) = ( 0.2536232 0.2536232 -0.0000000), wk = 0.0026667 k( 136) = ( 0.2463768 0.2463768 -0.0000000), wk = 0.0026667 k( 137) = ( 0.2391304 0.2391304 -0.0000000), wk = 0.0026667 k( 138) = ( 0.2318841 0.2318841 -0.0000000), wk = 0.0026667 k( 139) = ( 0.2246377 0.2246377 -0.0000000), wk = 0.0026667 k( 140) = ( 0.2173913 0.2173913 -0.0000000), wk = 0.0026667 k( 141) = ( 0.2101449 0.2101449 -0.0000000), wk = 0.0026667 k( 142) = ( 0.2028986 0.2028985 -0.0000000), wk = 0.0026667 k( 143) = ( 0.1956522 0.1956522 -0.0000000), wk = 0.0026667 k( 144) = ( 0.1884058 0.1884058 -0.0000000), wk = 0.0026667 k( 145) = ( 0.1811594 0.1811594 -0.0000000), wk = 0.0026667 k( 146) = ( 0.1739130 0.1739130 -0.0000000), wk = 0.0026667 k( 147) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0026667 k( 148) = ( 0.1594203 0.1594203 -0.0000000), wk = 0.0026667 k( 149) = ( 0.1521739 0.1521739 -0.0000000), wk = 0.0026667 k( 150) = ( 0.1449275 0.1449275 -0.0000000), wk = 0.0026667 k( 151) = ( 0.1376812 0.1376812 -0.0000000), wk = 0.0026667 k( 152) = ( 0.1304348 0.1304348 -0.0000000), wk = 0.0026667 k( 153) = ( 0.1231884 0.1231884 -0.0000000), wk = 0.0026667 k( 154) = ( 0.1159420 0.1159420 -0.0000000), wk = 0.0026667 k( 155) = ( 0.1086957 0.1086956 -0.0000000), wk = 0.0026667 k( 156) = ( 0.1014493 0.1014493 -0.0000000), wk = 0.0026667 k( 157) = ( 0.0942029 0.0942029 -0.0000000), wk = 0.0026667 k( 158) = ( 0.0869565 0.0869565 -0.0000000), wk = 0.0026667 k( 159) = ( 0.0797101 0.0797101 -0.0000000), wk = 0.0026667 k( 160) = ( 0.0724638 0.0724638 -0.0000000), wk = 0.0026667 k( 161) = ( 0.0652174 0.0652174 -0.0000000), wk = 0.0026667 k( 162) = ( 0.0579710 0.0579710 -0.0000000), wk = 0.0026667 k( 163) = ( 0.0507246 0.0507246 -0.0000000), wk = 0.0026667 k( 164) = ( 0.0434783 0.0434783 -0.0000000), wk = 0.0026667 k( 165) = ( 0.0362319 0.0362319 -0.0000000), wk = 0.0026667 k( 166) = ( 0.0289855 0.0289855 -0.0000000), wk = 0.0026667 k( 167) = ( 0.0217391 0.0217391 -0.0000000), wk = 0.0026667 k( 168) = ( 0.0144928 0.0144927 -0.0000000), wk = 0.0026667 k( 169) = ( 0.0072464 0.0072464 -0.0000000), wk = 0.0026667 k( 170) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026667 k( 171) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026667 k( 172) = ( 0.0059524 0.0059524 0.0059524), wk = 0.0026667 k( 173) = ( 0.0119048 0.0119048 0.0119048), wk = 0.0026667 k( 174) = ( 0.0178571 0.0178571 0.0178571), wk = 0.0026667 k( 175) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0026667 k( 176) = ( 0.0297619 0.0297619 0.0297619), wk = 0.0026667 k( 177) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0026667 k( 178) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0026667 k( 179) = ( 0.0476191 0.0476190 0.0476190), wk = 0.0026667 k( 180) = ( 0.0535714 0.0535714 0.0535714), wk = 0.0026667 k( 181) = ( 0.0595238 0.0595238 0.0595238), wk = 0.0026667 k( 182) = ( 0.0654762 0.0654762 0.0654762), wk = 0.0026667 k( 183) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0026667 k( 184) = ( 0.0773810 0.0773809 0.0773809), wk = 0.0026667 k( 185) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0026667 k( 186) = ( 0.0892857 0.0892857 0.0892857), wk = 0.0026667 k( 187) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0026667 k( 188) = ( 0.1011905 0.1011905 0.1011905), wk = 0.0026667 k( 189) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0026667 k( 190) = ( 0.1130952 0.1130952 0.1130952), wk = 0.0026667 k( 191) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0026667 k( 192) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0026667 k( 193) = ( 0.1309524 0.1309524 0.1309524), wk = 0.0026667 k( 194) = ( 0.1369048 0.1369048 0.1369048), wk = 0.0026667 k( 195) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0026667 k( 196) = ( 0.1488095 0.1488095 0.1488095), wk = 0.0026667 k( 197) = ( 0.1547619 0.1547619 0.1547619), wk = 0.0026667 k( 198) = ( 0.1607143 0.1607143 0.1607143), wk = 0.0026667 k( 199) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0026667 k( 200) = ( 0.1726190 0.1726190 0.1726190), wk = 0.0026667 k( 201) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0026667 k( 202) = ( 0.1845238 0.1845238 0.1845238), wk = 0.0026667 k( 203) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0026667 k( 204) = ( 0.1964286 0.1964286 0.1964286), wk = 0.0026667 k( 205) = ( 0.2023810 0.2023809 0.2023809), wk = 0.0026667 k( 206) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0026667 k( 207) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0026667 k( 208) = ( 0.2202381 0.2202381 0.2202381), wk = 0.0026667 k( 209) = ( 0.2261905 0.2261905 0.2261905), wk = 0.0026667 k( 210) = ( 0.2321429 0.2321429 0.2321429), wk = 0.0026667 k( 211) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0026667 k( 212) = ( 0.2440476 0.2440476 0.2440476), wk = 0.0026667 k( 213) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026667 k( 214) = ( 0.2559524 0.2559524 0.2559524), wk = 0.0026667 k( 215) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0026667 k( 216) = ( 0.2678571 0.2678571 0.2678571), wk = 0.0026667 k( 217) = ( 0.2738095 0.2738095 0.2738095), wk = 0.0026667 k( 218) = ( 0.2797619 0.2797619 0.2797619), wk = 0.0026667 k( 219) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0026667 k( 220) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0026667 k( 221) = ( 0.2976190 0.2976190 0.2976190), wk = 0.0026667 k( 222) = ( 0.3035714 0.3035714 0.3035714), wk = 0.0026667 k( 223) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0026667 k( 224) = ( 0.3154762 0.3154762 0.3154762), wk = 0.0026667 k( 225) = ( 0.3214286 0.3214286 0.3214286), wk = 0.0026667 k( 226) = ( 0.3273810 0.3273809 0.3273809), wk = 0.0026667 k( 227) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0026667 k( 228) = ( 0.3392857 0.3392857 0.3392857), wk = 0.0026667 k( 229) = ( 0.3452381 0.3452381 0.3452381), wk = 0.0026667 k( 230) = ( 0.3511905 0.3511905 0.3511905), wk = 0.0026667 k( 231) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0026667 k( 232) = ( 0.3630952 0.3630952 0.3630952), wk = 0.0026667 k( 233) = ( 0.3690476 0.3690476 0.3690476), wk = 0.0026667 k( 234) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0026667 k( 235) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0026667 k( 236) = ( 0.3869048 0.3869048 0.3869048), wk = 0.0026667 k( 237) = ( 0.3928571 0.3928571 0.3928571), wk = 0.0026667 k( 238) = ( 0.3988095 0.3988095 0.3988095), wk = 0.0026667 k( 239) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0026667 k( 240) = ( 0.4107143 0.4107143 0.4107143), wk = 0.0026667 k( 241) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0026667 k( 242) = ( 0.4226190 0.4226190 0.4226190), wk = 0.0026667 k( 243) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0026667 k( 244) = ( 0.4345238 0.4345238 0.4345238), wk = 0.0026667 k( 245) = ( 0.4404762 0.4404762 0.4404762), wk = 0.0026667 k( 246) = ( 0.4464286 0.4464286 0.4464286), wk = 0.0026667 k( 247) = ( 0.4523810 0.4523809 0.4523809), wk = 0.0026667 k( 248) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0026667 k( 249) = ( 0.4642857 0.4642857 0.4642857), wk = 0.0026667 k( 250) = ( 0.4702381 0.4702381 0.4702381), wk = 0.0026667 k( 251) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0026667 k( 252) = ( 0.4821429 0.4821429 0.4821429), wk = 0.0026667 k( 253) = ( 0.4880952 0.4880952 0.4880952), wk = 0.0026667 k( 254) = ( 0.4940476 0.4940476 0.4940476), wk = 0.0026667 k( 255) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026667 k( 256) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026667 k( 257) = ( 0.4927536 0.5000000 0.4927536), wk = 0.0026667 k( 258) = ( 0.4855073 0.5000000 0.4855072), wk = 0.0026667 k( 259) = ( 0.4782609 0.5000000 0.4782609), wk = 0.0026667 k( 260) = ( 0.4710145 0.5000000 0.4710145), wk = 0.0026667 k( 261) = ( 0.4637681 0.5000000 0.4637681), wk = 0.0026667 k( 262) = ( 0.4565217 0.5000000 0.4565217), wk = 0.0026667 k( 263) = ( 0.4492754 0.5000000 0.4492754), wk = 0.0026667 k( 264) = ( 0.4420290 0.5000000 0.4420290), wk = 0.0026667 k( 265) = ( 0.4347826 0.5000000 0.4347826), wk = 0.0026667 k( 266) = ( 0.4275362 0.5000000 0.4275362), wk = 0.0026667 k( 267) = ( 0.4202899 0.5000000 0.4202899), wk = 0.0026667 k( 268) = ( 0.4130435 0.5000000 0.4130435), wk = 0.0026667 k( 269) = ( 0.4057971 0.5000000 0.4057971), wk = 0.0026667 k( 270) = ( 0.3985507 0.5000000 0.3985507), wk = 0.0026667 k( 271) = ( 0.3913044 0.5000000 0.3913043), wk = 0.0026667 k( 272) = ( 0.3840580 0.5000000 0.3840580), wk = 0.0026667 k( 273) = ( 0.3768116 0.5000000 0.3768116), wk = 0.0026667 k( 274) = ( 0.3695652 0.5000000 0.3695652), wk = 0.0026667 k( 275) = ( 0.3623188 0.5000000 0.3623188), wk = 0.0026667 k( 276) = ( 0.3550725 0.5000000 0.3550725), wk = 0.0026667 k( 277) = ( 0.3478261 0.5000000 0.3478261), wk = 0.0026667 k( 278) = ( 0.3405797 0.5000000 0.3405797), wk = 0.0026667 k( 279) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0026667 k( 280) = ( 0.3260870 0.5000000 0.3260870), wk = 0.0026667 k( 281) = ( 0.3188406 0.5000000 0.3188406), wk = 0.0026667 k( 282) = ( 0.3115942 0.5000000 0.3115942), wk = 0.0026667 k( 283) = ( 0.3043478 0.5000000 0.3043478), wk = 0.0026667 k( 284) = ( 0.2971014 0.5000000 0.2971014), wk = 0.0026667 k( 285) = ( 0.2898551 0.5000000 0.2898551), wk = 0.0026667 k( 286) = ( 0.2826087 0.5000000 0.2826087), wk = 0.0026667 k( 287) = ( 0.2753623 0.5000000 0.2753623), wk = 0.0026667 k( 288) = ( 0.2681159 0.5000000 0.2681159), wk = 0.0026667 k( 289) = ( 0.2608696 0.5000000 0.2608696), wk = 0.0026667 k( 290) = ( 0.2536232 0.5000000 0.2536232), wk = 0.0026667 k( 291) = ( 0.2463768 0.5000000 0.2463768), wk = 0.0026667 k( 292) = ( 0.2391304 0.5000000 0.2391304), wk = 0.0026667 k( 293) = ( 0.2318841 0.5000000 0.2318841), wk = 0.0026667 k( 294) = ( 0.2246377 0.5000000 0.2246377), wk = 0.0026667 k( 295) = ( 0.2173913 0.5000000 0.2173913), wk = 0.0026667 k( 296) = ( 0.2101449 0.5000000 0.2101449), wk = 0.0026667 k( 297) = ( 0.2028986 0.5000000 0.2028985), wk = 0.0026667 k( 298) = ( 0.1956522 0.5000000 0.1956522), wk = 0.0026667 k( 299) = ( 0.1884058 0.5000000 0.1884058), wk = 0.0026667 k( 300) = ( 0.1811594 0.5000000 0.1811594), wk = 0.0026667 k( 301) = ( 0.1739130 0.5000000 0.1739130), wk = 0.0026667 k( 302) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0026667 k( 303) = ( 0.1594203 0.5000000 0.1594203), wk = 0.0026667 k( 304) = ( 0.1521739 0.5000000 0.1521739), wk = 0.0026667 k( 305) = ( 0.1449275 0.5000000 0.1449275), wk = 0.0026667 k( 306) = ( 0.1376812 0.5000000 0.1376812), wk = 0.0026667 k( 307) = ( 0.1304348 0.5000000 0.1304348), wk = 0.0026667 k( 308) = ( 0.1231884 0.5000000 0.1231884), wk = 0.0026667 k( 309) = ( 0.1159420 0.5000000 0.1159420), wk = 0.0026667 k( 310) = ( 0.1086957 0.5000000 0.1086956), wk = 0.0026667 k( 311) = ( 0.1014493 0.5000000 0.1014493), wk = 0.0026667 k( 312) = ( 0.0942029 0.5000000 0.0942029), wk = 0.0026667 k( 313) = ( 0.0869565 0.5000000 0.0869565), wk = 0.0026667 k( 314) = ( 0.0797101 0.5000000 0.0797101), wk = 0.0026667 k( 315) = ( 0.0724638 0.5000000 0.0724638), wk = 0.0026667 k( 316) = ( 0.0652174 0.5000000 0.0652174), wk = 0.0026667 k( 317) = ( 0.0579710 0.5000000 0.0579710), wk = 0.0026667 k( 318) = ( 0.0507246 0.5000000 0.0507246), wk = 0.0026667 k( 319) = ( 0.0434783 0.5000000 0.0434783), wk = 0.0026667 k( 320) = ( 0.0362319 0.5000000 0.0362319), wk = 0.0026667 k( 321) = ( 0.0289855 0.5000000 0.0289855), wk = 0.0026667 k( 322) = ( 0.0217391 0.5000000 0.0217391), wk = 0.0026667 k( 323) = ( 0.0144928 0.5000000 0.0144927), wk = 0.0026667 k( 324) = ( 0.0072464 0.5000000 0.0072464), wk = 0.0026667 k( 325) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026667 k( 326) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026667 k( 327) = ( 0.5000000 0.5000000 0.0102041), wk = 0.0026667 k( 328) = ( 0.5000000 0.5000000 0.0204082), wk = 0.0026667 k( 329) = ( 0.5000000 0.5000000 0.0306122), wk = 0.0026667 k( 330) = ( 0.5000000 0.5000000 0.0408163), wk = 0.0026667 k( 331) = ( 0.5000000 0.5000000 0.0510204), wk = 0.0026667 k( 332) = ( 0.5000000 0.5000000 0.0612245), wk = 0.0026667 k( 333) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0026667 k( 334) = ( 0.5000000 0.5000000 0.0816326), wk = 0.0026667 k( 335) = ( 0.5000000 0.5000000 0.0918367), wk = 0.0026667 k( 336) = ( 0.5000000 0.5000000 0.1020408), wk = 0.0026667 k( 337) = ( 0.5000000 0.5000000 0.1122449), wk = 0.0026667 k( 338) = ( 0.5000000 0.5000000 0.1224490), wk = 0.0026667 k( 339) = ( 0.5000000 0.5000000 0.1326531), wk = 0.0026667 k( 340) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0026667 k( 341) = ( 0.5000000 0.5000000 0.1530612), wk = 0.0026667 k( 342) = ( 0.5000000 0.5000000 0.1632653), wk = 0.0026667 k( 343) = ( 0.5000000 0.5000000 0.1734694), wk = 0.0026667 k( 344) = ( 0.5000000 0.5000000 0.1836735), wk = 0.0026667 k( 345) = ( 0.5000000 0.5000000 0.1938775), wk = 0.0026667 k( 346) = ( 0.5000000 0.5000000 0.2040816), wk = 0.0026667 k( 347) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0026667 k( 348) = ( 0.5000000 0.5000000 0.2244898), wk = 0.0026667 k( 349) = ( 0.5000000 0.5000000 0.2346939), wk = 0.0026667 k( 350) = ( 0.5000000 0.5000000 0.2448980), wk = 0.0026667 k( 351) = ( 0.5000000 0.5000000 0.2551020), wk = 0.0026667 k( 352) = ( 0.5000000 0.5000000 0.2653061), wk = 0.0026667 k( 353) = ( 0.5000000 0.5000000 0.2755102), wk = 0.0026667 k( 354) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0026667 k( 355) = ( 0.5000000 0.5000000 0.2959184), wk = 0.0026667 k( 356) = ( 0.5000000 0.5000000 0.3061224), wk = 0.0026667 k( 357) = ( 0.5000000 0.5000000 0.3163265), wk = 0.0026667 k( 358) = ( 0.5000000 0.5000000 0.3265306), wk = 0.0026667 k( 359) = ( 0.5000000 0.5000000 0.3367347), wk = 0.0026667 k( 360) = ( 0.5000000 0.5000000 0.3469388), wk = 0.0026667 k( 361) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0026667 k( 362) = ( 0.5000000 0.5000000 0.3673469), wk = 0.0026667 k( 363) = ( 0.5000000 0.5000000 0.3775510), wk = 0.0026667 k( 364) = ( 0.5000000 0.5000000 0.3877551), wk = 0.0026667 k( 365) = ( 0.5000000 0.5000000 0.3979592), wk = 0.0026667 k( 366) = ( 0.5000000 0.5000000 0.4081633), wk = 0.0026667 k( 367) = ( 0.5000000 0.5000000 0.4183673), wk = 0.0026667 k( 368) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0026667 k( 369) = ( 0.5000000 0.5000000 0.4387755), wk = 0.0026667 k( 370) = ( 0.5000000 0.5000000 0.4489796), wk = 0.0026667 k( 371) = ( 0.5000000 0.5000000 0.4591837), wk = 0.0026667 k( 372) = ( 0.5000000 0.5000000 0.4693878), wk = 0.0026667 k( 373) = ( 0.5000000 0.5000000 0.4795918), wk = 0.0026667 k( 374) = ( 0.5000000 0.5000000 0.4897959), wk = 0.0026667 k( 375) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026667 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026667 k( 2) = ( 0.0000000 0.0102041 0.0000000), wk = 0.0026667 k( 3) = ( 0.0000000 0.0204082 0.0000000), wk = 0.0026667 k( 4) = ( 0.0000000 0.0306122 0.0000000), wk = 0.0026667 k( 5) = ( 0.0000000 0.0408163 0.0000000), wk = 0.0026667 k( 6) = ( 0.0000000 0.0510204 0.0000000), wk = 0.0026667 k( 7) = ( 0.0000000 0.0612245 0.0000000), wk = 0.0026667 k( 8) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0026667 k( 9) = ( 0.0000000 0.0816327 0.0000000), wk = 0.0026667 k( 10) = ( 0.0000000 0.0918367 0.0000000), wk = 0.0026667 k( 11) = ( 0.0000000 0.1020408 0.0000000), wk = 0.0026667 k( 12) = ( 0.0000000 0.1122449 0.0000000), wk = 0.0026667 k( 13) = ( 0.0000000 0.1224490 0.0000000), wk = 0.0026667 k( 14) = ( 0.0000000 0.1326531 0.0000000), wk = 0.0026667 k( 15) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0026667 k( 16) = ( 0.0000000 0.1530612 0.0000000), wk = 0.0026667 k( 17) = ( 0.0000000 0.1632653 0.0000000), wk = 0.0026667 k( 18) = ( 0.0000000 0.1734694 0.0000000), wk = 0.0026667 k( 19) = ( 0.0000000 0.1836735 0.0000000), wk = 0.0026667 k( 20) = ( 0.0000000 0.1938776 0.0000000), wk = 0.0026667 k( 21) = ( 0.0000000 0.2040816 0.0000000), wk = 0.0026667 k( 22) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0026667 k( 23) = ( 0.0000000 0.2244898 0.0000000), wk = 0.0026667 k( 24) = ( 0.0000000 0.2346939 0.0000000), wk = 0.0026667 k( 25) = ( 0.0000000 0.2448980 0.0000000), wk = 0.0026667 k( 26) = ( 0.0000000 0.2551020 0.0000000), wk = 0.0026667 k( 27) = ( 0.0000000 0.2653061 0.0000000), wk = 0.0026667 k( 28) = ( 0.0000000 0.2755102 0.0000000), wk = 0.0026667 k( 29) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0026667 k( 30) = ( 0.0000000 0.2959184 0.0000000), wk = 0.0026667 k( 31) = ( 0.0000000 0.3061224 0.0000000), wk = 0.0026667 k( 32) = ( 0.0000000 0.3163265 0.0000000), wk = 0.0026667 k( 33) = ( 0.0000000 0.3265306 0.0000000), wk = 0.0026667 k( 34) = ( 0.0000000 0.3367347 0.0000000), wk = 0.0026667 k( 35) = ( 0.0000000 0.3469388 0.0000000), wk = 0.0026667 k( 36) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0026667 k( 37) = ( 0.0000000 0.3673469 0.0000000), wk = 0.0026667 k( 38) = ( 0.0000000 0.3775510 0.0000000), wk = 0.0026667 k( 39) = ( 0.0000000 0.3877551 0.0000000), wk = 0.0026667 k( 40) = ( 0.0000000 0.3979592 0.0000000), wk = 0.0026667 k( 41) = ( 0.0000000 0.4081633 0.0000000), wk = 0.0026667 k( 42) = ( 0.0000000 0.4183674 0.0000000), wk = 0.0026667 k( 43) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0026667 k( 44) = ( 0.0000000 0.4387755 0.0000000), wk = 0.0026667 k( 45) = ( 0.0000000 0.4489796 0.0000000), wk = 0.0026667 k( 46) = ( 0.0000000 0.4591837 0.0000000), wk = 0.0026667 k( 47) = ( 0.0000000 0.4693878 0.0000000), wk = 0.0026667 k( 48) = ( 0.0000000 0.4795918 0.0000000), wk = 0.0026667 k( 49) = ( 0.0000000 0.4897959 0.0000000), wk = 0.0026667 k( 50) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026667 k( 51) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026667 k( 52) = ( 0.0102041 0.5000000 0.0000000), wk = 0.0026667 k( 53) = ( 0.0204082 0.5000000 0.0000000), wk = 0.0026667 k( 54) = ( 0.0306122 0.5000000 0.0000000), wk = 0.0026667 k( 55) = ( 0.0408163 0.5000000 0.0000000), wk = 0.0026667 k( 56) = ( 0.0510204 0.5000000 0.0000000), wk = 0.0026667 k( 57) = ( 0.0612245 0.5000000 0.0000000), wk = 0.0026667 k( 58) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0026667 k( 59) = ( 0.0816327 0.5000000 0.0000000), wk = 0.0026667 k( 60) = ( 0.0918367 0.5000000 0.0000000), wk = 0.0026667 k( 61) = ( 0.1020408 0.5000000 0.0000000), wk = 0.0026667 k( 62) = ( 0.1122449 0.5000000 0.0000000), wk = 0.0026667 k( 63) = ( 0.1224490 0.5000000 0.0000000), wk = 0.0026667 k( 64) = ( 0.1326531 0.5000000 0.0000000), wk = 0.0026667 k( 65) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0026667 k( 66) = ( 0.1530612 0.5000000 0.0000000), wk = 0.0026667 k( 67) = ( 0.1632653 0.5000000 0.0000000), wk = 0.0026667 k( 68) = ( 0.1734694 0.5000000 0.0000000), wk = 0.0026667 k( 69) = ( 0.1836735 0.5000000 0.0000000), wk = 0.0026667 k( 70) = ( 0.1938776 0.5000000 0.0000000), wk = 0.0026667 k( 71) = ( 0.2040816 0.5000000 0.0000000), wk = 0.0026667 k( 72) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0026667 k( 73) = ( 0.2244898 0.5000000 0.0000000), wk = 0.0026667 k( 74) = ( 0.2346939 0.5000000 0.0000000), wk = 0.0026667 k( 75) = ( 0.2448980 0.5000000 0.0000000), wk = 0.0026667 k( 76) = ( 0.2551020 0.5000000 0.0000000), wk = 0.0026667 k( 77) = ( 0.2653061 0.5000000 0.0000000), wk = 0.0026667 k( 78) = ( 0.2755102 0.5000000 0.0000000), wk = 0.0026667 k( 79) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0026667 k( 80) = ( 0.2959184 0.5000000 -0.0000000), wk = 0.0026667 k( 81) = ( 0.3061224 0.5000000 -0.0000000), wk = 0.0026667 k( 82) = ( 0.3163265 0.5000000 0.0000000), wk = 0.0026667 k( 83) = ( 0.3265306 0.5000000 0.0000000), wk = 0.0026667 k( 84) = ( 0.3367347 0.5000000 0.0000000), wk = 0.0026667 k( 85) = ( 0.3469388 0.5000000 0.0000000), wk = 0.0026667 k( 86) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0026667 k( 87) = ( 0.3673469 0.5000000 0.0000000), wk = 0.0026667 k( 88) = ( 0.3775510 0.5000000 0.0000000), wk = 0.0026667 k( 89) = ( 0.3877551 0.5000000 0.0000000), wk = 0.0026667 k( 90) = ( 0.3979592 0.5000000 0.0000000), wk = 0.0026667 k( 91) = ( 0.4081633 0.5000000 -0.0000000), wk = 0.0026667 k( 92) = ( 0.4183674 0.5000000 -0.0000000), wk = 0.0026667 k( 93) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0026667 k( 94) = ( 0.4387755 0.5000000 0.0000000), wk = 0.0026667 k( 95) = ( 0.4489796 0.5000000 0.0000000), wk = 0.0026667 k( 96) = ( 0.4591837 0.5000000 0.0000000), wk = 0.0026667 k( 97) = ( 0.4693878 0.5000000 0.0000000), wk = 0.0026667 k( 98) = ( 0.4795918 0.5000000 0.0000000), wk = 0.0026667 k( 99) = ( 0.4897959 0.5000000 0.0000000), wk = 0.0026667 k( 100) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026667 k( 101) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026667 k( 102) = ( 0.4927536 0.4927536 0.0000000), wk = 0.0026667 k( 103) = ( 0.4855073 0.4855073 0.0000000), wk = 0.0026667 k( 104) = ( 0.4782609 0.4782609 0.0000000), wk = 0.0026667 k( 105) = ( 0.4710145 0.4710145 0.0000000), wk = 0.0026667 k( 106) = ( 0.4637681 0.4637681 0.0000000), wk = 0.0026667 k( 107) = ( 0.4565217 0.4565217 0.0000000), wk = 0.0026667 k( 108) = ( 0.4492754 0.4492754 0.0000000), wk = 0.0026667 k( 109) = ( 0.4420290 0.4420290 0.0000000), wk = 0.0026667 k( 110) = ( 0.4347826 0.4347826 -0.0000000), wk = 0.0026667 k( 111) = ( 0.4275362 0.4275362 0.0000000), wk = 0.0026667 k( 112) = ( 0.4202899 0.4202899 0.0000000), wk = 0.0026667 k( 113) = ( 0.4130435 0.4130435 0.0000000), wk = 0.0026667 k( 114) = ( 0.4057971 0.4057971 -0.0000000), wk = 0.0026667 k( 115) = ( 0.3985507 0.3985507 0.0000000), wk = 0.0026667 k( 116) = ( 0.3913044 0.3913044 0.0000000), wk = 0.0026667 k( 117) = ( 0.3840580 0.3840580 0.0000000), wk = 0.0026667 k( 118) = ( 0.3768116 0.3768116 -0.0000000), wk = 0.0026667 k( 119) = ( 0.3695652 0.3695652 0.0000000), wk = 0.0026667 k( 120) = ( 0.3623188 0.3623188 0.0000000), wk = 0.0026667 k( 121) = ( 0.3550725 0.3550725 0.0000000), wk = 0.0026667 k( 122) = ( 0.3478261 0.3478261 0.0000000), wk = 0.0026667 k( 123) = ( 0.3405797 0.3405797 0.0000000), wk = 0.0026667 k( 124) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0026667 k( 125) = ( 0.3260870 0.3260870 0.0000000), wk = 0.0026667 k( 126) = ( 0.3188406 0.3188406 0.0000000), wk = 0.0026667 k( 127) = ( 0.3115942 0.3115942 0.0000000), wk = 0.0026667 k( 128) = ( 0.3043478 0.3043478 0.0000000), wk = 0.0026667 k( 129) = ( 0.2971014 0.2971014 0.0000000), wk = 0.0026667 k( 130) = ( 0.2898551 0.2898551 0.0000000), wk = 0.0026667 k( 131) = ( 0.2826087 0.2826087 0.0000000), wk = 0.0026667 k( 132) = ( 0.2753623 0.2753623 0.0000000), wk = 0.0026667 k( 133) = ( 0.2681159 0.2681159 0.0000000), wk = 0.0026667 k( 134) = ( 0.2608696 0.2608696 0.0000000), wk = 0.0026667 k( 135) = ( 0.2536232 0.2536232 0.0000000), wk = 0.0026667 k( 136) = ( 0.2463768 0.2463768 0.0000000), wk = 0.0026667 k( 137) = ( 0.2391304 0.2391304 0.0000000), wk = 0.0026667 k( 138) = ( 0.2318841 0.2318841 0.0000000), wk = 0.0026667 k( 139) = ( 0.2246377 0.2246377 0.0000000), wk = 0.0026667 k( 140) = ( 0.2173913 0.2173913 0.0000000), wk = 0.0026667 k( 141) = ( 0.2101449 0.2101449 0.0000000), wk = 0.0026667 k( 142) = ( 0.2028986 0.2028986 -0.0000000), wk = 0.0026667 k( 143) = ( 0.1956522 0.1956522 0.0000000), wk = 0.0026667 k( 144) = ( 0.1884058 0.1884058 0.0000000), wk = 0.0026667 k( 145) = ( 0.1811594 0.1811594 0.0000000), wk = 0.0026667 k( 146) = ( 0.1739130 0.1739130 0.0000000), wk = 0.0026667 k( 147) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0026667 k( 148) = ( 0.1594203 0.1594203 0.0000000), wk = 0.0026667 k( 149) = ( 0.1521739 0.1521739 0.0000000), wk = 0.0026667 k( 150) = ( 0.1449275 0.1449275 0.0000000), wk = 0.0026667 k( 151) = ( 0.1376812 0.1376812 0.0000000), wk = 0.0026667 k( 152) = ( 0.1304348 0.1304348 0.0000000), wk = 0.0026667 k( 153) = ( 0.1231884 0.1231884 0.0000000), wk = 0.0026667 k( 154) = ( 0.1159420 0.1159420 0.0000000), wk = 0.0026667 k( 155) = ( 0.1086957 0.1086957 0.0000000), wk = 0.0026667 k( 156) = ( 0.1014493 0.1014493 0.0000000), wk = 0.0026667 k( 157) = ( 0.0942029 0.0942029 0.0000000), wk = 0.0026667 k( 158) = ( 0.0869565 0.0869565 0.0000000), wk = 0.0026667 k( 159) = ( 0.0797101 0.0797101 0.0000000), wk = 0.0026667 k( 160) = ( 0.0724638 0.0724638 0.0000000), wk = 0.0026667 k( 161) = ( 0.0652174 0.0652174 0.0000000), wk = 0.0026667 k( 162) = ( 0.0579710 0.0579710 0.0000000), wk = 0.0026667 k( 163) = ( 0.0507246 0.0507246 0.0000000), wk = 0.0026667 k( 164) = ( 0.0434783 0.0434783 0.0000000), wk = 0.0026667 k( 165) = ( 0.0362319 0.0362319 0.0000000), wk = 0.0026667 k( 166) = ( 0.0289855 0.0289855 0.0000000), wk = 0.0026667 k( 167) = ( 0.0217391 0.0217391 0.0000000), wk = 0.0026667 k( 168) = ( 0.0144928 0.0144928 0.0000000), wk = 0.0026667 k( 169) = ( 0.0072464 0.0072464 0.0000000), wk = 0.0026667 k( 170) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026667 k( 171) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026667 k( 172) = ( 0.0059524 0.0059524 0.0059524), wk = 0.0026667 k( 173) = ( 0.0119048 0.0119048 0.0119048), wk = 0.0026667 k( 174) = ( 0.0178571 0.0178571 0.0178571), wk = 0.0026667 k( 175) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0026667 k( 176) = ( 0.0297619 0.0297619 0.0297619), wk = 0.0026667 k( 177) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0026667 k( 178) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0026667 k( 179) = ( 0.0476191 0.0476191 0.0476191), wk = 0.0026667 k( 180) = ( 0.0535714 0.0535714 0.0535714), wk = 0.0026667 k( 181) = ( 0.0595238 0.0595238 0.0595238), wk = 0.0026667 k( 182) = ( 0.0654762 0.0654762 0.0654762), wk = 0.0026667 k( 183) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0026667 k( 184) = ( 0.0773810 0.0773810 0.0773810), wk = 0.0026667 k( 185) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0026667 k( 186) = ( 0.0892857 0.0892857 0.0892857), wk = 0.0026667 k( 187) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0026667 k( 188) = ( 0.1011905 0.1011905 0.1011905), wk = 0.0026667 k( 189) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0026667 k( 190) = ( 0.1130952 0.1130952 0.1130952), wk = 0.0026667 k( 191) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0026667 k( 192) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0026667 k( 193) = ( 0.1309524 0.1309524 0.1309524), wk = 0.0026667 k( 194) = ( 0.1369048 0.1369048 0.1369048), wk = 0.0026667 k( 195) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0026667 k( 196) = ( 0.1488095 0.1488095 0.1488095), wk = 0.0026667 k( 197) = ( 0.1547619 0.1547619 0.1547619), wk = 0.0026667 k( 198) = ( 0.1607143 0.1607143 0.1607143), wk = 0.0026667 k( 199) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0026667 k( 200) = ( 0.1726190 0.1726190 0.1726190), wk = 0.0026667 k( 201) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0026667 k( 202) = ( 0.1845238 0.1845238 0.1845238), wk = 0.0026667 k( 203) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0026667 k( 204) = ( 0.1964286 0.1964286 0.1964286), wk = 0.0026667 k( 205) = ( 0.2023810 0.2023810 0.2023810), wk = 0.0026667 k( 206) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0026667 k( 207) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0026667 k( 208) = ( 0.2202381 0.2202381 0.2202381), wk = 0.0026667 k( 209) = ( 0.2261905 0.2261905 0.2261905), wk = 0.0026667 k( 210) = ( 0.2321429 0.2321429 0.2321429), wk = 0.0026667 k( 211) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0026667 k( 212) = ( 0.2440476 0.2440476 0.2440476), wk = 0.0026667 k( 213) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026667 k( 214) = ( 0.2559524 0.2559524 0.2559524), wk = 0.0026667 k( 215) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0026667 k( 216) = ( 0.2678571 0.2678571 0.2678571), wk = 0.0026667 k( 217) = ( 0.2738095 0.2738095 0.2738095), wk = 0.0026667 k( 218) = ( 0.2797619 0.2797619 0.2797619), wk = 0.0026667 k( 219) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0026667 k( 220) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0026667 k( 221) = ( 0.2976190 0.2976190 0.2976190), wk = 0.0026667 k( 222) = ( 0.3035714 0.3035714 0.3035714), wk = 0.0026667 k( 223) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0026667 k( 224) = ( 0.3154762 0.3154762 0.3154762), wk = 0.0026667 k( 225) = ( 0.3214286 0.3214286 0.3214286), wk = 0.0026667 k( 226) = ( 0.3273810 0.3273810 0.3273810), wk = 0.0026667 k( 227) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0026667 k( 228) = ( 0.3392857 0.3392857 0.3392857), wk = 0.0026667 k( 229) = ( 0.3452381 0.3452381 0.3452381), wk = 0.0026667 k( 230) = ( 0.3511905 0.3511905 0.3511905), wk = 0.0026667 k( 231) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0026667 k( 232) = ( 0.3630952 0.3630952 0.3630952), wk = 0.0026667 k( 233) = ( 0.3690476 0.3690476 0.3690476), wk = 0.0026667 k( 234) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0026667 k( 235) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0026667 k( 236) = ( 0.3869048 0.3869048 0.3869048), wk = 0.0026667 k( 237) = ( 0.3928571 0.3928571 0.3928571), wk = 0.0026667 k( 238) = ( 0.3988095 0.3988095 0.3988095), wk = 0.0026667 k( 239) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0026667 k( 240) = ( 0.4107143 0.4107143 0.4107143), wk = 0.0026667 k( 241) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0026667 k( 242) = ( 0.4226190 0.4226190 0.4226190), wk = 0.0026667 k( 243) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0026667 k( 244) = ( 0.4345238 0.4345238 0.4345238), wk = 0.0026667 k( 245) = ( 0.4404762 0.4404762 0.4404762), wk = 0.0026667 k( 246) = ( 0.4464286 0.4464286 0.4464286), wk = 0.0026667 k( 247) = ( 0.4523810 0.4523810 0.4523810), wk = 0.0026667 k( 248) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0026667 k( 249) = ( 0.4642857 0.4642857 0.4642857), wk = 0.0026667 k( 250) = ( 0.4702381 0.4702381 0.4702381), wk = 0.0026667 k( 251) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0026667 k( 252) = ( 0.4821429 0.4821429 0.4821429), wk = 0.0026667 k( 253) = ( 0.4880952 0.4880952 0.4880952), wk = 0.0026667 k( 254) = ( 0.4940476 0.4940476 0.4940476), wk = 0.0026667 k( 255) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026667 k( 256) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026667 k( 257) = ( 0.4927536 0.5000000 0.4927536), wk = 0.0026667 k( 258) = ( 0.4855073 0.5000000 0.4855073), wk = 0.0026667 k( 259) = ( 0.4782609 0.5000000 0.4782609), wk = 0.0026667 k( 260) = ( 0.4710145 0.5000000 0.4710145), wk = 0.0026667 k( 261) = ( 0.4637681 0.5000000 0.4637681), wk = 0.0026667 k( 262) = ( 0.4565217 0.5000000 0.4565217), wk = 0.0026667 k( 263) = ( 0.4492754 0.5000000 0.4492754), wk = 0.0026667 k( 264) = ( 0.4420290 0.5000000 0.4420290), wk = 0.0026667 k( 265) = ( 0.4347826 0.5000000 0.4347826), wk = 0.0026667 k( 266) = ( 0.4275362 0.5000000 0.4275362), wk = 0.0026667 k( 267) = ( 0.4202899 0.5000000 0.4202899), wk = 0.0026667 k( 268) = ( 0.4130435 0.5000000 0.4130435), wk = 0.0026667 k( 269) = ( 0.4057971 0.5000000 0.4057971), wk = 0.0026667 k( 270) = ( 0.3985507 0.5000000 0.3985507), wk = 0.0026667 k( 271) = ( 0.3913044 0.5000000 0.3913044), wk = 0.0026667 k( 272) = ( 0.3840580 0.5000000 0.3840580), wk = 0.0026667 k( 273) = ( 0.3768116 0.5000000 0.3768116), wk = 0.0026667 k( 274) = ( 0.3695652 0.5000000 0.3695652), wk = 0.0026667 k( 275) = ( 0.3623188 0.5000000 0.3623188), wk = 0.0026667 k( 276) = ( 0.3550725 0.5000000 0.3550725), wk = 0.0026667 k( 277) = ( 0.3478261 0.5000000 0.3478261), wk = 0.0026667 k( 278) = ( 0.3405797 0.5000000 0.3405797), wk = 0.0026667 k( 279) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0026667 k( 280) = ( 0.3260870 0.5000000 0.3260870), wk = 0.0026667 k( 281) = ( 0.3188406 0.5000000 0.3188406), wk = 0.0026667 k( 282) = ( 0.3115942 0.5000000 0.3115942), wk = 0.0026667 k( 283) = ( 0.3043478 0.5000000 0.3043478), wk = 0.0026667 k( 284) = ( 0.2971014 0.5000000 0.2971014), wk = 0.0026667 k( 285) = ( 0.2898551 0.5000000 0.2898551), wk = 0.0026667 k( 286) = ( 0.2826087 0.5000000 0.2826087), wk = 0.0026667 k( 287) = ( 0.2753623 0.5000000 0.2753623), wk = 0.0026667 k( 288) = ( 0.2681159 0.5000000 0.2681159), wk = 0.0026667 k( 289) = ( 0.2608696 0.5000000 0.2608696), wk = 0.0026667 k( 290) = ( 0.2536232 0.5000000 0.2536232), wk = 0.0026667 k( 291) = ( 0.2463768 0.5000000 0.2463768), wk = 0.0026667 k( 292) = ( 0.2391304 0.5000000 0.2391304), wk = 0.0026667 k( 293) = ( 0.2318841 0.5000000 0.2318841), wk = 0.0026667 k( 294) = ( 0.2246377 0.5000000 0.2246377), wk = 0.0026667 k( 295) = ( 0.2173913 0.5000000 0.2173913), wk = 0.0026667 k( 296) = ( 0.2101449 0.5000000 0.2101449), wk = 0.0026667 k( 297) = ( 0.2028986 0.5000000 0.2028986), wk = 0.0026667 k( 298) = ( 0.1956522 0.5000000 0.1956522), wk = 0.0026667 k( 299) = ( 0.1884058 0.5000000 0.1884058), wk = 0.0026667 k( 300) = ( 0.1811594 0.5000000 0.1811594), wk = 0.0026667 k( 301) = ( 0.1739130 0.5000000 0.1739130), wk = 0.0026667 k( 302) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0026667 k( 303) = ( 0.1594203 0.5000000 0.1594203), wk = 0.0026667 k( 304) = ( 0.1521739 0.5000000 0.1521739), wk = 0.0026667 k( 305) = ( 0.1449275 0.5000000 0.1449275), wk = 0.0026667 k( 306) = ( 0.1376812 0.5000000 0.1376812), wk = 0.0026667 k( 307) = ( 0.1304348 0.5000000 0.1304348), wk = 0.0026667 k( 308) = ( 0.1231884 0.5000000 0.1231884), wk = 0.0026667 k( 309) = ( 0.1159420 0.5000000 0.1159420), wk = 0.0026667 k( 310) = ( 0.1086957 0.5000000 0.1086957), wk = 0.0026667 k( 311) = ( 0.1014493 0.5000000 0.1014493), wk = 0.0026667 k( 312) = ( 0.0942029 0.5000000 0.0942029), wk = 0.0026667 k( 313) = ( 0.0869565 0.5000000 0.0869565), wk = 0.0026667 k( 314) = ( 0.0797101 0.5000000 0.0797101), wk = 0.0026667 k( 315) = ( 0.0724638 0.5000000 0.0724638), wk = 0.0026667 k( 316) = ( 0.0652174 0.5000000 0.0652174), wk = 0.0026667 k( 317) = ( 0.0579710 0.5000000 0.0579710), wk = 0.0026667 k( 318) = ( 0.0507246 0.5000000 0.0507246), wk = 0.0026667 k( 319) = ( 0.0434783 0.5000000 0.0434783), wk = 0.0026667 k( 320) = ( 0.0362319 0.5000000 0.0362319), wk = 0.0026667 k( 321) = ( 0.0289855 0.5000000 0.0289855), wk = 0.0026667 k( 322) = ( 0.0217391 0.5000000 0.0217391), wk = 0.0026667 k( 323) = ( 0.0144928 0.5000000 0.0144928), wk = 0.0026667 k( 324) = ( 0.0072464 0.5000000 0.0072464), wk = 0.0026667 k( 325) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026667 k( 326) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026667 k( 327) = ( 0.5000000 0.5000000 0.0102041), wk = 0.0026667 k( 328) = ( 0.5000000 0.5000000 0.0204082), wk = 0.0026667 k( 329) = ( 0.5000000 0.5000000 0.0306122), wk = 0.0026667 k( 330) = ( 0.5000000 0.5000000 0.0408163), wk = 0.0026667 k( 331) = ( 0.5000000 0.5000000 0.0510204), wk = 0.0026667 k( 332) = ( 0.5000000 0.5000000 0.0612245), wk = 0.0026667 k( 333) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0026667 k( 334) = ( 0.5000000 0.5000000 0.0816327), wk = 0.0026667 k( 335) = ( 0.5000000 0.5000000 0.0918367), wk = 0.0026667 k( 336) = ( 0.5000000 0.5000000 0.1020408), wk = 0.0026667 k( 337) = ( 0.5000000 0.5000000 0.1122449), wk = 0.0026667 k( 338) = ( 0.5000000 0.5000000 0.1224490), wk = 0.0026667 k( 339) = ( 0.5000000 0.5000000 0.1326531), wk = 0.0026667 k( 340) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0026667 k( 341) = ( 0.5000000 0.5000000 0.1530612), wk = 0.0026667 k( 342) = ( 0.5000000 0.5000000 0.1632653), wk = 0.0026667 k( 343) = ( 0.5000000 0.5000000 0.1734694), wk = 0.0026667 k( 344) = ( 0.5000000 0.5000000 0.1836735), wk = 0.0026667 k( 345) = ( 0.5000000 0.5000000 0.1938776), wk = 0.0026667 k( 346) = ( 0.5000000 0.5000000 0.2040816), wk = 0.0026667 k( 347) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0026667 k( 348) = ( 0.5000000 0.5000000 0.2244898), wk = 0.0026667 k( 349) = ( 0.5000000 0.5000000 0.2346939), wk = 0.0026667 k( 350) = ( 0.5000000 0.5000000 0.2448980), wk = 0.0026667 k( 351) = ( 0.5000000 0.5000000 0.2551020), wk = 0.0026667 k( 352) = ( 0.5000000 0.5000000 0.2653061), wk = 0.0026667 k( 353) = ( 0.5000000 0.5000000 0.2755102), wk = 0.0026667 k( 354) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0026667 k( 355) = ( 0.5000000 0.5000000 0.2959184), wk = 0.0026667 k( 356) = ( 0.5000000 0.5000000 0.3061224), wk = 0.0026667 k( 357) = ( 0.5000000 0.5000000 0.3163265), wk = 0.0026667 k( 358) = ( 0.5000000 0.5000000 0.3265306), wk = 0.0026667 k( 359) = ( 0.5000000 0.5000000 0.3367347), wk = 0.0026667 k( 360) = ( 0.5000000 0.5000000 0.3469388), wk = 0.0026667 k( 361) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0026667 k( 362) = ( 0.5000000 0.5000000 0.3673469), wk = 0.0026667 k( 363) = ( 0.5000000 0.5000000 0.3775510), wk = 0.0026667 k( 364) = ( 0.5000000 0.5000000 0.3877551), wk = 0.0026667 k( 365) = ( 0.5000000 0.5000000 0.3979592), wk = 0.0026667 k( 366) = ( 0.5000000 0.5000000 0.4081633), wk = 0.0026667 k( 367) = ( 0.5000000 0.5000000 0.4183674), wk = 0.0026667 k( 368) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0026667 k( 369) = ( 0.5000000 0.5000000 0.4387755), wk = 0.0026667 k( 370) = ( 0.5000000 0.5000000 0.4489796), wk = 0.0026667 k( 371) = ( 0.5000000 0.5000000 0.4591837), wk = 0.0026667 k( 372) = ( 0.5000000 0.5000000 0.4693878), wk = 0.0026667 k( 373) = ( 0.5000000 0.5000000 0.4795918), wk = 0.0026667 k( 374) = ( 0.5000000 0.5000000 0.4897959), wk = 0.0026667 k( 375) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026667 Dense grid: 31559 G-vectors FFT dimensions: ( 40, 40, 40) Smooth grid: 11459 G-vectors FFT dimensions: ( 27, 27, 27) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.04 Mb ( 98, 30) NL pseudopotentials 0.05 Mb ( 49, 68) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 880) G-vector shells 0.00 Mb ( 231) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.18 Mb ( 98, 120) Each subspace H/S matrix 0.01 Mb ( 30, 30) Each matrix 0.06 Mb ( 68, 2, 30) Check: negative/imaginary core charge= -0.000007 0.000000 The potential is recalculated from file : ./ScCu.save/charge-density.dat Starting wfc are 38 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.1 secs Computing kpt #: 2 total cpu time spent up to now is 2.2 secs Computing kpt #: 3 total cpu time spent up to now is 2.2 secs Computing kpt #: 4 total cpu time spent up to now is 2.3 secs Computing kpt #: 5 total cpu time spent up to now is 2.4 secs Computing kpt #: 6 total cpu time spent up to now is 2.5 secs Computing kpt #: 7 total cpu time spent up to now is 2.6 secs Computing kpt #: 8 total cpu time spent up to now is 2.7 secs Computing kpt #: 9 total cpu time spent up to now is 2.8 secs Computing kpt #: 10 total cpu time spent up to now is 2.9 secs Computing kpt #: 11 total cpu time spent up to now is 3.0 secs Computing kpt #: 12 total cpu time spent up to now is 3.0 secs Computing kpt #: 13 total cpu time spent up to now is 3.1 secs Computing kpt #: 14 total cpu time spent up to now is 3.2 secs Computing kpt #: 15 total cpu time spent up to now is 3.3 secs Computing kpt #: 16 total cpu time spent up to now is 3.4 secs Computing kpt #: 17 total cpu time spent up to now is 3.5 secs Computing kpt #: 18 total cpu time spent up to now is 3.6 secs Computing kpt #: 19 total cpu time spent up to now is 3.7 secs Computing kpt #: 20 total cpu time spent up to now is 3.8 secs Computing kpt #: 21 total cpu time spent up to now is 3.9 secs Computing kpt #: 22 total cpu time spent up to now is 4.0 secs Computing kpt #: 23 total cpu time spent up to now is 4.2 secs Computing kpt #: 24 total cpu time spent up to now is 4.3 secs Computing kpt #: 25 total cpu time spent up to now is 4.4 secs Computing kpt #: 26 total cpu time spent up to now is 4.5 secs Computing kpt #: 27 total cpu time spent up to now is 4.6 secs Computing kpt #: 28 total cpu time spent up to now is 4.7 secs Computing kpt #: 29 total cpu time spent up to now is 4.8 secs Computing kpt #: 30 total cpu time spent up to now is 4.9 secs Computing kpt #: 31 total cpu time spent up to now is 5.0 secs Computing kpt #: 32 total cpu time spent up to now is 5.1 secs Computing kpt #: 33 total cpu time spent up to now is 5.3 secs Computing kpt #: 34 total cpu time spent up to now is 5.4 secs Computing kpt #: 35 total cpu time spent up to now is 5.5 secs Computing kpt #: 36 total cpu time spent up to now is 5.6 secs Computing kpt #: 37 total cpu time spent up to now is 5.7 secs Computing kpt #: 38 total cpu time spent up to now is 5.8 secs Computing kpt #: 39 total cpu time spent up to now is 5.9 secs Computing kpt #: 40 total cpu time spent up to now is 6.1 secs Computing kpt #: 41 total cpu time spent up to now is 6.3 secs Computing kpt #: 42 total cpu time spent up to now is 6.4 secs Computing kpt #: 43 total cpu time spent up to now is 6.5 secs Computing kpt #: 44 total cpu time spent up to now is 6.6 secs Computing kpt #: 45 total cpu time spent up to now is 6.7 secs Computing kpt #: 46 total cpu time spent up to now is 6.8 secs Computing kpt #: 47 total cpu time spent up to now is 6.9 secs Computing kpt #: 48 total cpu time spent up to now is 7.0 secs Computing kpt #: 49 total cpu time spent up to now is 7.0 secs Computing kpt #: 50 total cpu time spent up to now is 7.1 secs Computing kpt #: 51 total cpu time spent up to now is 7.2 secs Computing kpt #: 52 total cpu time spent up to now is 7.3 secs Computing kpt #: 53 total cpu time spent up to now is 7.4 secs Computing kpt #: 54 total cpu time spent up to now is 7.5 secs Computing kpt #: 55 total cpu time spent up to now is 7.6 secs Computing kpt #: 56 total cpu time spent up to now is 7.7 secs Computing kpt #: 57 total cpu time spent up to now is 7.8 secs Computing kpt #: 58 total cpu time spent up to now is 7.9 secs Computing kpt #: 59 total cpu time spent up to now is 8.0 secs Computing kpt #: 60 total cpu time spent up to now is 8.0 secs Computing kpt #: 61 total cpu time spent up to now is 8.1 secs Computing kpt #: 62 total cpu time spent up to now is 8.2 secs Computing kpt #: 63 total cpu time spent up to now is 8.3 secs Computing kpt #: 64 total cpu time spent up to now is 8.4 secs Computing kpt #: 65 total cpu time spent up to now is 8.5 secs Computing kpt #: 66 total cpu time spent up to now is 8.6 secs Computing kpt #: 67 total cpu time spent up to now is 8.7 secs Computing kpt #: 68 total cpu time spent up to now is 8.8 secs Computing kpt #: 69 total cpu time spent up to now is 8.9 secs Computing kpt #: 70 total cpu time spent up to now is 9.0 secs Computing kpt #: 71 total cpu time spent up to now is 9.1 secs Computing kpt #: 72 total cpu time spent up to now is 9.2 secs Computing kpt #: 73 total cpu time spent up to now is 9.3 secs Computing kpt #: 74 total cpu time spent up to now is 9.4 secs Computing kpt #: 75 total cpu time spent up to now is 9.5 secs Computing kpt #: 76 total cpu time spent up to now is 9.6 secs Computing kpt #: 77 total cpu time spent up to now is 9.7 secs Computing kpt #: 78 total cpu time spent up to now is 9.9 secs Computing kpt #: 79 total cpu time spent up to now is 10.0 secs Computing kpt #: 80 total cpu time spent up to now is 10.1 secs Computing kpt #: 81 total cpu time spent up to now is 10.2 secs Computing kpt #: 82 total cpu time spent up to now is 10.3 secs Computing kpt #: 83 total cpu time spent up to now is 10.4 secs Computing kpt #: 84 total cpu time spent up to now is 10.6 secs Computing kpt #: 85 total cpu time spent up to now is 10.7 secs Computing kpt #: 86 total cpu time spent up to now is 10.8 secs Computing kpt #: 87 total cpu time spent up to now is 10.9 secs Computing kpt #: 88 total cpu time spent up to now is 11.0 secs Computing kpt #: 89 total cpu time spent up to now is 11.2 secs Computing kpt #: 90 total cpu time spent up to now is 11.3 secs Computing kpt #: 91 total cpu time spent up to now is 11.4 secs Computing kpt #: 92 total cpu time spent up to now is 11.5 secs Computing kpt #: 93 total cpu time spent up to now is 11.6 secs Computing kpt #: 94 total cpu time spent up to now is 11.7 secs Computing kpt #: 95 total cpu time spent up to now is 11.9 secs Computing kpt #: 96 total cpu time spent up to now is 12.0 secs Computing kpt #: 97 total cpu time spent up to now is 12.1 secs Computing kpt #: 98 total cpu time spent up to now is 12.2 secs Computing kpt #: 99 total cpu time spent up to now is 12.3 secs Computing kpt #: 100 total cpu time spent up to now is 12.4 secs Computing kpt #: 101 total cpu time spent up to now is 12.5 secs Computing kpt #: 102 total cpu time spent up to now is 12.6 secs Computing kpt #: 103 total cpu time spent up to now is 12.7 secs Computing kpt #: 104 total cpu time spent up to now is 12.8 secs Computing kpt #: 105 total cpu time spent up to now is 12.9 secs Computing kpt #: 106 total cpu time spent up to now is 13.1 secs Computing kpt #: 107 total cpu time spent up to now is 13.2 secs Computing kpt #: 108 total cpu time spent up to now is 13.3 secs Computing kpt #: 109 total cpu time spent up to now is 13.4 secs Computing kpt #: 110 total cpu time spent up to now is 13.5 secs Computing kpt #: 111 total cpu time spent up to now is 13.6 secs Computing kpt #: 112 total cpu time spent up to now is 13.8 secs Computing kpt #: 113 total cpu time spent up to now is 13.9 secs Computing kpt #: 114 total cpu time spent up to now is 14.0 secs Computing kpt #: 115 total cpu time spent up to now is 14.1 secs Computing kpt #: 116 total cpu time spent up to now is 14.2 secs Computing kpt #: 117 total cpu time spent up to now is 14.4 secs Computing kpt #: 118 total cpu time spent up to now is 14.5 secs Computing kpt #: 119 total cpu time spent up to now is 14.6 secs Computing kpt #: 120 total cpu time spent up to now is 14.7 secs Computing kpt #: 121 total cpu time spent up to now is 14.8 secs Computing kpt #: 122 total cpu time spent up to now is 14.9 secs Computing kpt #: 123 total cpu time spent up to now is 15.1 secs Computing kpt #: 124 total cpu time spent up to now is 15.2 secs Computing kpt #: 125 total cpu time spent up to now is 15.3 secs Computing kpt #: 126 total cpu time spent up to now is 15.4 secs Computing kpt #: 127 total cpu time spent up to now is 15.5 secs Computing kpt #: 128 total cpu time spent up to now is 15.6 secs Computing kpt #: 129 total cpu time spent up to now is 15.7 secs Computing kpt #: 130 total cpu time spent up to now is 15.8 secs Computing kpt #: 131 total cpu time spent up to now is 16.0 secs Computing kpt #: 132 total cpu time spent up to now is 16.1 secs Computing kpt #: 133 total cpu time spent up to now is 16.2 secs Computing kpt #: 134 total cpu time spent up to now is 16.3 secs Computing kpt #: 135 total cpu time spent up to now is 16.4 secs Computing kpt #: 136 total cpu time spent up to now is 16.5 secs Computing kpt #: 137 total cpu time spent up to now is 16.6 secs Computing kpt #: 138 total cpu time spent up to now is 16.7 secs Computing kpt #: 139 total cpu time spent up to now is 16.8 secs Computing kpt #: 140 total cpu time spent up to now is 16.9 secs Computing kpt #: 141 total cpu time spent up to now is 17.0 secs Computing kpt #: 142 total cpu time spent up to now is 17.1 secs Computing kpt #: 143 total cpu time spent up to now is 17.2 secs Computing kpt #: 144 total cpu time spent up to now is 17.3 secs Computing kpt #: 145 total cpu time spent up to now is 17.4 secs Computing kpt #: 146 total cpu time spent up to now is 17.5 secs Computing kpt #: 147 total cpu time spent up to now is 17.7 secs Computing kpt #: 148 total cpu time spent up to now is 17.8 secs Computing kpt #: 149 total cpu time spent up to now is 17.9 secs Computing kpt #: 150 total cpu time spent up to now is 18.0 secs Computing kpt #: 151 total cpu time spent up to now is 18.1 secs Computing kpt #: 152 total cpu time spent up to now is 18.2 secs Computing kpt #: 153 total cpu time spent up to now is 18.3 secs Computing kpt #: 154 total cpu time spent up to now is 18.4 secs Computing kpt #: 155 total cpu time spent up to now is 18.5 secs Computing kpt #: 156 total cpu time spent up to now is 18.6 secs Computing kpt #: 157 total cpu time spent up to now is 18.7 secs Computing kpt #: 158 total cpu time spent up to now is 18.8 secs Computing kpt #: 159 total cpu time spent up to now is 18.9 secs Computing kpt #: 160 total cpu time spent up to now is 19.0 secs Computing kpt #: 161 total cpu time spent up to now is 19.1 secs Computing kpt #: 162 total cpu time spent up to now is 19.2 secs Computing kpt #: 163 total cpu time spent up to now is 19.2 secs Computing kpt #: 164 total cpu time spent up to now is 19.3 secs Computing kpt #: 165 total cpu time spent up to now is 19.4 secs Computing kpt #: 166 total cpu time spent up to now is 19.5 secs Computing kpt #: 167 total cpu time spent up to now is 19.6 secs Computing kpt #: 168 total cpu time spent up to now is 19.7 secs Computing kpt #: 169 total cpu time spent up to now is 19.8 secs Computing kpt #: 170 total cpu time spent up to now is 19.9 secs Computing kpt #: 171 total cpu time spent up to now is 19.9 secs Computing kpt #: 172 total cpu time spent up to now is 20.0 secs Computing kpt #: 173 total cpu time spent up to now is 20.1 secs Computing kpt #: 174 total cpu time spent up to now is 20.2 secs Computing kpt #: 175 total cpu time spent up to now is 20.3 secs Computing kpt #: 176 total cpu time spent up to now is 20.4 secs Computing kpt #: 177 total cpu time spent up to now is 20.5 secs Computing kpt #: 178 total cpu time spent up to now is 20.6 secs Computing kpt #: 179 total cpu time spent up to now is 20.7 secs Computing kpt #: 180 total cpu time spent up to now is 20.7 secs Computing kpt #: 181 total cpu time spent up to now is 20.8 secs Computing kpt #: 182 total cpu time spent up to now is 20.9 secs Computing kpt #: 183 total cpu time spent up to now is 21.0 secs Computing kpt #: 184 total cpu time spent up to now is 21.1 secs Computing kpt #: 185 total cpu time spent up to now is 21.2 secs Computing kpt #: 186 total cpu time spent up to now is 21.3 secs Computing kpt #: 187 total cpu time spent up to now is 21.4 secs Computing kpt #: 188 total cpu time spent up to now is 21.5 secs Computing kpt #: 189 total cpu time spent up to now is 21.6 secs Computing kpt #: 190 total cpu time spent up to now is 21.7 secs Computing kpt #: 191 total cpu time spent up to now is 21.8 secs Computing kpt #: 192 total cpu time spent up to now is 21.9 secs Computing kpt #: 193 total cpu time spent up to now is 22.0 secs Computing kpt #: 194 total cpu time spent up to now is 22.1 secs Computing kpt #: 195 total cpu time spent up to now is 22.2 secs Computing kpt #: 196 total cpu time spent up to now is 22.3 secs Computing kpt #: 197 total cpu time spent up to now is 22.4 secs Computing kpt #: 198 total cpu time spent up to now is 22.5 secs Computing kpt #: 199 total cpu time spent up to now is 22.7 secs Computing kpt #: 200 total cpu time spent up to now is 22.8 secs Computing kpt #: 201 total cpu time spent up to now is 22.9 secs Computing kpt #: 202 total cpu time spent up to now is 23.0 secs Computing kpt #: 203 total cpu time spent up to now is 23.1 secs Computing kpt #: 204 total cpu time spent up to now is 23.2 secs Computing kpt #: 205 total cpu time spent up to now is 23.3 secs Computing kpt #: 206 total cpu time spent up to now is 23.4 secs Computing kpt #: 207 total cpu time spent up to now is 23.5 secs Computing kpt #: 208 total cpu time spent up to now is 23.6 secs Computing kpt #: 209 total cpu time spent up to now is 23.7 secs Computing kpt #: 210 total cpu time spent up to now is 23.8 secs Computing kpt #: 211 total cpu time spent up to now is 23.9 secs Computing kpt #: 212 total cpu time spent up to now is 24.0 secs Computing kpt #: 213 total cpu time spent up to now is 24.1 secs Computing kpt #: 214 total cpu time spent up to now is 24.2 secs Computing kpt #: 215 total cpu time spent up to now is 24.4 secs Computing kpt #: 216 total cpu time spent up to now is 24.5 secs Computing kpt #: 217 total cpu time spent up to now is 24.6 secs Computing kpt #: 218 total cpu time spent up to now is 24.7 secs Computing kpt #: 219 total cpu time spent up to now is 24.8 secs Computing kpt #: 220 total cpu time spent up to now is 24.9 secs Computing kpt #: 221 total cpu time spent up to now is 25.0 secs Computing kpt #: 222 total cpu time spent up to now is 25.1 secs Computing kpt #: 223 total cpu time spent up to now is 25.2 secs Computing kpt #: 224 total cpu time spent up to now is 25.3 secs Computing kpt #: 225 total cpu time spent up to now is 25.4 secs Computing kpt #: 226 total cpu time spent up to now is 25.6 secs Computing kpt #: 227 total cpu time spent up to now is 25.7 secs Computing kpt #: 228 total cpu time spent up to now is 25.8 secs Computing kpt #: 229 total cpu time spent up to now is 25.9 secs Computing kpt #: 230 total cpu time spent up to now is 26.0 secs Computing kpt #: 231 total cpu time spent up to now is 26.2 secs Computing kpt #: 232 total cpu time spent up to now is 26.3 secs Computing kpt #: 233 total cpu time spent up to now is 26.4 secs Computing kpt #: 234 total cpu time spent up to now is 26.7 secs Computing kpt #: 235 total cpu time spent up to now is 26.9 secs Computing kpt #: 236 total cpu time spent up to now is 27.0 secs Computing kpt #: 237 total cpu time spent up to now is 27.1 secs Computing kpt #: 238 total cpu time spent up to now is 27.3 secs Computing kpt #: 239 total cpu time spent up to now is 27.4 secs Computing kpt #: 240 total cpu time spent up to now is 27.5 secs Computing kpt #: 241 total cpu time spent up to now is 27.7 secs Computing kpt #: 242 total cpu time spent up to now is 27.8 secs Computing kpt #: 243 total cpu time spent up to now is 27.9 secs Computing kpt #: 244 total cpu time spent up to now is 28.0 secs Computing kpt #: 245 total cpu time spent up to now is 28.1 secs Computing kpt #: 246 total cpu time spent up to now is 28.3 secs Computing kpt #: 247 total cpu time spent up to now is 28.4 secs Computing kpt #: 248 total cpu time spent up to now is 28.5 secs Computing kpt #: 249 total cpu time spent up to now is 28.6 secs Computing kpt #: 250 total cpu time spent up to now is 28.7 secs Computing kpt #: 251 total cpu time spent up to now is 28.8 secs Computing kpt #: 252 total cpu time spent up to now is 28.9 secs Computing kpt #: 253 total cpu time spent up to now is 29.0 secs Computing kpt #: 254 total cpu time spent up to now is 29.0 secs Computing kpt #: 255 total cpu time spent up to now is 29.1 secs Computing kpt #: 256 total cpu time spent up to now is 29.2 secs Computing kpt #: 257 total cpu time spent up to now is 29.3 secs Computing kpt #: 258 total cpu time spent up to now is 29.4 secs Computing kpt #: 259 total cpu time spent up to now is 29.5 secs Computing kpt #: 260 total cpu time spent up to now is 29.6 secs Computing kpt #: 261 total cpu time spent up to now is 29.7 secs Computing kpt #: 262 total cpu time spent up to now is 29.8 secs Computing kpt #: 263 total cpu time spent up to now is 29.9 secs Computing kpt #: 264 total cpu time spent up to now is 30.0 secs Computing kpt #: 265 total cpu time spent up to now is 30.1 secs Computing kpt #: 266 total cpu time spent up to now is 30.3 secs Computing kpt #: 267 total cpu time spent up to now is 30.4 secs Computing kpt #: 268 total cpu time spent up to now is 30.5 secs Computing kpt #: 269 total cpu time spent up to now is 30.6 secs Computing kpt #: 270 total cpu time spent up to now is 30.7 secs Computing kpt #: 271 total cpu time spent up to now is 30.9 secs Computing kpt #: 272 total cpu time spent up to now is 31.0 secs Computing kpt #: 273 total cpu time spent up to now is 31.1 secs Computing kpt #: 274 total cpu time spent up to now is 31.2 secs Computing kpt #: 275 total cpu time spent up to now is 31.4 secs Computing kpt #: 276 total cpu time spent up to now is 31.5 secs Computing kpt #: 277 total cpu time spent up to now is 31.6 secs Computing kpt #: 278 total cpu time spent up to now is 31.8 secs Computing kpt #: 279 total cpu time spent up to now is 31.9 secs Computing kpt #: 280 total cpu time spent up to now is 32.0 secs Computing kpt #: 281 total cpu time spent up to now is 32.2 secs Computing kpt #: 282 total cpu time spent up to now is 32.3 secs Computing kpt #: 283 total cpu time spent up to now is 32.4 secs Computing kpt #: 284 total cpu time spent up to now is 32.6 secs Computing kpt #: 285 total cpu time spent up to now is 32.7 secs Computing kpt #: 286 total cpu time spent up to now is 32.8 secs Computing kpt #: 287 total cpu time spent up to now is 33.0 secs Computing kpt #: 288 total cpu time spent up to now is 33.1 secs Computing kpt #: 289 total cpu time spent up to now is 33.2 secs Computing kpt #: 290 total cpu time spent up to now is 33.4 secs Computing kpt #: 291 total cpu time spent up to now is 33.5 secs Computing kpt #: 292 total cpu time spent up to now is 33.6 secs Computing kpt #: 293 total cpu time spent up to now is 33.7 secs Computing kpt #: 294 total cpu time spent up to now is 33.8 secs Computing kpt #: 295 total cpu time spent up to now is 33.9 secs Computing kpt #: 296 total cpu time spent up to now is 34.1 secs Computing kpt #: 297 total cpu time spent up to now is 34.2 secs Computing kpt #: 298 total cpu time spent up to now is 34.3 secs Computing kpt #: 299 total cpu time spent up to now is 34.4 secs Computing kpt #: 300 total cpu time spent up to now is 34.5 secs Computing kpt #: 301 total cpu time spent up to now is 34.6 secs Computing kpt #: 302 total cpu time spent up to now is 34.7 secs Computing kpt #: 303 total cpu time spent up to now is 34.8 secs Computing kpt #: 304 total cpu time spent up to now is 34.9 secs Computing kpt #: 305 total cpu time spent up to now is 35.0 secs Computing kpt #: 306 total cpu time spent up to now is 35.1 secs Computing kpt #: 307 total cpu time spent up to now is 35.2 secs Computing kpt #: 308 total cpu time spent up to now is 35.3 secs Computing kpt #: 309 total cpu time spent up to now is 35.4 secs Computing kpt #: 310 total cpu time spent up to now is 35.5 secs Computing kpt #: 311 total cpu time spent up to now is 35.6 secs Computing kpt #: 312 total cpu time spent up to now is 35.7 secs Computing kpt #: 313 total cpu time spent up to now is 35.8 secs Computing kpt #: 314 total cpu time spent up to now is 35.9 secs Computing kpt #: 315 total cpu time spent up to now is 36.0 secs Computing kpt #: 316 total cpu time spent up to now is 36.1 secs Computing kpt #: 317 total cpu time spent up to now is 36.2 secs Computing kpt #: 318 total cpu time spent up to now is 36.2 secs Computing kpt #: 319 total cpu time spent up to now is 36.3 secs Computing kpt #: 320 total cpu time spent up to now is 36.4 secs Computing kpt #: 321 total cpu time spent up to now is 36.5 secs Computing kpt #: 322 total cpu time spent up to now is 36.6 secs Computing kpt #: 323 total cpu time spent up to now is 36.7 secs Computing kpt #: 324 total cpu time spent up to now is 36.8 secs Computing kpt #: 325 total cpu time spent up to now is 36.9 secs Computing kpt #: 326 total cpu time spent up to now is 37.0 secs Computing kpt #: 327 total cpu time spent up to now is 37.1 secs Computing kpt #: 328 total cpu time spent up to now is 37.2 secs Computing kpt #: 329 total cpu time spent up to now is 37.3 secs Computing kpt #: 330 total cpu time spent up to now is 37.3 secs Computing kpt #: 331 total cpu time spent up to now is 37.4 secs Computing kpt #: 332 total cpu time spent up to now is 37.5 secs Computing kpt #: 333 total cpu time spent up to now is 37.7 secs Computing kpt #: 334 total cpu time spent up to now is 37.8 secs Computing kpt #: 335 total cpu time spent up to now is 37.9 secs Computing kpt #: 336 total cpu time spent up to now is 38.0 secs Computing kpt #: 337 total cpu time spent up to now is 38.2 secs Computing kpt #: 338 total cpu time spent up to now is 38.3 secs Computing kpt #: 339 total cpu time spent up to now is 38.4 secs Computing kpt #: 340 total cpu time spent up to now is 38.6 secs Computing kpt #: 341 total cpu time spent up to now is 38.7 secs Computing kpt #: 342 total cpu time spent up to now is 38.9 secs Computing kpt #: 343 total cpu time spent up to now is 39.0 secs Computing kpt #: 344 total cpu time spent up to now is 39.1 secs Computing kpt #: 345 total cpu time spent up to now is 39.3 secs Computing kpt #: 346 total cpu time spent up to now is 39.4 secs Computing kpt #: 347 total cpu time spent up to now is 39.5 secs Computing kpt #: 348 total cpu time spent up to now is 39.7 secs Computing kpt #: 349 total cpu time spent up to now is 39.8 secs Computing kpt #: 350 total cpu time spent up to now is 39.9 secs Computing kpt #: 351 total cpu time spent up to now is 40.1 secs Computing kpt #: 352 total cpu time spent up to now is 40.2 secs Computing kpt #: 353 total cpu time spent up to now is 40.4 secs Computing kpt #: 354 total cpu time spent up to now is 40.5 secs Computing kpt #: 355 total cpu time spent up to now is 40.6 secs Computing kpt #: 356 total cpu time spent up to now is 40.8 secs Computing kpt #: 357 total cpu time spent up to now is 40.9 secs Computing kpt #: 358 total cpu time spent up to now is 41.0 secs Computing kpt #: 359 total cpu time spent up to now is 41.2 secs Computing kpt #: 360 total cpu time spent up to now is 41.3 secs Computing kpt #: 361 total cpu time spent up to now is 41.4 secs Computing kpt #: 362 total cpu time spent up to now is 41.5 secs Computing kpt #: 363 total cpu time spent up to now is 41.7 secs Computing kpt #: 364 total cpu time spent up to now is 41.8 secs Computing kpt #: 365 total cpu time spent up to now is 41.9 secs Computing kpt #: 366 total cpu time spent up to now is 42.0 secs Computing kpt #: 367 total cpu time spent up to now is 42.1 secs Computing kpt #: 368 total cpu time spent up to now is 42.2 secs Computing kpt #: 369 total cpu time spent up to now is 42.3 secs Computing kpt #: 370 total cpu time spent up to now is 42.4 secs Computing kpt #: 371 total cpu time spent up to now is 42.5 secs Computing kpt #: 372 total cpu time spent up to now is 42.6 secs Computing kpt #: 373 total cpu time spent up to now is 42.7 secs Computing kpt #: 374 total cpu time spent up to now is 42.8 secs Computing kpt #: 375 total cpu time spent up to now is 42.9 secs ethr = 4.55E-08, avg # of iterations = 12.3 total cpu time spent up to now is 42.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1365 PWs) bands (ev): -38.5197 -38.5197 -17.3708 -17.3708 -16.8594 -16.8594 -16.8594 -16.8594 4.1413 4.1413 7.3984 7.3984 7.3984 7.3984 8.2265 8.2265 8.2265 8.2265 8.3779 8.3779 11.7586 11.7586 11.7586 11.7586 14.3562 14.3562 14.3562 14.3562 14.3868 14.3868 k = 0.0000 0.0102-0.0000 ( 1374 PWs) bands (ev): -38.5197 -38.5197 -17.3710 -17.3710 -16.8597 -16.8597 -16.8594 -16.8594 4.1430 4.1430 7.3984 7.3984 7.3987 7.3987 8.2264 8.2264 8.2265 8.2265 8.3779 8.3779 11.7584 11.7584 11.7585 11.7585 14.3531 14.3531 14.3551 14.3551 14.3847 14.3847 k = 0.0000 0.0204-0.0000 ( 1382 PWs) bands (ev): -38.5196 -38.5196 -17.3712 -17.3712 -16.8602 -16.8602 -16.8594 -16.8594 4.1481 4.1481 7.3996 7.3996 7.3998 7.3998 8.2260 8.2260 8.2266 8.2266 8.3777 8.3777 11.7578 11.7578 11.7584 11.7584 14.3438 14.3438 14.3508 14.3508 14.3796 14.3796 k = 0.0000 0.0306-0.0000 ( 1390 PWs) bands (ev): -38.5195 -38.5195 -17.3716 -17.3716 -16.8610 -16.8610 -16.8594 -16.8594 4.1566 4.1566 7.4012 7.4012 7.4019 7.4019 8.2255 8.2255 8.2268 8.2268 8.3774 8.3774 11.7568 11.7568 11.7582 11.7582 14.3286 14.3286 14.3411 14.3411 14.3739 14.3739 k = 0.0000 0.0408-0.0000 ( 1390 PWs) bands (ev): -38.5194 -38.5194 -17.3720 -17.3720 -16.8621 -16.8621 -16.8592 -16.8592 4.1685 4.1685 7.4038 7.4038 7.4051 7.4051 8.2247 8.2247 8.2270 8.2270 8.3771 8.3771 11.7554 11.7554 11.7578 11.7578 14.3076 14.3076 14.3239 14.3239 14.3699 14.3699 k = 0.0000 0.0510-0.0000 ( 1390 PWs) bands (ev): -38.5192 -38.5192 -17.3726 -17.3726 -16.8635 -16.8635 -16.8591 -16.8591 4.1838 4.1838 7.4071 7.4071 7.4091 7.4091 8.2237 8.2237 8.2273 8.2273 8.3767 8.3767 11.7537 11.7537 11.7572 11.7572 14.2813 14.2813 14.2999 14.2999 14.3672 14.3672 k = 0.0000 0.0612-0.0000 ( 1390 PWs) bands (ev): -38.5189 -38.5189 -17.3733 -17.3733 -16.8652 -16.8652 -16.8589 -16.8589 4.2024 4.2024 7.4111 7.4111 7.4140 7.4140 8.2226 8.2226 8.2277 8.2277 8.3763 8.3763 11.7516 11.7516 11.7561 11.7561 14.2499 14.2499 14.2700 14.2700 14.3653 14.3653 k = 0.0000 0.0714-0.0000 ( 1390 PWs) bands (ev): -38.5187 -38.5187 -17.3742 -17.3742 -16.8671 -16.8671 -16.8586 -16.8586 4.2243 4.2243 7.4158 7.4158 7.4198 7.4198 8.2212 8.2212 8.2280 8.2280 8.3757 8.3757 11.7491 11.7491 11.7545 11.7545 14.2141 14.2141 14.2353 14.2353 14.3636 14.3636 k = 0.0000 0.0816-0.0000 ( 1394 PWs) bands (ev): -38.5184 -38.5184 -17.3752 -17.3752 -16.8694 -16.8694 -16.8583 -16.8583 4.2496 4.2496 7.4212 7.4212 7.4263 7.4263 8.2196 8.2196 8.2285 8.2285 8.3752 8.3752 11.7462 11.7462 11.7519 11.7519 14.1741 14.1741 14.1963 14.1963 14.3619 14.3619 k = 0.0000 0.0918-0.0000 ( 1394 PWs) bands (ev): -38.5180 -38.5180 -17.3763 -17.3763 -16.8719 -16.8719 -16.8580 -16.8580 4.2782 4.2782 7.4272 7.4272 7.4337 7.4337 8.2179 8.2179 8.2289 8.2289 8.3746 8.3746 11.7430 11.7430 11.7485 11.7485 14.1306 14.1306 14.1536 14.1536 14.3602 14.3602 k = 0.0000 0.1020-0.0000 ( 1394 PWs) bands (ev): -38.5176 -38.5176 -17.3775 -17.3775 -16.8746 -16.8746 -16.8576 -16.8576 4.3101 4.3101 7.4339 7.4339 7.4417 7.4417 8.2160 8.2160 8.2294 8.2294 8.3740 8.3740 11.7395 11.7395 11.7440 11.7440 14.0841 14.0841 14.1078 14.1078 14.3584 14.3584 k = 0.0000 0.1122-0.0000 ( 1402 PWs) bands (ev): -38.5172 -38.5172 -17.3790 -17.3790 -16.8776 -16.8776 -16.8573 -16.8573 4.3452 4.3452 7.4412 7.4412 7.4505 7.4505 8.2137 8.2137 8.2297 8.2297 8.3733 8.3733 11.7355 11.7355 11.7379 11.7379 14.0348 14.0348 14.0592 14.0592 14.3565 14.3565 k = 0.0000 0.1224-0.0000 ( 1402 PWs) bands (ev): -38.5167 -38.5167 -17.3805 -17.3805 -16.8807 -16.8807 -16.8568 -16.8568 4.3836 4.3836 7.4491 7.4491 7.4600 7.4600 8.2115 8.2115 8.2301 8.2301 8.3727 8.3727 11.7299 11.7299 11.7312 11.7312 13.9834 13.9834 14.0084 14.0084 14.3546 14.3546 k = 0.0000 0.1327-0.0000 ( 1402 PWs) bands (ev): -38.5162 -38.5162 -17.3821 -17.3821 -16.8840 -16.8840 -16.8564 -16.8564 4.4251 4.4251 7.4575 7.4575 7.4700 7.4700 8.2092 8.2092 8.2305 8.2305 8.3722 8.3722 11.7198 11.7198 11.7267 11.7267 13.9303 13.9303 13.9558 13.9558 14.3525 14.3525 k = 0.0000 0.1429-0.0000 ( 1410 PWs) bands (ev): -38.5157 -38.5157 -17.3839 -17.3839 -16.8876 -16.8876 -16.8560 -16.8560 4.4698 4.4698 7.4665 7.4665 7.4807 7.4807 8.2065 8.2065 8.2307 8.2307 8.3716 8.3716 11.7071 11.7071 11.7217 11.7217 13.8757 13.8757 13.9017 13.9017 14.3503 14.3503 k = 0.0000 0.1531-0.0000 ( 1414 PWs) bands (ev): -38.5152 -38.5152 -17.3859 -17.3859 -16.8912 -16.8912 -16.8555 -16.8555 4.5176 4.5176 7.4760 7.4760 7.4916 7.4916 8.2039 8.2039 8.2309 8.2309 8.3713 8.3713 11.6913 11.6913 11.7165 11.7165 13.8201 13.8201 13.8466 13.8466 14.3479 14.3479 k = 0.0000 0.1633-0.0000 ( 1414 PWs) bands (ev): -38.5146 -38.5146 -17.3879 -17.3879 -16.8950 -16.8950 -16.8549 -16.8549 4.5684 4.5684 7.4860 7.4860 7.5033 7.5033 8.2012 8.2012 8.2310 8.2310 8.3710 8.3710 11.6722 11.6722 11.7111 11.7111 13.7638 13.7638 13.7907 13.7907 14.3455 14.3455 k = 0.0000 0.1735-0.0000 ( 1414 PWs) bands (ev): -38.5140 -38.5140 -17.3901 -17.3901 -16.8988 -16.8988 -16.8544 -16.8544 4.6223 4.6223 7.4964 7.4964 7.5154 7.5154 8.1985 8.1985 8.2311 8.2311 8.3709 8.3709 11.6491 11.6491 11.7053 11.7053 13.7072 13.7072 13.7343 13.7343 14.3430 14.3430 k = 0.0000 0.1837-0.0000 ( 1414 PWs) bands (ev): -38.5134 -38.5134 -17.3923 -17.3923 -16.9027 -16.9027 -16.8538 -16.8538 4.6791 4.6791 7.5073 7.5073 7.5279 7.5279 8.1956 8.1956 8.2310 8.2310 8.3709 8.3709 11.6217 11.6217 11.6993 11.6993 13.6503 13.6503 13.6778 13.6778 14.3405 14.3405 k = 0.0000 0.1939-0.0000 ( 1422 PWs) bands (ev): -38.5127 -38.5127 -17.3948 -17.3948 -16.9067 -16.9067 -16.8533 -16.8533 4.7388 4.7388 7.5184 7.5184 7.5408 7.5408 8.1926 8.1926 8.2307 8.2307 8.3709 8.3709 11.5894 11.5894 11.6931 11.6931 13.5937 13.5937 13.6214 13.6214 14.3378 14.3378 k = 0.0000 0.2041-0.0000 ( 1422 PWs) bands (ev): -38.5121 -38.5121 -17.3973 -17.3973 -16.9107 -16.9107 -16.8527 -16.8527 4.8014 4.8014 7.5299 7.5299 7.5539 7.5539 8.1897 8.1897 8.2304 8.2304 8.3712 8.3712 11.5520 11.5520 11.6867 11.6867 13.5373 13.5373 13.5652 13.5652 14.3351 14.3351 k = 0.0000 0.2143-0.0000 ( 1430 PWs) bands (ev): -38.5114 -38.5114 -17.3999 -17.3999 -16.9148 -16.9148 -16.8521 -16.8521 4.8667 4.8667 7.5415 7.5415 7.5672 7.5672 8.1867 8.1867 8.2299 8.2299 8.3717 8.3717 11.5090 11.5090 11.6800 11.6800 13.4815 13.4815 13.5095 13.5095 14.3323 14.3323 k = 0.0000 0.2245-0.0000 ( 1430 PWs) bands (ev): -38.5108 -38.5108 -17.4026 -17.4026 -16.9188 -16.9188 -16.8515 -16.8515 4.9347 4.9347 7.5535 7.5535 7.5808 7.5808 8.1837 8.1837 8.2294 8.2294 8.3723 8.3723 11.4600 11.4600 11.6732 11.6732 13.4265 13.4265 13.4546 13.4546 14.3295 14.3295 k = 0.0000 0.2347-0.0000 ( 1430 PWs) bands (ev): -38.5101 -38.5101 -17.4054 -17.4054 -16.9227 -16.9227 -16.8509 -16.8509 5.0054 5.0054 7.5657 7.5657 7.5944 7.5944 8.1807 8.1807 8.2287 8.2287 8.3732 8.3732 11.4049 11.4049 11.6663 11.6663 13.3723 13.3723 13.4006 13.4006 14.3267 14.3267 k = 0.0000 0.2449-0.0000 ( 1422 PWs) bands (ev): -38.5094 -38.5094 -17.4082 -17.4082 -16.9266 -16.9266 -16.8503 -16.8503 5.0785 5.0785 7.5780 7.5780 7.6082 7.6082 8.1778 8.1778 8.2280 8.2280 8.3742 8.3742 11.3439 11.3439 11.6592 11.6592 13.3193 13.3193 13.3476 13.3476 14.3238 14.3238 k = 0.0000 0.2551-0.0000 ( 1422 PWs) bands (ev): -38.5087 -38.5087 -17.4111 -17.4111 -16.9305 -16.9305 -16.8496 -16.8496 5.1541 5.1541 7.5903 7.5903 7.6220 7.6220 8.1749 8.1749 8.2270 8.2270 8.3753 8.3753 11.2761 11.2761 11.6520 11.6520 13.2674 13.2674 13.2957 13.2957 14.3209 14.3209 k = 0.0000 0.2653-0.0000 ( 1426 PWs) bands (ev): -38.5080 -38.5080 -17.4142 -17.4142 -16.9343 -16.9343 -16.8490 -16.8490 5.2321 5.2321 7.6027 7.6027 7.6357 7.6357 8.1719 8.1719 8.2260 8.2260 8.3766 8.3766 11.2020 11.2020 11.6448 11.6448 13.2169 13.2169 13.2452 13.2452 14.3181 14.3181 k = 0.0000 0.2755-0.0000 ( 1426 PWs) bands (ev): -38.5073 -38.5073 -17.4172 -17.4172 -16.9380 -16.9380 -16.8484 -16.8484 5.3122 5.3122 7.6151 7.6151 7.6495 7.6495 8.1690 8.1690 8.2249 8.2249 8.3780 8.3780 11.1219 11.1219 11.6375 11.6375 13.1678 13.1678 13.1961 13.1961 14.3152 14.3152 k = 0.0000 0.2857-0.0000 ( 1426 PWs) bands (ev): -38.5067 -38.5067 -17.4202 -17.4202 -16.9415 -16.9415 -16.8478 -16.8478 5.3945 5.3945 7.6274 7.6274 7.6631 7.6631 8.1662 8.1662 8.2237 8.2237 8.3796 8.3796 11.0359 11.0359 11.6303 11.6303 13.1203 13.1203 13.1485 13.1485 14.3124 14.3124 k = 0.0000 0.2959-0.0000 ( 1426 PWs) bands (ev): -38.5060 -38.5060 -17.4233 -17.4233 -16.9450 -16.9450 -16.8472 -16.8472 5.4786 5.4786 7.6395 7.6395 7.6767 7.6767 8.1634 8.1634 8.2225 8.2225 8.3812 8.3812 10.9445 10.9445 11.6230 11.6230 13.0744 13.0744 13.1026 13.1026 14.3096 14.3096 k = 0.0000 0.3061-0.0000 ( 1430 PWs) bands (ev): -38.5054 -38.5054 -17.4264 -17.4264 -16.9484 -16.9484 -16.8466 -16.8466 5.5645 5.5645 7.6515 7.6515 7.6900 7.6900 8.1607 8.1607 8.2212 8.2212 8.3829 8.3829 10.8482 10.8482 11.6158 11.6158 13.0303 13.0303 13.0584 13.0584 14.3068 14.3068 k = 0.0000 0.3163-0.0000 ( 1430 PWs) bands (ev): -38.5047 -38.5047 -17.4295 -17.4295 -16.9516 -16.9516 -16.8460 -16.8460 5.6520 5.6520 7.6632 7.6632 7.7033 7.7033 8.1580 8.1580 8.2200 8.2200 8.3847 8.3847 10.7474 10.7474 11.6087 11.6087 12.9880 12.9880 13.0160 13.0160 14.3041 14.3041 k = 0.0000 0.3265-0.0000 ( 1426 PWs) bands (ev): -38.5041 -38.5041 -17.4325 -17.4325 -16.9546 -16.9546 -16.8454 -16.8454 5.7409 5.7409 7.6747 7.6747 7.7167 7.7167 8.1555 8.1555 8.2187 8.2187 8.3866 8.3866 10.6429 10.6429 11.6017 11.6017 12.9476 12.9476 12.9756 12.9756 14.3015 14.3015 k = 0.0000 0.3367-0.0000 ( 1426 PWs) bands (ev): -38.5035 -38.5035 -17.4354 -17.4354 -16.9575 -16.9575 -16.8449 -16.8449 5.8308 5.8308 7.6858 7.6858 7.7298 7.7298 8.1529 8.1529 8.2175 8.2175 8.3884 8.3884 10.5351 10.5351 11.5949 11.5949 12.9092 12.9092 12.9370 12.9370 14.2990 14.2990 k = 0.0000 0.3469-0.0000 ( 1426 PWs) bands (ev): -38.5029 -38.5029 -17.4383 -17.4383 -16.9602 -16.9602 -16.8444 -16.8444 5.9216 5.9216 7.6964 7.6964 7.7428 7.7428 8.1503 8.1503 8.2162 8.2162 8.3903 8.3903 10.4249 10.4249 11.5883 11.5883 12.8728 12.8728 12.9006 12.9006 14.2966 14.2966 k = 0.0000 0.3571-0.0000 ( 1434 PWs) bands (ev): -38.5024 -38.5024 -17.4412 -17.4412 -16.9628 -16.9628 -16.8439 -16.8439 6.0128 6.0128 7.7067 7.7067 7.7556 7.7556 8.1477 8.1477 8.2150 8.2150 8.3921 8.3921 10.3129 10.3129 11.5819 11.5819 12.8385 12.8385 12.8661 12.8661 14.2942 14.2942 k = 0.0000 0.3673-0.0000 ( 1434 PWs) bands (ev): -38.5019 -38.5019 -17.4439 -17.4439 -16.9652 -16.9652 -16.8434 -16.8434 6.1040 6.1040 7.7164 7.7164 7.7686 7.7686 8.1451 8.1451 8.2138 8.2138 8.3939 8.3939 10.2000 10.2000 11.5757 11.5757 12.8063 12.8063 12.8339 12.8339 14.2920 14.2920 k = 0.0000 0.3776-0.0000 ( 1434 PWs) bands (ev): -38.5014 -38.5014 -17.4465 -17.4465 -16.9675 -16.9675 -16.8429 -16.8429 6.1947 6.1947 7.7257 7.7257 7.7818 7.7818 8.1424 8.1424 8.2127 8.2127 8.3957 8.3957 10.0868 10.0868 11.5699 11.5699 12.7764 12.7764 12.8038 12.8038 14.2899 14.2899 k = 0.0000 0.3878-0.0000 ( 1434 PWs) bands (ev): -38.5009 -38.5009 -17.4490 -17.4490 -16.9695 -16.9695 -16.8425 -16.8425 6.2845 6.2845 7.7343 7.7343 7.7951 7.7951 8.1396 8.1396 8.2117 8.2117 8.3974 8.3974 9.9744 9.9744 11.5644 11.5644 12.7487 12.7487 12.7760 12.7760 14.2879 14.2879 k = 0.0000 0.3980-0.0000 ( 1430 PWs) bands (ev): -38.5005 -38.5005 -17.4512 -17.4512 -16.9714 -16.9714 -16.8421 -16.8421 6.3725 6.3725 7.7423 7.7423 7.8087 7.8087 8.1365 8.1365 8.2108 8.2108 8.3990 8.3990 9.8639 9.8639 11.5592 11.5592 12.7233 12.7233 12.7505 12.7505 14.2861 14.2861 k = 0.0000 0.4082-0.0000 ( 1434 PWs) bands (ev): -38.5001 -38.5001 -17.4534 -17.4534 -16.9731 -16.9731 -16.8418 -16.8418 6.4580 6.4580 7.7497 7.7497 7.8228 7.8228 8.1332 8.1332 8.2099 8.2099 8.4004 8.4004 9.7558 9.7558 11.5543 11.5543 12.7001 12.7001 12.7273 12.7273 14.2844 14.2844 k = 0.0000 0.4184-0.0000 ( 1434 PWs) bands (ev): -38.4997 -38.4997 -17.4553 -17.4553 -16.9746 -16.9746 -16.8414 -16.8414 6.5400 6.5400 7.7564 7.7564 7.8375 7.8375 8.1294 8.1294 8.2092 8.2092 8.4018 8.4018 9.6517 9.6517 11.5500 11.5500 12.6794 12.6794 12.7065 12.7065 14.2829 14.2829 k = 0.0000 0.4286-0.0000 ( 1434 PWs) bands (ev): -38.4994 -38.4994 -17.4571 -17.4571 -16.9759 -16.9759 -16.8412 -16.8412 6.6173 6.6173 7.7623 7.7623 7.8530 7.8530 8.1251 8.1251 8.2085 8.2085 8.4031 8.4031 9.5529 9.5529 11.5461 11.5461 12.6610 12.6610 12.6880 12.6880 14.2815 14.2815 k = 0.0000 0.4388-0.0000 ( 1434 PWs) bands (ev): -38.4991 -38.4991 -17.4586 -17.4586 -16.9771 -16.9771 -16.8409 -16.8409 6.6887 6.6887 7.7676 7.7676 7.8694 7.8694 8.1201 8.1201 8.2079 8.2079 8.4042 8.4042 9.4609 9.4609 11.5427 11.5427 12.6450 12.6450 12.6720 12.6720 14.2804 14.2804 k = 0.0000 0.4490-0.0000 ( 1438 PWs) bands (ev): -38.4989 -38.4989 -17.4600 -17.4600 -16.9781 -16.9781 -16.8407 -16.8407 6.7527 6.7527 7.7720 7.7720 7.8863 7.8863 8.1143 8.1143 8.2074 8.2074 8.4051 8.4051 9.3774 9.3774 11.5397 11.5397 12.6314 12.6314 12.6583 12.6583 14.2793 14.2793 k = 0.0000 0.4592-0.0000 ( 1430 PWs) bands (ev): -38.4987 -38.4987 -17.4610 -17.4610 -16.9789 -16.9789 -16.8405 -16.8405 6.8078 6.8078 7.7758 7.7758 7.9036 7.9036 8.1078 8.1078 8.2071 8.2071 8.4059 8.4059 9.3047 9.3047 11.5374 11.5374 12.6203 12.6203 12.6472 12.6472 14.2785 14.2785 k = 0.0000 0.4694-0.0000 ( 1422 PWs) bands (ev): -38.4985 -38.4985 -17.4618 -17.4618 -16.9794 -16.9794 -16.8403 -16.8403 6.8526 6.8526 7.7787 7.7787 7.9204 7.9204 8.1008 8.1008 8.2068 8.2068 8.4066 8.4066 9.2448 9.2448 11.5356 11.5356 12.6117 12.6117 12.6386 12.6386 14.2779 14.2779 k = 0.0000 0.4796-0.0000 ( 1422 PWs) bands (ev): -38.4984 -38.4984 -17.4624 -17.4624 -16.9799 -16.9799 -16.8402 -16.8402 6.8857 6.8857 7.7807 7.7807 7.9351 7.9351 8.0940 8.0940 8.2066 8.2066 8.4070 8.4070 9.2000 9.2000 11.5342 11.5342 12.6055 12.6055 12.6324 12.6324 14.2774 14.2774 k = 0.0000 0.4898-0.0000 ( 1422 PWs) bands (ev): -38.4984 -38.4984 -17.4628 -17.4628 -16.9801 -16.9801 -16.8401 -16.8401 6.9060 6.9060 7.7820 7.7820 7.9455 7.9455 8.0887 8.0887 8.2064 8.2064 8.4073 8.4073 9.1722 9.1722 11.5334 11.5334 12.6018 12.6018 12.6286 12.6286 14.2771 14.2771 k = 0.0000 0.5000-0.0000 ( 1422 PWs) bands (ev): -38.4983 -38.4983 -17.4629 -17.4629 -16.9802 -16.9802 -16.8401 -16.8401 6.9129 6.9129 7.7824 7.7824 7.9493 7.9493 8.0866 8.0866 8.2064 8.2064 8.4074 8.4074 9.1628 9.1628 11.5331 11.5331 12.6006 12.6006 12.6274 12.6274 14.2770 14.2770 k = 0.0000 0.5000-0.0000 ( 1422 PWs) bands (ev): -38.4983 -38.4983 -17.4629 -17.4629 -16.9802 -16.9802 -16.8401 -16.8401 6.9129 6.9129 7.7824 7.7824 7.9493 7.9493 8.0866 8.0866 8.2064 8.2064 8.4074 8.4074 9.1628 9.1628 11.5331 11.5331 12.6006 12.6006 12.6274 12.6274 14.2770 14.2770 k = 0.0102 0.5000-0.0000 ( 1422 PWs) bands (ev): -38.4983 -38.4983 -17.4629 -17.4629 -16.9803 -16.9803 -16.8402 -16.8402 6.9135 6.9135 7.7823 7.7823 7.9453 7.9453 8.0902 8.0902 8.2081 8.2081 8.4070 8.4070 9.1626 9.1626 11.5344 11.5344 12.6009 12.6009 12.6277 12.6277 14.2763 14.2763 k = 0.0204 0.5000-0.0000 ( 1422 PWs) bands (ev): -38.4983 -38.4983 -17.4630 -17.4630 -16.9804 -16.9804 -16.8405 -16.8405 6.9154 6.9154 7.7821 7.7821 7.9346 7.9346 8.0993 8.0993 8.2134 8.2134 8.4060 8.4060 9.1621 9.1621 11.5382 11.5382 12.6015 12.6015 12.6290 12.6290 14.2743 14.2743 k = 0.0306 0.5000-0.0000 ( 1428 PWs) bands (ev): -38.4982 -38.4982 -17.4631 -17.4631 -16.9807 -16.9807 -16.8411 -16.8411 6.9186 6.9186 7.7816 7.7816 7.9198 7.9198 8.1103 8.1103 8.2233 8.2233 8.4044 8.4044 9.1613 9.1613 11.5445 11.5445 12.6016 12.6016 12.6319 12.6319 14.2709 14.2709 k = 0.0408 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4980 -38.4980 -17.4633 -17.4633 -16.9810 -16.9810 -16.8418 -16.8418 6.9229 6.9229 7.7809 7.7809 7.9033 7.9033 8.1200 8.1200 8.2389 8.2389 8.4023 8.4023 9.1601 9.1601 11.5533 11.5533 12.6003 12.6003 12.6374 12.6374 14.2662 14.2662 k = 0.0510 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4978 -38.4978 -17.4635 -17.4635 -16.9814 -16.9814 -16.8427 -16.8427 6.9285 6.9285 7.7797 7.7797 7.8864 7.8864 8.1268 8.1268 8.2600 8.2600 8.4004 8.4004 9.1587 9.1587 11.5647 11.5647 12.5974 12.5974 12.6457 12.6457 14.2602 14.2602 k = 0.0612 0.5000-0.0000 ( 1430 PWs) bands (ev): -38.4976 -38.4976 -17.4637 -17.4637 -16.9819 -16.9819 -16.8437 -16.8437 6.9352 6.9352 7.7775 7.7775 7.8702 7.8702 8.1307 8.1307 8.2851 8.2851 8.3995 8.3995 9.1570 9.1570 11.5785 11.5785 12.5928 12.5928 12.6568 12.6568 14.2529 14.2529 k = 0.0714 0.5000-0.0000 ( 1430 PWs) bands (ev): -38.4973 -38.4973 -17.4640 -17.4640 -16.9825 -16.9825 -16.8450 -16.8450 6.9429 6.9429 7.7738 7.7738 7.8560 7.8560 8.1321 8.1321 8.3108 8.3108 8.4021 8.4021 9.1551 9.1551 11.5946 11.5946 12.5867 12.5867 12.6703 12.6703 14.2444 14.2444 k = 0.0816 0.5000-0.0000 ( 1430 PWs) bands (ev): -38.4970 -38.4970 -17.4643 -17.4643 -16.9833 -16.9833 -16.8463 -16.8463 6.9515 6.9515 7.7678 7.7678 7.8446 7.8446 8.1318 8.1318 8.3308 8.3308 8.4138 8.4138 9.1529 9.1529 11.6130 11.6130 12.5792 12.5792 12.6861 12.6861 14.2348 14.2348 k = 0.0918 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4967 -38.4967 -17.4647 -17.4647 -16.9841 -16.9841 -16.8479 -16.8479 6.9610 6.9610 7.7588 7.7588 7.8369 7.8369 8.1302 8.1302 8.3395 8.3395 8.4397 8.4397 9.1506 9.1506 11.6335 11.6335 12.5703 12.5703 12.7039 12.7039 14.2241 14.2241 k = 0.1020 0.5000-0.0000 ( 1438 PWs) bands (ev): -38.4963 -38.4963 -17.4652 -17.4652 -16.9851 -16.9851 -16.8495 -16.8495 6.9711 6.9711 7.7468 7.7468 7.8331 7.8331 8.1277 8.1277 8.3392 8.3392 8.4771 8.4771 9.1481 9.1481 11.6560 11.6560 12.5602 12.5602 12.7238 12.7238 14.2123 14.2123 k = 0.1122 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4959 -38.4959 -17.4656 -17.4656 -16.9862 -16.9862 -16.8512 -16.8512 6.9818 6.9818 7.7327 7.7327 7.8326 7.8326 8.1245 8.1245 8.3344 8.3344 8.5215 8.5215 9.1456 9.1456 11.6806 11.6806 12.5487 12.5487 12.7455 12.7455 14.1996 14.1996 k = 0.1224 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4955 -38.4955 -17.4661 -17.4661 -16.9874 -16.9874 -16.8530 -16.8530 6.9930 6.9930 7.7171 7.7171 7.8346 7.8346 8.1206 8.1206 8.3272 8.3272 8.5705 8.5705 9.1431 9.1431 11.7069 11.7069 12.5357 12.5357 12.7690 12.7690 14.1861 14.1861 k = 0.1327 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4950 -38.4950 -17.4667 -17.4667 -16.9888 -16.9888 -16.8548 -16.8548 7.0043 7.0043 7.7008 7.7008 7.8388 7.8388 8.1162 8.1162 8.3187 8.3187 8.6231 8.6231 9.1406 9.1406 11.7350 11.7350 12.5214 12.5214 12.7941 12.7941 14.1717 14.1717 k = 0.1429 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4945 -38.4945 -17.4674 -17.4674 -16.9903 -16.9903 -16.8566 -16.8566 7.0157 7.0157 7.6840 7.6840 7.8448 7.8448 8.1114 8.1114 8.3092 8.3092 8.6789 8.6789 9.1382 9.1382 11.7646 11.7646 12.5055 12.5055 12.8207 12.8207 14.1566 14.1566 k = 0.1531 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4940 -38.4940 -17.4681 -17.4681 -16.9919 -16.9919 -16.8584 -16.8584 7.0270 7.0270 7.6671 7.6671 7.8525 7.8525 8.1063 8.1063 8.2991 8.2991 8.7375 8.7375 9.1360 9.1360 11.7956 11.7956 12.4882 12.4882 12.8487 12.8487 14.1408 14.1408 k = 0.1633 0.5000-0.0000 ( 1430 PWs) bands (ev): -38.4935 -38.4935 -17.4688 -17.4688 -16.9937 -16.9937 -16.8602 -16.8602 7.0380 7.0380 7.6502 7.6502 7.8619 7.8619 8.1010 8.1010 8.2887 8.2887 8.7988 8.7988 9.1342 9.1342 11.8277 11.8277 12.4693 12.4693 12.8781 12.8781 14.1245 14.1245 k = 0.1735 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4929 -38.4929 -17.4697 -17.4697 -16.9956 -16.9956 -16.8620 -16.8620 7.0484 7.0484 7.6332 7.6332 7.8728 7.8728 8.0954 8.0954 8.2779 8.2779 8.8623 8.8623 9.1330 9.1330 11.8609 11.8609 12.4487 12.4487 12.9085 12.9085 14.1077 14.1077 k = 0.1837 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4923 -38.4923 -17.4706 -17.4706 -16.9977 -16.9977 -16.8637 -16.8637 7.0583 7.0583 7.6164 7.6164 7.8853 7.8853 8.0898 8.0898 8.2669 8.2669 8.9278 8.9278 9.1327 9.1327 11.8949 11.8949 12.4265 12.4265 12.9401 12.9401 14.0906 14.0906 k = 0.1939 0.5000-0.0000 ( 1440 PWs) bands (ev): -38.4917 -38.4917 -17.4715 -17.4715 -16.9999 -16.9999 -16.8654 -16.8654 7.0673 7.0673 7.5999 7.5999 7.8992 7.8992 8.0842 8.0842 8.2560 8.2560 8.9939 8.9939 9.1348 9.1348 11.9295 11.9295 12.4026 12.4026 12.9725 12.9725 14.0731 14.0731 k = 0.2041 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4911 -38.4911 -17.4725 -17.4725 -17.0023 -17.0023 -16.8669 -16.8669 7.0755 7.0755 7.5837 7.5837 7.9144 7.9144 8.0790 8.0790 8.2454 8.2454 9.0557 9.0557 9.1438 9.1438 11.9645 11.9645 12.3770 12.3770 13.0058 13.0058 14.0555 14.0555 k = 0.2143 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4904 -38.4904 -17.4736 -17.4736 -17.0047 -17.0047 -16.8684 -16.8684 7.0827 7.0827 7.5676 7.5676 7.9303 7.9303 8.0743 8.0743 8.2352 8.2352 9.0960 9.0960 9.1774 9.1774 11.9997 11.9997 12.3495 12.3495 13.0397 13.0397 14.0376 14.0376 k = 0.2245 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4898 -38.4898 -17.4747 -17.4747 -17.0073 -17.0073 -16.8697 -16.8697 7.0888 7.0888 7.5519 7.5519 7.9464 7.9464 8.0706 8.0706 8.2258 8.2258 9.1093 9.1093 9.2408 9.2408 12.0348 12.0348 12.3203 12.3203 13.0742 13.0742 14.0198 14.0198 k = 0.2347 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4892 -38.4892 -17.4759 -17.4759 -17.0099 -17.0099 -16.8710 -16.8710 7.0937 7.0937 7.5364 7.5364 7.9613 7.9613 8.0685 8.0685 8.2177 8.2177 9.1141 9.1141 9.3154 9.3154 12.0696 12.0696 12.2893 12.2893 13.1091 13.1091 14.0019 14.0019 k = 0.2449 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4885 -38.4885 -17.4771 -17.4771 -17.0127 -17.0127 -16.8722 -16.8722 7.0976 7.0976 7.5213 7.5213 7.9737 7.9737 8.0688 8.0688 8.2115 8.2115 9.1172 9.1172 9.3945 9.3945 12.1038 12.1038 12.2564 12.2564 13.1442 13.1442 13.9842 13.9842 k = 0.2551 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4879 -38.4879 -17.4784 -17.4784 -17.0155 -17.0155 -16.8732 -16.8732 7.1003 7.1003 7.5066 7.5066 7.9820 7.9820 8.0720 8.0720 8.2084 8.2084 9.1203 9.1203 9.4765 9.4765 12.1370 12.1370 12.2218 12.2218 13.1794 13.1794 13.9666 13.9666 k = 0.2653 0.5000-0.0000 ( 1424 PWs) bands (ev): -38.4872 -38.4872 -17.4797 -17.4797 -17.0183 -17.0183 -16.8741 -16.8741 7.1021 7.1021 7.4924 7.4924 7.9858 7.9858 8.0769 8.0769 8.2101 8.2101 9.1238 9.1238 9.5609 9.5609 12.1689 12.1689 12.1859 12.1859 13.2147 13.2147 13.9493 13.9493 k = 0.2755 0.5000-0.0000 ( 1424 PWs) bands (ev): -38.4866 -38.4866 -17.4811 -17.4811 -17.0211 -17.0211 -16.8749 -16.8749 7.1028 7.1028 7.4786 7.4786 7.9856 7.9856 8.0811 8.0811 8.2177 8.2177 9.1281 9.1281 9.6471 9.6471 12.1473 12.1473 12.2000 12.2000 13.2498 13.2498 13.9322 13.9322 k = 0.2857 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4859 -38.4859 -17.4826 -17.4826 -17.0240 -17.0240 -16.8757 -16.8757 7.1025 7.1025 7.4650 7.4650 7.9827 7.9827 8.0826 8.0826 8.2319 8.2319 9.1333 9.1333 9.7350 9.7350 12.1077 12.1077 12.2287 12.2287 13.2846 13.2846 13.9155 13.9155 k = 0.2959 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4853 -38.4853 -17.4840 -17.4840 -17.0269 -17.0269 -16.8763 -16.8763 7.1015 7.1015 7.4521 7.4521 7.9782 7.9782 8.0810 8.0810 8.2521 8.2521 9.1397 9.1397 9.8244 9.8244 12.0665 12.0665 12.2552 12.2552 13.3190 13.3190 13.8992 13.8992 k = 0.3061 0.5000-0.0000 ( 1428 PWs) bands (ev): -38.4847 -38.4847 -17.4855 -17.4855 -17.0297 -17.0297 -16.8768 -16.8768 7.0998 7.0998 7.4396 7.4396 7.9728 7.9728 8.0770 8.0770 8.2766 8.2766 9.1475 9.1475 9.9152 9.9152 12.0239 12.0239 12.2794 12.2794 13.3528 13.3528 13.8834 13.8834 k = 0.3163 0.5000-0.0000 ( 1428 PWs) bands (ev): -38.4841 -38.4841 -17.4869 -17.4869 -17.0324 -17.0324 -16.8773 -16.8773 7.0974 7.0974 7.4276 7.4276 7.9669 7.9669 8.0714 8.0714 8.3037 8.3037 9.1567 9.1567 10.0070 10.0070 11.9800 11.9800 12.3006 12.3006 13.3859 13.3859 13.8682 13.8682 k = 0.3265 0.5000-0.0000 ( 1430 PWs) bands (ev): -38.4835 -38.4835 -17.4884 -17.4884 -17.0351 -17.0351 -16.8777 -16.8777 7.0945 7.0945 7.4162 7.4162 7.9606 7.9606 8.0648 8.0648 8.3323 8.3323 9.1676 9.1676 10.0996 10.0996 11.9351 11.9351 12.3187 12.3187 13.4181 13.4181 13.8535 13.8535 k = 0.3367 0.5000-0.0000 ( 1430 PWs) bands (ev): -38.4829 -38.4829 -17.4899 -17.4899 -17.0378 -17.0378 -16.8780 -16.8780 7.0913 7.0913 7.4053 7.4053 7.9542 7.9542 8.0578 8.0578 8.3615 8.3615 9.1800 9.1800 10.1929 10.1929 11.8892 11.8892 12.3333 12.3333 13.4494 13.4494 13.8394 13.8394 k = 0.3469 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4824 -38.4824 -17.4914 -17.4914 -17.0403 -17.0403 -16.8783 -16.8783 7.0877 7.0877 7.3950 7.3950 7.9478 7.9478 8.0507 8.0507 8.3905 8.3905 9.1943 9.1943 10.2866 10.2866 11.8428 11.8428 12.3440 12.3440 13.4795 13.4795 13.8260 13.8260 k = 0.3571 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4818 -38.4818 -17.4928 -17.4928 -17.0427 -17.0427 -16.8785 -16.8785 7.0839 7.0839 7.3853 7.3853 7.9415 7.9415 8.0436 8.0436 8.4187 8.4187 9.2103 9.2103 10.3804 10.3804 11.7960 11.7960 12.3507 12.3507 13.5085 13.5085 13.8132 13.8132 k = 0.3673 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4813 -38.4813 -17.4942 -17.4942 -17.0450 -17.0450 -16.8787 -16.8787 7.0800 7.0800 7.3762 7.3762 7.9353 7.9353 8.0368 8.0368 8.4457 8.4457 9.2281 9.2281 10.4739 10.4739 11.7492 11.7492 12.3531 12.3531 13.5360 13.5360 13.8012 13.8012 k = 0.3776 0.5000-0.0000 ( 1440 PWs) bands (ev): -38.4809 -38.4809 -17.4956 -17.4956 -17.0472 -17.0472 -16.8789 -16.8789 7.0760 7.0760 7.3677 7.3677 7.9294 7.9294 8.0302 8.0302 8.4711 8.4711 9.2473 9.2473 10.5668 10.5668 11.7027 11.7027 12.3510 12.3510 13.5621 13.5621 13.7900 13.7900 k = 0.3878 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4804 -38.4804 -17.4968 -17.4968 -17.0491 -17.0491 -16.8789 -16.8789 7.0721 7.0721 7.3598 7.3598 7.9238 7.9238 8.0241 8.0241 8.4947 8.4947 9.2682 9.2682 10.6588 10.6588 11.6570 11.6570 12.3443 12.3443 13.5865 13.5865 13.7796 13.7796 k = 0.3980 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4800 -38.4800 -17.4981 -17.4981 -17.0510 -17.0510 -16.8790 -16.8790 7.0683 7.0683 7.3526 7.3526 7.9186 7.9186 8.0183 8.0183 8.5161 8.5161 9.2900 9.2900 10.7494 10.7494 11.6124 11.6124 12.3331 12.3331 13.6093 13.6093 13.7700 13.7700 k = 0.4082 0.5000-0.0000 ( 1436 PWs) bands (ev): -38.4796 -38.4796 -17.4992 -17.4992 -17.0527 -17.0527 -16.8791 -16.8791 7.0646 7.0646 7.3460 7.3460 7.9137 7.9137 8.0131 8.0131 8.5354 8.5354 9.3126 9.3126 10.8379 10.8379 11.5695 11.5695 12.3174 12.3174 13.6302 13.6302 13.7612 13.7612 k = 0.4184 0.5000-0.0000 ( 1432 PWs) bands (ev): -38.4793 -38.4793 -17.5002 -17.5002 -17.0542 -17.0542 -16.8791 -16.8791 7.0612 7.0612 7.3402 7.3402 7.9093 7.9093 8.0084 8.0084 8.5524 8.5524 9.3353 9.3353 10.9237 10.9237 11.5288 11.5288 12.2976 12.2976 13.6492 13.6492 13.7533 13.7533 k = 0.4286 0.5000-0.0000 ( 1438 PWs) bands (ev): -38.4790 -38.4790 -17.5012 -17.5012 -17.0556 -17.0556 -16.8791 -16.8791 7.0580 7.0580 7.3349 7.3349 7.9053 7.9053 8.0042 8.0042 8.5672 8.5672 9.3575 9.3575 11.0059 11.0059 11.4909 11.4909 12.2742 12.2742 13.6661 13.6661 13.7463 13.7463 k = 0.4388 0.5000-0.0000 ( 1434 PWs) bands (ev): -38.4787 -38.4787 -17.5020 -17.5020 -17.0567 -17.0567 -16.8791 -16.8791 7.0552 7.0552 7.3304 7.3304 7.9019 7.9019 8.0005 8.0005 8.5797 8.5797 9.3787 9.3787 11.0836 11.0836 11.4565 11.4565 12.2481 12.2481 13.6810 13.6810 13.7402 13.7402 k = 0.4490 0.5000-0.0000 ( 1442 PWs) bands (ev): -38.4785 -38.4785 -17.5028 -17.5028 -17.0577 -17.0577 -16.8792 -16.8792 7.0527 7.0527 7.3265 7.3265 7.8987 7.8987 7.9972 7.9972 8.5902 8.5902 9.3981 9.3981 11.1553 11.1553 11.4259 11.4259 12.2202 12.2202 13.6938 13.6938 13.7350 13.7350 k = 0.4592 0.5000-0.0000 ( 1442 PWs) bands (ev): -38.4783 -38.4783 -17.5034 -17.5034 -17.0586 -17.0586 -16.8792 -16.8792 7.0506 7.0506 7.3233 7.3233 7.8961 7.8961 7.9945 7.9945 8.5986 8.5986 9.4152 9.4152 11.2193 11.2193 11.4001 11.4001 12.1923 12.1923 13.7043 13.7043 13.7308 13.7308 k = 0.4694 0.5000-0.0000 ( 1452 PWs) bands (ev): -38.4782 -38.4782 -17.5039 -17.5039 -17.0593 -17.0593 -16.8792 -16.8792 7.0489 7.0489 7.3207 7.3207 7.8941 7.8941 7.9924 7.9924 8.6050 8.6050 9.4292 9.4292 11.2732 11.2732 11.3794 11.3794 12.1663 12.1663 13.7124 13.7124 13.7274 13.7274 k = 0.4796 0.5000-0.0000 ( 1452 PWs) bands (ev): -38.4781 -38.4781 -17.5043 -17.5043 -17.0597 -17.0597 -16.8792 -16.8792 7.0478 7.0478 7.3190 7.3190 7.8927 7.8927 7.9910 7.9910 8.6095 8.6095 9.4397 9.4397 11.3143 11.3143 11.3648 11.3648 12.1447 12.1447 13.7183 13.7183 13.7251 13.7251 k = 0.4898 0.5000-0.0000 ( 1452 PWs) bands (ev): -38.4780 -38.4780 -17.5045 -17.5045 -17.0600 -17.0600 -16.8792 -16.8792 7.0471 7.0471 7.3179 7.3179 7.8918 7.8918 7.9901 7.9901 8.6122 8.6122 9.4461 9.4461 11.3382 11.3382 11.3581 11.3581 12.1303 12.1303 13.7216 13.7216 13.7239 13.7239 k = 0.5000 0.5000-0.0000 ( 1452 PWs) bands (ev): -38.4780 -38.4780 -17.5045 -17.5045 -17.0601 -17.0601 -16.8792 -16.8792 7.0468 7.0468 7.3175 7.3175 7.8915 7.8915 7.9898 7.9898 8.6131 8.6131 9.4483 9.4483 11.3432 11.3432 11.3592 11.3592 12.1252 12.1252 13.7224 13.7224 13.7239 13.7239 k = 0.5000 0.5000-0.0000 ( 1452 PWs) bands (ev): -38.4780 -38.4780 -17.5045 -17.5045 -17.0601 -17.0601 -16.8792 -16.8792 7.0468 7.0468 7.3175 7.3175 7.8915 7.8915 7.9898 7.9898 8.6131 8.6131 9.4483 9.4483 11.3432 11.3432 11.3592 11.3592 12.1252 12.1252 13.7224 13.7224 13.7239 13.7239 k = 0.4928 0.4928-0.0000 ( 1452 PWs) bands (ev): -38.4780 -38.4780 -17.5045 -17.5045 -17.0600 -17.0600 -16.8792 -16.8792 7.0471 7.0471 7.3179 7.3179 7.8918 7.8918 7.9901 7.9901 8.6122 8.6122 9.4461 9.4461 11.3395 11.3395 11.3568 11.3568 12.1303 12.1303 13.7218 13.7218 13.7237 13.7238 k = 0.4855 0.4855-0.0000 ( 1452 PWs) bands (ev): -38.4781 -38.4781 -17.5043 -17.5043 -17.0597 -17.0597 -16.8792 -16.8792 7.0478 7.0478 7.3190 7.3190 7.8927 7.8927 7.9910 7.9910 8.6095 8.6095 9.4394 9.4394 11.3234 11.3234 11.3554 11.3554 12.1451 12.1451 13.7191 13.7191 13.7243 13.7243 k = 0.4783 0.4783-0.0000 ( 1452 PWs) bands (ev): -38.4782 -38.4782 -17.5039 -17.5039 -17.0593 -17.0593 -16.8792 -16.8792 7.0489 7.0489 7.3208 7.3208 7.8941 7.8941 7.9924 7.9924 8.6050 8.6050 9.4282 9.4282 11.2947 11.2947 11.3574 11.3574 12.1676 12.1676 13.7143 13.7143 13.7255 13.7255 k = 0.4710 0.4710-0.0000 ( 1442 PWs) bands (ev): -38.4783 -38.4783 -17.5034 -17.5034 -17.0586 -17.0586 -16.8792 -16.8792 7.0504 7.0504 7.3235 7.3235 7.8962 7.8962 7.9946 7.9946 8.5989 8.5989 9.4125 9.4125 11.2575 11.2575 11.3611 11.3611 12.1956 12.1956 13.7076 13.7076 13.7273 13.7273 k = 0.4638 0.4638-0.0000 ( 1444 PWs) bands (ev): -38.4785 -38.4785 -17.5028 -17.5028 -17.0577 -17.0577 -16.8792 -16.8792 7.0519 7.0519 7.3268 7.3268 7.8987 7.8987 7.9973 7.9973 8.5909 8.5909 9.3918 9.3918 11.2149 11.2149 11.3662 11.3662 12.2267 12.2267 13.6992 13.6992 13.7297 13.7297 k = 0.4565 0.4565-0.0000 ( 1440 PWs) bands (ev): -38.4787 -38.4787 -17.5020 -17.5020 -17.0567 -17.0567 -16.8792 -16.8792 7.0534 7.0534 7.3310 7.3310 7.9017 7.9017 8.0004 8.0004 8.5813 8.5813 9.3663 9.3663 11.1694 11.1694 11.3725 11.3725 12.2593 12.2593 13.6889 13.6889 13.7326 13.7326 k = 0.4493 0.4493-0.0000 ( 1430 PWs) bands (ev): -38.4790 -38.4790 -17.5010 -17.5010 -17.0554 -17.0554 -16.8791 -16.8791 7.0549 7.0549 7.3363 7.3363 7.9053 7.9053 8.0043 8.0043 8.5702 8.5702 9.3356 9.3356 11.1233 11.1233 11.3798 11.3798 12.2916 12.2916 13.6771 13.6771 13.7360 13.7360 k = 0.4420 0.4420-0.0000 ( 1430 PWs) bands (ev): -38.4793 -38.4793 -17.5000 -17.5000 -17.0541 -17.0541 -16.8792 -16.8792 7.0557 7.0557 7.3424 7.3424 7.9092 7.9092 8.0087 8.0087 8.5574 8.5574 9.2997 9.2997 11.0782 11.0782 11.3880 11.3880 12.3227 12.3227 13.6637 13.6637 13.7399 13.7399 k = 0.4348 0.4348-0.0000 ( 1430 PWs) bands (ev): -38.4797 -38.4797 -17.4988 -17.4988 -17.0525 -17.0525 -16.8792 -16.8792 7.0558 7.0558 7.3495 7.3495 7.9136 7.9136 8.0135 8.0135 8.5431 8.5431 9.2587 9.2587 11.0355 11.0355 11.3971 11.3971 12.3518 12.3518 13.6489 13.6489 13.7443 13.7443 k = 0.4275 0.4275-0.0000 ( 1426 PWs) bands (ev): -38.4801 -38.4801 -17.4975 -17.4975 -17.0507 -17.0507 -16.8791 -16.8791 7.0548 7.0548 7.3577 7.3577 7.9185 7.9185 8.0190 8.0190 8.5275 8.5275 9.2127 9.2127 10.9963 10.9963 11.4069 11.4069 12.3783 12.3783 13.6329 13.6329 13.7493 13.7493 k = 0.4203 0.4203-0.0000 ( 1430 PWs) bands (ev): -38.4805 -38.4805 -17.4962 -17.4962 -17.0489 -17.0489 -16.8791 -16.8791 7.0524 7.0524 7.3670 7.3670 7.9237 7.9237 8.0248 8.0248 8.5106 8.5106 9.1618 9.1618 10.9615 10.9615 11.4173 11.4173 12.4018 12.4018 13.6158 13.6158 13.7547 13.7547 k = 0.4130 0.4130-0.0000 ( 1432 PWs) bands (ev): -38.4810 -38.4810 -17.4946 -17.4946 -17.0468 -17.0468 -16.8791 -16.8791 7.0483 7.0483 7.3773 7.3773 7.9292 7.9292 8.0312 8.0312 8.4925 8.4925 9.1065 9.1065 10.9315 10.9315 11.4283 11.4283 12.4223 12.4223 13.5978 13.5978 13.7607 13.7607 k = 0.4058 0.4058-0.0000 ( 1432 PWs) bands (ev): -38.4815 -38.4815 -17.4930 -17.4930 -17.0446 -17.0446 -16.8791 -16.8791 7.0421 7.0421 7.3888 7.3888 7.9350 7.9350 8.0378 8.0378 8.4733 8.4733 9.0476 9.0476 10.9069 10.9069 11.4398 11.4398 12.4398 12.4398 13.5790 13.5790 13.7671 13.7671 k = 0.3986 0.3986-0.0000 ( 1432 PWs) bands (ev): -38.4820 -38.4820 -17.4912 -17.4912 -17.0421 -17.0421 -16.8791 -16.8791 7.0334 7.0334 7.4013 7.4013 7.9411 7.9411 8.0449 8.0449 8.4531 8.4531 8.9857 8.9857 10.8877 10.8877 11.4517 11.4517 12.4542 12.4542 13.5596 13.5596 13.7740 13.7740 k = 0.3913 0.3913-0.0000 ( 1432 PWs) bands (ev): -38.4826 -38.4826 -17.4893 -17.4893 -17.0396 -17.0396 -16.8791 -16.8791 7.0218 7.0218 7.4147 7.4147 7.9475 7.9475 8.0521 8.0521 8.4320 8.4320 8.9215 8.9215 10.8740 10.8740 11.4638 11.4638 12.4656 12.4656 13.5397 13.5397 13.7815 13.7815 k = 0.3841 0.3841-0.0000 ( 1428 PWs) bands (ev): -38.4832 -38.4832 -17.4873 -17.4873 -17.0368 -17.0368 -16.8790 -16.8790 7.0069 7.0069 7.4290 7.4290 7.9541 7.9541 8.0594 8.0594 8.4102 8.4102 8.8561 8.8561 10.8656 10.8656 11.4761 11.4761 12.4743 12.4743 13.5197 13.5197 13.7894 13.7894 k = 0.3768 0.3768-0.0000 ( 1428 PWs) bands (ev): -38.4838 -38.4838 -17.4852 -17.4852 -17.0339 -17.0339 -16.8790 -16.8790 6.9884 6.9884 7.4439 7.4439 7.9610 7.9610 8.0666 8.0666 8.3877 8.3877 8.7905 8.7905 10.8625 10.8625 11.4886 11.4886 12.4805 12.4805 13.4996 13.4996 13.7977 13.7977 k = 0.3696 0.3696-0.0000 ( 1428 PWs) bands (ev): -38.4845 -38.4845 -17.4830 -17.4830 -17.0309 -17.0309 -16.8790 -16.8790 6.9658 6.9658 7.4594 7.4594 7.9680 7.9680 8.0735 8.0735 8.3649 8.3649 8.7257 8.7257 10.8645 10.8645 11.5010 11.5010 12.4843 12.4843 13.4796 13.4796 13.8066 13.8066 k = 0.3623 0.3623-0.0000 ( 1428 PWs) bands (ev): -38.4852 -38.4852 -17.4807 -17.4807 -17.0277 -17.0277 -16.8789 -16.8789 6.9388 6.9388 7.4751 7.4751 7.9752 7.9752 8.0798 8.0798 8.3419 8.3419 8.6627 8.6627 10.8711 10.8711 11.5134 11.5134 12.4860 12.4860 13.4600 13.4600 13.8158 13.8158 k = 0.3551 0.3551-0.0000 ( 1428 PWs) bands (ev): -38.4859 -38.4859 -17.4783 -17.4783 -17.0244 -17.0244 -16.8788 -16.8788 6.9070 6.9070 7.4911 7.4911 7.9825 7.9825 8.0850 8.0850 8.3192 8.3192 8.6026 8.6026 10.8824 10.8824 11.5257 11.5257 12.4860 12.4860 13.4409 13.4409 13.8256 13.8256 k = 0.3478 0.3478-0.0000 ( 1432 PWs) bands (ev): -38.4867 -38.4867 -17.4759 -17.4759 -17.0210 -17.0210 -16.8787 -16.8787 6.8701 6.8701 7.5070 7.5070 7.9900 7.9900 8.0884 8.0884 8.2972 8.2972 8.5462 8.5462 10.8979 10.8979 11.5378 11.5378 12.4845 12.4845 13.4224 13.4224 13.8357 13.8357 k = 0.3406 0.3406-0.0000 ( 1432 PWs) bands (ev): -38.4875 -38.4875 -17.4733 -17.4733 -17.0175 -17.0175 -16.8786 -16.8786 6.8279 6.8279 7.5226 7.5226 7.9976 7.9976 8.0894 8.0894 8.2768 8.2768 8.4944 8.4944 10.9176 10.9176 11.5496 11.5496 12.4820 12.4820 13.4049 13.4049 13.8463 13.8463 k = 0.3333 0.3333-0.0000 ( 1436 PWs) bands (ev): -38.4883 -38.4883 -17.4707 -17.4707 -17.0138 -17.0138 -16.8786 -16.8786 6.7803 6.7803 7.5377 7.5377 8.0052 8.0052 8.0869 8.0869 8.2591 8.2591 8.4477 8.4477 10.9409 10.9409 11.5612 11.5612 12.4787 12.4787 13.3883 13.3883 13.8573 13.8573 k = 0.3261 0.3261-0.0000 ( 1428 PWs) bands (ev): -38.4891 -38.4891 -17.4680 -17.4680 -17.0099 -17.0099 -16.8784 -16.8784 6.7274 6.7274 7.5522 7.5522 8.0129 8.0129 8.0801 8.0801 8.2450 8.2450 8.4066 8.4066 10.9678 10.9678 11.5725 11.5725 12.4750 12.4750 13.3730 13.3730 13.8687 13.8687 k = 0.3188 0.3188-0.0000 ( 1428 PWs) bands (ev): -38.4899 -38.4899 -17.4652 -17.4652 -17.0060 -17.0060 -16.8782 -16.8782 6.6691 6.6691 7.5658 7.5658 8.0200 8.0200 8.0690 8.0690 8.2345 8.2345 8.3714 8.3714 10.9980 10.9980 11.5833 11.5833 12.4713 12.4713 13.3591 13.3591 13.8805 13.8805 k = 0.3116 0.3116-0.0000 ( 1428 PWs) bands (ev): -38.4908 -38.4908 -17.4624 -17.4624 -17.0020 -17.0020 -16.8780 -16.8780 6.6059 6.6059 7.5784 7.5784 8.0251 8.0251 8.0558 8.0558 8.2269 8.2269 8.3424 8.3424 11.0310 11.0310 11.5938 11.5938 12.4679 12.4679 13.3468 13.3468 13.8926 13.8926 k = 0.3043 0.3043-0.0000 ( 1428 PWs) bands (ev): -38.4917 -38.4917 -17.4595 -17.4595 -16.9979 -16.9979 -16.8778 -16.8778 6.5382 6.5382 7.5898 7.5898 8.0211 8.0211 8.0486 8.0486 8.2205 8.2205 8.3203 8.3203 11.0667 11.0667 11.6039 11.6039 12.4652 12.4652 13.3361 13.3361 13.9051 13.9051 k = 0.2971 0.2971-0.0000 ( 1428 PWs) bands (ev): -38.4926 -38.4926 -17.4566 -17.4566 -16.9937 -16.9937 -16.8776 -16.8776 6.4663 6.4663 7.5998 7.5998 8.0044 8.0044 8.0524 8.0524 8.2134 8.2134 8.3053 8.3053 11.1047 11.1047 11.6136 11.6136 12.4637 12.4637 13.3272 13.3272 13.9179 13.9179 k = 0.2899 0.2899-0.0000 ( 1424 PWs) bands (ev): -38.4935 -38.4935 -17.4536 -17.4536 -16.9894 -16.9894 -16.8773 -16.8773 6.3910 6.3910 7.6083 7.6083 7.9834 7.9834 8.0596 8.0596 8.2047 8.2047 8.2972 8.2972 11.1445 11.1445 11.6228 11.6228 12.4637 12.4637 13.3204 13.3204 13.9311 13.9311 k = 0.2826 0.2826-0.0000 ( 1424 PWs) bands (ev): -38.4944 -38.4944 -17.4506 -17.4506 -16.9851 -16.9851 -16.8771 -16.8771 6.3124 6.3124 7.6154 7.6154 7.9611 7.9611 8.0677 8.0677 8.1950 8.1950 8.2947 8.2947 11.1858 11.1858 11.6316 11.6316 12.4659 12.4659 13.3156 13.3156 13.9445 13.9445 k = 0.2754 0.2754-0.0000 ( 1424 PWs) bands (ev): -38.4953 -38.4953 -17.4476 -17.4476 -16.9807 -16.9807 -16.8767 -16.8767 6.2315 6.2315 7.6208 7.6208 7.9385 7.9385 8.0762 8.0762 8.1852 8.1852 8.2958 8.2958 11.2281 11.2281 11.6399 11.6399 12.4707 12.4707 13.3130 13.3130 13.9582 13.9582 k = 0.2681 0.2681-0.0000 ( 1424 PWs) bands (ev): -38.4963 -38.4963 -17.4445 -17.4445 -16.9763 -16.9763 -16.8764 -16.8764 6.1486 6.1486 7.6246 7.6246 7.9158 7.9158 8.0849 8.0849 8.1764 8.1764 8.2990 8.2990 11.2708 11.2708 11.6478 11.6478 12.4786 12.4786 13.3128 13.3128 13.9721 13.9721 k = 0.2609 0.2609-0.0000 ( 1422 PWs) bands (ev): -38.4972 -38.4972 -17.4414 -17.4414 -16.9718 -16.9718 -16.8761 -16.8761 6.0643 6.0643 7.6269 7.6269 7.8931 7.8931 8.0936 8.0936 8.1690 8.1690 8.3036 8.3036 11.3134 11.3134 11.6554 11.6554 12.4902 12.4902 13.3149 13.3149 13.9862 13.9862 k = 0.2536 0.2536-0.0000 ( 1422 PWs) bands (ev): -38.4982 -38.4982 -17.4384 -17.4384 -16.9672 -16.9672 -16.8757 -16.8757 5.9790 5.9790 7.6277 7.6277 7.8705 7.8705 8.1024 8.1024 8.1631 8.1631 8.3088 8.3088 11.3553 11.3553 11.6625 11.6625 12.5060 12.5060 13.3195 13.3195 14.0006 14.0006 k = 0.2464 0.2464-0.0000 ( 1422 PWs) bands (ev): -38.4991 -38.4991 -17.4353 -17.4353 -16.9627 -16.9627 -16.8753 -16.8753 5.8932 5.8932 7.6271 7.6271 7.8481 7.8481 8.1111 8.1111 8.1589 8.1589 8.3142 8.3142 11.3959 11.3959 11.6692 11.6692 12.5265 12.5265 13.3266 13.3266 14.0151 14.0151 k = 0.2391 0.2391-0.0000 ( 1422 PWs) bands (ev): -38.5001 -38.5001 -17.4323 -17.4323 -16.9581 -16.9581 -16.8748 -16.8748 5.8073 5.8073 7.6251 7.6251 7.8257 7.8257 8.1198 8.1198 8.1562 8.1562 8.3197 8.3197 11.4347 11.4347 11.6756 11.6756 12.5522 12.5522 13.3362 13.3362 14.0297 14.0297 k = 0.2319 0.2319-0.0000 ( 1420 PWs) bands (ev): -38.5010 -38.5010 -17.4292 -17.4292 -16.9535 -16.9535 -16.8744 -16.8744 5.7217 5.7217 7.6220 7.6220 7.8037 7.8037 8.1284 8.1284 8.1548 8.1548 8.3251 8.3251 11.4711 11.4711 11.6816 11.6816 12.5835 12.5835 13.3485 13.3485 14.0445 14.0445 k = 0.2246 0.2246-0.0000 ( 1420 PWs) bands (ev): -38.5019 -38.5019 -17.4262 -17.4262 -16.9490 -16.9490 -16.8739 -16.8739 5.6366 5.6366 7.6177 7.6177 7.7817 7.7817 8.1368 8.1368 8.1545 8.1545 8.3302 8.3302 11.5048 11.5048 11.6872 11.6872 12.6207 12.6207 13.3634 13.3634 14.0593 14.0593 k = 0.2174 0.2174-0.0000 ( 1420 PWs) bands (ev): -38.5029 -38.5029 -17.4232 -17.4232 -16.9444 -16.9444 -16.8734 -16.8734 5.5524 5.5524 7.6124 7.6124 7.7601 7.7601 8.1450 8.1450 8.1552 8.1552 8.3350 8.3350 11.5354 11.5354 11.6925 11.6925 12.6638 12.6638 13.3809 13.3809 14.0742 14.0742 k = 0.2101 0.2101-0.0000 ( 1426 PWs) bands (ev): -38.5038 -38.5038 -17.4203 -17.4203 -16.9399 -16.9399 -16.8729 -16.8729 5.4693 5.4693 7.6062 7.6062 7.7387 7.7387 8.1529 8.1529 8.1568 8.1568 8.3394 8.3394 11.5628 11.5628 11.6975 11.6975 12.7127 12.7127 13.4010 13.4010 14.0891 14.0891 k = 0.2029 0.2029-0.0000 ( 1422 PWs) bands (ev): -38.5047 -38.5047 -17.4173 -17.4173 -16.9354 -16.9354 -16.8724 -16.8724 5.3876 5.3876 7.5992 7.5992 7.7178 7.7178 8.1585 8.1585 8.1610 8.1610 8.3435 8.3435 11.5872 11.5872 11.7022 11.7022 12.7673 12.7673 13.4237 13.4237 14.1040 14.1040 k = 0.1957 0.1957-0.0000 ( 1426 PWs) bands (ev): -38.5056 -38.5056 -17.4145 -17.4145 -16.9310 -16.9310 -16.8718 -16.8718 5.3074 5.3074 7.5915 7.5915 7.6972 7.6972 8.1613 8.1613 8.1682 8.1682 8.3471 8.3471 11.6085 11.6085 11.7065 11.7065 12.8271 12.8271 13.4489 13.4489 14.1188 14.1188 k = 0.1884 0.1884-0.0000 ( 1426 PWs) bands (ev): -38.5065 -38.5065 -17.4116 -17.4116 -16.9266 -16.9266 -16.8712 -16.8712 5.2289 5.2289 7.5832 7.5832 7.6770 7.6770 8.1643 8.1643 8.1752 8.1752 8.3504 8.3504 11.6271 11.6271 11.7107 11.7107 12.8917 12.8917 13.4766 13.4766 14.1335 14.1335 k = 0.1812 0.1812-0.0000 ( 1426 PWs) bands (ev): -38.5074 -38.5074 -17.4089 -17.4089 -16.9222 -16.9222 -16.8706 -16.8706 5.1524 5.1524 7.5744 7.5744 7.6574 7.6574 8.1676 8.1676 8.1818 8.1818 8.3534 8.3534 11.6432 11.6432 11.7146 11.7146 12.9604 12.9604 13.5067 13.5067 14.1481 14.1481 k = 0.1739 0.1739-0.0000 ( 1418 PWs) bands (ev): -38.5083 -38.5083 -17.4061 -17.4061 -16.9179 -16.9179 -16.8700 -16.8700 5.0779 5.0779 7.5653 7.5653 7.6385 7.6385 8.1711 8.1711 8.1880 8.1880 8.3560 8.3560 11.6571 11.6571 11.7183 11.7183 13.0326 13.0326 13.5391 13.5391 14.1625 14.1625 k = 0.1667 0.1667-0.0000 ( 1418 PWs) bands (ev): -38.5091 -38.5091 -17.4035 -17.4035 -16.9137 -16.9137 -16.8694 -16.8694 5.0056 5.0056 7.5558 7.5558 7.6199 7.6199 8.1747 8.1747 8.1937 8.1937 8.3583 8.3583 11.6691 11.6691 11.7218 11.7218 13.1076 13.1076 13.5736 13.5736 14.1767 14.1767 k = 0.1594 0.1594-0.0000 ( 1418 PWs) bands (ev): -38.5099 -38.5099 -17.4009 -17.4009 -16.9096 -16.9096 -16.8688 -16.8688 4.9357 4.9357 7.5460 7.5460 7.6019 7.6019 8.1784 8.1784 8.1990 8.1990 8.3603 8.3603 11.6795 11.6795 11.7250 11.7250 13.1849 13.1849 13.6102 13.6102 14.1907 14.1907 k = 0.1522 0.1522-0.0000 ( 1420 PWs) bands (ev): -38.5107 -38.5107 -17.3984 -17.3984 -16.9056 -16.9056 -16.8682 -16.8682 4.8682 4.8682 7.5360 7.5360 7.5846 7.5846 8.1821 8.1821 8.2038 8.2038 8.3620 8.3620 11.6886 11.6886 11.7281 11.7281 13.2637 13.2637 13.6487 13.6487 14.2044 14.2044 k = 0.1449 0.1449-0.0000 ( 1420 PWs) bands (ev): -38.5115 -38.5115 -17.3960 -17.3960 -16.9018 -16.9018 -16.8675 -16.8675 4.8032 4.8032 7.5260 7.5260 7.5679 7.5679 8.1857 8.1857 8.2081 8.2081 8.3635 8.3635 11.6966 11.6966 11.7310 11.7310 13.3434 13.3434 13.6889 13.6889 14.2178 14.2178 k = 0.1377 0.1377-0.0000 ( 1420 PWs) bands (ev): -38.5123 -38.5123 -17.3937 -17.3937 -16.8980 -16.8980 -16.8669 -16.8669 4.7409 4.7409 7.5159 7.5159 7.5519 7.5519 8.1894 8.1894 8.2119 8.2119 8.3649 8.3649 11.7036 11.7036 11.7337 11.7337 13.4235 13.4235 13.7306 13.7306 14.2309 14.2309 k = 0.1304 0.1304-0.0000 ( 1416 PWs) bands (ev): -38.5130 -38.5130 -17.3915 -17.3915 -16.8943 -16.8943 -16.8663 -16.8663 4.6813 4.6813 7.5059 7.5059 7.5368 7.5368 8.1929 8.1929 8.2153 8.2153 8.3661 8.3661 11.7099 11.7099 11.7362 11.7362 13.5032 13.5032 13.7736 13.7736 14.2435 14.2435 k = 0.1232 0.1232-0.0000 ( 1416 PWs) bands (ev): -38.5137 -38.5137 -17.3894 -17.3894 -16.8908 -16.8908 -16.8657 -16.8657 4.6245 4.6245 7.4960 7.4960 7.5222 7.5222 8.1963 8.1963 8.2181 8.2181 8.3672 8.3672 11.7155 11.7155 11.7386 11.7386 13.5821 13.5821 13.8176 13.8176 14.2558 14.2558 k = 0.1159 0.1159-0.0000 ( 1416 PWs) bands (ev): -38.5143 -38.5143 -17.3874 -17.3874 -16.8875 -16.8875 -16.8651 -16.8651 4.5706 4.5706 7.4863 7.4863 7.5083 7.5083 8.1996 8.1996 8.2205 8.2205 8.3682 8.3682 11.7207 11.7207 11.7409 11.7409 13.6596 13.6596 13.8625 13.8625 14.2675 14.2675 k = 0.1087 0.1087-0.0000 ( 1412 PWs) bands (ev): -38.5150 -38.5150 -17.3854 -17.3854 -16.8843 -16.8843 -16.8645 -16.8645 4.5197 4.5197 7.4768 7.4768 7.4952 7.4952 8.2028 8.2028 8.2225 8.2225 8.3693 8.3693 11.7254 11.7254 11.7430 11.7430 13.7351 13.7351 13.9078 13.9078 14.2788 14.2788 k = 0.1014 0.1014-0.0000 ( 1410 PWs) bands (ev): -38.5155 -38.5155 -17.3836 -17.3836 -16.8812 -16.8812 -16.8639 -16.8639 4.4718 4.4718 7.4676 7.4676 7.4829 7.4829 8.2057 8.2057 8.2241 8.2241 8.3702 8.3702 11.7296 11.7296 11.7450 11.7450 13.8081 13.8081 13.9533 13.9533 14.2895 14.2895 k = 0.0942 0.0942-0.0000 ( 1410 PWs) bands (ev): -38.5161 -38.5161 -17.3819 -17.3819 -16.8784 -16.8784 -16.8634 -16.8634 4.4270 4.4270 7.4588 7.4588 7.4714 7.4714 8.2085 8.2085 8.2253 8.2253 8.3710 8.3710 11.7335 11.7335 11.7468 11.7468 13.8782 13.8782 13.9986 13.9986 14.2997 14.2997 k = 0.0870 0.0870-0.0000 ( 1408 PWs) bands (ev): -38.5166 -38.5166 -17.3804 -17.3804 -16.8757 -16.8757 -16.8629 -16.8629 4.3852 4.3852 7.4505 7.4505 7.4606 7.4606 8.2111 8.2111 8.2262 8.2262 8.3719 8.3719 11.7372 11.7372 11.7485 11.7485 13.9449 13.9449 14.0433 14.0433 14.3093 14.3093 k = 0.0797 0.0797-0.0000 ( 1408 PWs) bands (ev): -38.5171 -38.5171 -17.3789 -17.3789 -16.8732 -16.8732 -16.8624 -16.8624 4.3467 4.3467 7.4426 7.4426 7.4507 7.4507 8.2135 8.2135 8.2268 8.2268 8.3727 8.3727 11.7405 11.7405 11.7500 11.7501 14.0077 14.0077 14.0872 14.0872 14.3183 14.3183 k = 0.0725 0.0725-0.0000 ( 1400 PWs) bands (ev): -38.5176 -38.5176 -17.3775 -17.3775 -16.8709 -16.8709 -16.8619 -16.8619 4.3114 4.3114 7.4352 7.4352 7.4416 7.4416 8.2157 8.2157 8.2272 8.2272 8.3735 8.3735 11.7436 11.7436 11.7516 11.7516 14.0661 14.0661 14.1296 14.1296 14.3267 14.3267 k = 0.0652 0.0652-0.0000 ( 1394 PWs) bands (ev): -38.5180 -38.5180 -17.3763 -17.3763 -16.8687 -16.8687 -16.8615 -16.8615 4.2793 4.2793 7.4284 7.4284 7.4334 7.4334 8.2178 8.2178 8.2275 8.2275 8.3743 8.3743 11.7464 11.7464 11.7530 11.7530 14.1200 14.1200 14.1702 14.1702 14.3344 14.3344 k = 0.0580 0.0580-0.0000 ( 1390 PWs) bands (ev): -38.5183 -38.5183 -17.3752 -17.3752 -16.8668 -16.8668 -16.8611 -16.8611 4.2505 4.2505 7.4222 7.4222 7.4259 7.4259 8.2196 8.2196 8.2276 8.2276 8.3751 8.3751 11.7489 11.7489 11.7542 11.7542 14.1687 14.1687 14.2084 14.2084 14.3415 14.3415 k = 0.0507 0.0507-0.0000 ( 1391 PWs) bands (ev): -38.5186 -38.5186 -17.3742 -17.3742 -16.8651 -16.8651 -16.8607 -16.8607 4.2250 4.2250 7.4166 7.4166 7.4194 7.4194 8.2212 8.2212 8.2275 8.2275 8.3757 8.3757 11.7511 11.7511 11.7552 11.7552 14.2122 14.2122 14.2438 14.2438 14.3480 14.3480 k = 0.0435 0.0435-0.0000 ( 1387 PWs) bands (ev): -38.5189 -38.5189 -17.3733 -17.3733 -16.8637 -16.8637 -16.8604 -16.8604 4.2029 4.2029 7.4118 7.4118 7.4137 7.4137 8.2226 8.2226 8.2273 8.2273 8.3762 8.3762 11.7531 11.7531 11.7561 11.7561 14.2501 14.2501 14.2757 14.2757 14.3540 14.3540 k = 0.0362 0.0362-0.0000 ( 1387 PWs) bands (ev): -38.5192 -38.5192 -17.3726 -17.3726 -16.8624 -16.8624 -16.8601 -16.8601 4.1841 4.1841 7.4077 7.4077 7.4088 7.4088 8.2238 8.2238 8.2271 8.2271 8.3767 8.3767 11.7547 11.7547 11.7568 11.7568 14.2823 14.2823 14.3033 14.3033 14.3597 14.3597 k = 0.0290 0.0290-0.0000 ( 1387 PWs) bands (ev): -38.5194 -38.5194 -17.3720 -17.3720 -16.8614 -16.8614 -16.8599 -16.8599 4.1687 4.1687 7.4042 7.4042 7.4049 7.4049 8.2248 8.2248 8.2269 8.2269 8.3771 8.3771 11.7561 11.7561 11.7574 11.7574 14.3088 14.3088 14.3255 14.3255 14.3655 14.3655 k = 0.0217 0.0217-0.0000 ( 1387 PWs) bands (ev): -38.5195 -38.5195 -17.3716 -17.3716 -16.8606 -16.8606 -16.8598 -16.8598 4.1568 4.1568 7.4015 7.4015 7.4018 7.4018 8.2255 8.2255 8.2267 8.2267 8.3774 8.3774 11.7572 11.7572 11.7579 11.7579 14.3294 14.3294 14.3413 14.3413 14.3721 14.3721 k = 0.0145 0.0145-0.0000 ( 1383 PWs) bands (ev): -38.5196 -38.5196 -17.3712 -17.3712 -16.8600 -16.8600 -16.8596 -16.8596 4.1482 4.1482 7.3996 7.3996 7.3997 7.3997 8.2260 8.2260 8.2266 8.2266 8.3777 8.3777 11.7579 11.7579 11.7583 11.7583 14.3443 14.3443 14.3505 14.3505 14.3792 14.3792 k = 0.0072 0.0072-0.0000 ( 1375 PWs) bands (ev): -38.5197 -38.5197 -17.3710 -17.3710 -16.8596 -16.8596 -16.8595 -16.8595 4.1431 4.1431 7.3984 7.3984 7.3986 7.3986 8.2264 8.2264 8.2265 8.2265 8.3779 8.3779 11.7584 11.7584 11.7585 11.7585 14.3532 14.3532 14.3549 14.3549 14.3847 14.3847 k = 0.0000 0.0000 0.0000 ( 1365 PWs) bands (ev): -38.5197 -38.5197 -17.3708 -17.3708 -16.8594 -16.8594 -16.8594 -16.8594 4.1413 4.1413 7.3984 7.3984 7.3984 7.3984 8.2265 8.2265 8.2265 8.2265 8.3779 8.3779 11.7586 11.7586 11.7586 11.7586 14.3562 14.3562 14.3562 14.3562 14.3868 14.3868 k = 0.0000 0.0000 0.0000 ( 1365 PWs) bands (ev): -38.5197 -38.5197 -17.3708 -17.3708 -16.8594 -16.8594 -16.8594 -16.8594 4.1413 4.1413 7.3984 7.3984 7.3984 7.3984 8.2265 8.2265 8.2265 8.2265 8.3779 8.3779 11.7586 11.7586 11.7586 11.7586 14.3562 14.3562 14.3562 14.3562 14.3868 14.3868 k = 0.0060 0.0060 0.0060 ( 1371 PWs) bands (ev): -38.5197 -38.5197 -17.3710 -17.3710 -16.8596 -16.8596 -16.8595 -16.8595 4.1431 4.1431 7.3987 7.3987 7.3987 7.3987 8.2264 8.2264 8.2265 8.2265 8.3779 8.3779 11.7585 11.7585 11.7585 11.7585 14.3532 14.3532 14.3549 14.3549 14.3847 14.3847 k = 0.0119 0.0119 0.0119 ( 1386 PWs) bands (ev): -38.5196 -38.5196 -17.3712 -17.3712 -16.8599 -16.8599 -16.8598 -16.8598 4.1483 4.1483 7.3995 7.3995 7.3996 7.3996 8.2260 8.2260 8.2266 8.2266 8.3777 8.3777 11.7581 11.7581 11.7581 11.7581 14.3438 14.3438 14.3510 14.3510 14.3788 14.3788 k = 0.0179 0.0179 0.0179 ( 1386 PWs) bands (ev): -38.5195 -38.5195 -17.3716 -17.3716 -16.8603 -16.8603 -16.8601 -16.8601 4.1570 4.1570 7.4015 7.4015 7.4018 7.4018 8.2255 8.2255 8.2267 8.2267 8.3774 8.3774 11.7575 11.7575 11.7576 11.7576 14.3274 14.3274 14.3445 14.3445 14.3702 14.3702 k = 0.0238 0.0238 0.0238 ( 1386 PWs) bands (ev): -38.5194 -38.5194 -17.3720 -17.3720 -16.8608 -16.8608 -16.8606 -16.8606 4.1691 4.1691 7.4044 7.4044 7.4049 7.4049 8.2247 8.2247 8.2269 8.2269 8.3771 8.3771 11.7567 11.7567 11.7569 11.7569 14.3037 14.3037 14.3355 14.3355 14.3592 14.3592 k = 0.0298 0.0298 0.0298 ( 1386 PWs) bands (ev): -38.5192 -38.5192 -17.3726 -17.3726 -16.8615 -16.8615 -16.8611 -16.8611 4.1846 4.1846 7.4080 7.4080 7.4088 7.4088 8.2238 8.2238 8.2271 8.2271 8.3767 8.3767 11.7558 11.7558 11.7560 11.7560 14.2729 14.2729 14.3239 14.3239 14.3460 14.3460 k = 0.0357 0.0357 0.0357 ( 1386 PWs) bands (ev): -38.5189 -38.5189 -17.3733 -17.3733 -16.8623 -16.8623 -16.8618 -16.8618 4.2036 4.2036 7.4124 7.4124 7.4135 7.4135 8.2226 8.2226 8.2272 8.2272 8.3762 8.3762 11.7547 11.7547 11.7550 11.7550 14.2356 14.2356 14.3098 14.3098 14.3305 14.3305 k = 0.0417 0.0417 0.0417 ( 1385 PWs) bands (ev): -38.5186 -38.5186 -17.3742 -17.3742 -16.8633 -16.8633 -16.8627 -16.8627 4.2260 4.2260 7.4176 7.4176 7.4191 7.4191 8.2212 8.2212 8.2273 8.2273 8.3756 8.3756 11.7534 11.7534 11.7538 11.7538 14.1923 14.1923 14.2932 14.2932 14.3127 14.3127 k = 0.0476 0.0476 0.0476 ( 1391 PWs) bands (ev): -38.5183 -38.5183 -17.3752 -17.3752 -16.8645 -16.8645 -16.8636 -16.8636 4.2518 4.2518 7.4235 7.4235 7.4255 7.4255 8.2196 8.2196 8.2271 8.2271 8.3749 8.3749 11.7520 11.7520 11.7526 11.7526 14.1438 14.1438 14.2742 14.2742 14.2924 14.2924 k = 0.0536 0.0536 0.0536 ( 1397 PWs) bands (ev): -38.5179 -38.5179 -17.3763 -17.3763 -16.8657 -16.8657 -16.8647 -16.8647 4.2809 4.2809 7.4300 7.4300 7.4326 7.4326 8.2178 8.2178 8.2269 8.2269 8.3741 8.3741 11.7506 11.7506 11.7513 11.7513 14.0906 14.0906 14.2528 14.2528 14.2697 14.2697 k = 0.0595 0.0595 0.0595 ( 1400 PWs) bands (ev): -38.5175 -38.5175 -17.3776 -17.3776 -16.8672 -16.8672 -16.8659 -16.8659 4.3134 4.3134 7.4374 7.4374 7.4405 7.4405 8.2157 8.2157 8.2265 8.2265 8.3733 8.3733 11.7492 11.7492 11.7500 11.7500 14.0334 14.0334 14.2290 14.2290 14.2447 14.2447 k = 0.0655 0.0655 0.0655 ( 1400 PWs) bands (ev): -38.5171 -38.5171 -17.3789 -17.3789 -16.8687 -16.8687 -16.8672 -16.8672 4.3491 4.3491 7.4455 7.4455 7.4492 7.4492 8.2134 8.2134 8.2259 8.2259 8.3724 8.3724 11.7477 11.7477 11.7487 11.7487 13.9728 13.9728 14.2029 14.2029 14.2173 14.2173 k = 0.0714 0.0714 0.0714 ( 1406 PWs) bands (ev): -38.5166 -38.5166 -17.3804 -17.3804 -16.8704 -16.8704 -16.8687 -16.8687 4.3881 4.3881 7.4542 7.4542 7.4587 7.4587 8.2109 8.2109 8.2250 8.2250 8.3714 8.3714 11.7462 11.7462 11.7473 11.7473 13.9095 13.9095 14.1745 14.1745 14.1877 14.1877 k = 0.0774 0.0774 0.0774 ( 1406 PWs) bands (ev): -38.5160 -38.5160 -17.3819 -17.3819 -16.8722 -16.8722 -16.8702 -16.8702 4.4303 4.4303 7.4635 7.4635 7.4689 7.4689 8.2082 8.2082 8.2237 8.2237 8.3703 8.3703 11.7450 11.7450 11.7463 11.7463 13.8439 13.8439 14.1440 14.1440 14.1559 14.1559 k = 0.0833 0.0833 0.0833 ( 1406 PWs) bands (ev): -38.5155 -38.5155 -17.3836 -17.3836 -16.8741 -16.8741 -16.8719 -16.8719 4.4756 4.4756 7.4734 7.4734 7.4797 7.4797 8.2052 8.2052 8.2220 8.2220 8.3691 8.3691 11.7439 11.7439 11.7454 11.7454 13.7768 13.7768 14.1115 14.1115 14.1219 14.1219 k = 0.0893 0.0893 0.0893 ( 1406 PWs) bands (ev): -38.5148 -38.5148 -17.3854 -17.3854 -16.8761 -16.8761 -16.8736 -16.8736 4.5241 4.5241 7.4840 7.4840 7.4912 7.4912 8.2021 8.2021 8.2199 8.2199 8.3678 8.3678 11.7431 11.7431 11.7446 11.7446 13.7087 13.7087 14.0769 14.0769 14.0860 14.0860 k = 0.0952 0.0952 0.0952 ( 1418 PWs) bands (ev): -38.5142 -38.5142 -17.3873 -17.3873 -16.8783 -16.8783 -16.8756 -16.8756 4.5756 4.5756 7.4950 7.4950 7.5033 7.5033 8.1985 8.1985 8.2173 8.2173 8.3661 8.3661 11.7422 11.7422 11.7440 11.7440 13.6402 13.6402 14.0405 14.0405 14.0482 14.0482 k = 0.1012 0.1012 0.1012 ( 1421 PWs) bands (ev): -38.5135 -38.5135 -17.3893 -17.3893 -16.8806 -16.8806 -16.8775 -16.8775 4.6301 4.6301 7.5066 7.5066 7.5160 7.5160 8.1950 8.1950 8.2142 8.2142 8.3643 8.3643 11.7419 11.7419 11.7437 11.7437 13.5718 13.5718 14.0023 14.0023 14.0086 14.0086 k = 0.1071 0.1071 0.1071 ( 1421 PWs) bands (ev): -38.5128 -38.5128 -17.3914 -17.3914 -16.8829 -16.8829 -16.8796 -16.8796 4.6876 4.6876 7.5186 7.5186 7.5292 7.5292 8.1912 8.1912 8.2107 8.2107 8.3622 8.3622 11.7418 11.7418 11.7437 11.7437 13.5041 13.5041 13.9624 13.9624 13.9673 13.9673 k = 0.1131 0.1131 0.1131 ( 1418 PWs) bands (ev): -38.5120 -38.5120 -17.3936 -17.3936 -16.8853 -16.8853 -16.8817 -16.8817 4.7479 4.7479 7.5310 7.5310 7.5430 7.5430 8.1873 8.1873 8.2067 8.2067 8.3598 8.3598 11.7420 11.7420 11.7441 11.7441 13.4375 13.4375 13.9210 13.9210 13.9246 13.9246 k = 0.1190 0.1190 0.1190 ( 1424 PWs) bands (ev): -38.5112 -38.5112 -17.3958 -17.3958 -16.8879 -16.8879 -16.8840 -16.8840 4.8111 4.8111 7.5438 7.5438 7.5571 7.5571 8.1831 8.1831 8.2021 8.2021 8.3569 8.3569 11.7426 11.7426 11.7447 11.7447 13.3724 13.3724 13.8783 13.8783 13.8805 13.8805 k = 0.1250 0.1250 0.1250 ( 1424 PWs) bands (ev): -38.5104 -38.5104 -17.3982 -17.3982 -16.8905 -16.8905 -16.8863 -16.8863 4.8770 4.8770 7.5569 7.5569 7.5718 7.5718 8.1787 8.1787 8.1970 8.1970 8.3535 8.3535 11.7435 11.7435 11.7456 11.7456 13.3094 13.3094 13.8343 13.8343 13.8352 13.8352 k = 0.1310 0.1310 0.1310 ( 1424 PWs) bands (ev): -38.5096 -38.5096 -17.4006 -17.4006 -16.8932 -16.8932 -16.8888 -16.8888 4.9455 4.9455 7.5704 7.5704 7.5869 7.5869 8.1742 8.1742 8.1914 8.1914 8.3495 8.3495 11.7446 11.7446 11.7467 11.7467 13.2488 13.2488 13.7890 13.7890 13.7893 13.7893 k = 0.1369 0.1369 0.1369 ( 1424 PWs) bands (ev): -38.5087 -38.5087 -17.4031 -17.4031 -16.8960 -16.8960 -16.8913 -16.8913 5.0167 5.0167 7.5842 7.5842 7.6024 7.6024 8.1695 8.1695 8.1853 8.1853 8.3449 8.3449 11.7461 11.7461 11.7481 11.7481 13.1910 13.1910 13.7419 13.7419 13.7435 13.7435 k = 0.1429 0.1429 0.1429 ( 1418 PWs) bands (ev): -38.5078 -38.5078 -17.4056 -17.4056 -16.8988 -16.8988 -16.8938 -16.8938 5.0903 5.0903 7.5981 7.5981 7.6181 7.6181 8.1648 8.1648 8.1788 8.1788 8.3398 8.3398 11.7478 11.7478 11.7497 11.7497 13.1364 13.1364 13.6943 13.6943 13.6971 13.6971 k = 0.1488 0.1488 0.1488 ( 1424 PWs) bands (ev): -38.5068 -38.5068 -17.4082 -17.4082 -16.9017 -16.9017 -16.8965 -16.8965 5.1664 5.1664 7.6122 7.6122 7.6342 7.6342 8.1597 8.1597 8.1716 8.1716 8.3337 8.3337 11.7496 11.7496 11.7512 11.7512 13.0852 13.0852 13.6464 13.6464 13.6502 13.6502 k = 0.1548 0.1548 0.1548 ( 1430 PWs) bands (ev): -38.5059 -38.5059 -17.4110 -17.4110 -16.9046 -16.9046 -16.8993 -16.8993 5.2447 5.2447 7.6262 7.6262 7.6503 7.6503 8.1547 8.1547 8.1642 8.1642 8.3269 8.3269 11.7514 11.7514 11.7528 11.7528 13.0379 13.0379 13.5984 13.5984 13.6032 13.6032 k = 0.1607 0.1607 0.1607 ( 1436 PWs) bands (ev): -38.5049 -38.5049 -17.4137 -17.4137 -16.9077 -16.9077 -16.9021 -16.9021 5.3253 5.3253 7.6405 7.6405 7.6667 7.6667 8.1496 8.1496 8.1562 8.1562 8.3192 8.3192 11.7531 11.7531 11.7541 11.7541 12.9947 12.9947 13.5507 13.5507 13.5564 13.5564 k = 0.1667 0.1667 0.1667 ( 1436 PWs) bands (ev): -38.5039 -38.5039 -17.4165 -17.4165 -16.9107 -16.9107 -16.9050 -16.9050 5.4080 5.4080 7.6547 7.6547 7.6832 7.6832 8.1446 8.1446 8.1480 8.1480 8.3108 8.3108 11.7546 11.7546 11.7552 11.7552 12.9558 12.9558 13.5035 13.5035 13.5101 13.5101 k = 0.1726 0.1726 0.1726 ( 1436 PWs) bands (ev): -38.5029 -38.5029 -17.4193 -17.4193 -16.9138 -16.9138 -16.9079 -16.9079 5.4927 5.4927 7.6689 7.6689 7.6998 7.6998 8.1394 8.1394 8.1396 8.1396 8.3015 8.3015 11.7556 11.7556 11.7557 11.7557 12.9215 12.9215 13.4573 13.4573 13.4646 13.4646 k = 0.1786 0.1786 0.1786 ( 1424 PWs) bands (ev): -38.5018 -38.5018 -17.4221 -17.4221 -16.9168 -16.9168 -16.9108 -16.9108 5.5793 5.5793 7.6829 7.6829 7.7165 7.7165 8.1307 8.1307 8.1348 8.1348 8.2916 8.2916 11.7555 11.7555 11.7561 11.7561 12.8920 12.8920 13.4124 13.4124 13.4202 13.4202 k = 0.1845 0.1845 0.1845 ( 1424 PWs) bands (ev): -38.5008 -38.5008 -17.4250 -17.4250 -16.9200 -16.9200 -16.9138 -16.9138 5.6678 5.6678 7.6968 7.6968 7.7331 7.7331 8.1217 8.1217 8.1300 8.1300 8.2807 8.2807 11.7541 11.7541 11.7555 11.7555 12.8674 12.8674 13.3693 13.3693 13.3775 13.3775 k = 0.1905 0.1905 0.1905 ( 1424 PWs) bands (ev): -38.4997 -38.4997 -17.4280 -17.4280 -16.9231 -16.9231 -16.9169 -16.9169 5.7579 5.7579 7.7103 7.7103 7.7495 7.7495 8.1124 8.1124 8.1254 8.1254 8.2692 8.2692 11.7514 11.7514 11.7537 11.7537 12.8478 12.8478 13.3283 13.3283 13.3368 13.3368 k = 0.1964 0.1964 0.1964 ( 1430 PWs) bands (ev): -38.4986 -38.4986 -17.4310 -17.4310 -16.9264 -16.9264 -16.9200 -16.9200 5.8495 5.8495 7.7235 7.7235 7.7656 7.7656 8.1031 8.1031 8.1210 8.1210 8.2568 8.2568 11.7469 11.7469 11.7502 11.7502 12.8334 12.8334 13.2899 13.2899 13.2986 13.2986 k = 0.2024 0.2024 0.2024 ( 1430 PWs) bands (ev): -38.4975 -38.4975 -17.4340 -17.4340 -16.9296 -16.9296 -16.9231 -16.9231 5.9425 5.9425 7.7363 7.7363 7.7814 7.7814 8.0938 8.0938 8.1171 8.1171 8.2439 8.2439 11.7403 11.7403 11.7448 11.7448 12.8243 12.8243 13.2547 13.2547 13.2634 13.2634 k = 0.2083 0.2083 0.2083 ( 1430 PWs) bands (ev): -38.4964 -38.4964 -17.4370 -17.4370 -16.9328 -16.9328 -16.9263 -16.9263 6.0369 6.0369 7.7485 7.7485 7.7967 7.7967 8.0848 8.0848 8.1136 8.1136 8.2306 8.2306 11.7313 11.7313 11.7371 11.7371 12.8205 12.8205 13.2232 13.2232 13.2318 13.2318 k = 0.2143 0.2143 0.2143 ( 1424 PWs) bands (ev): -38.4953 -38.4953 -17.4400 -17.4400 -16.9359 -16.9359 -16.9294 -16.9294 6.1323 6.1323 7.7601 7.7601 7.8114 7.8114 8.0761 8.0761 8.1107 8.1107 8.2169 8.2169 11.7195 11.7195 11.7266 11.7266 12.8222 12.8222 13.1958 13.1958 13.2041 13.2041 k = 0.2202 0.2202 0.2202 ( 1430 PWs) bands (ev): -38.4941 -38.4941 -17.4430 -17.4430 -16.9392 -16.9392 -16.9326 -16.9326 6.2287 6.2287 7.7710 7.7710 7.8250 7.8250 8.0679 8.0679 8.1084 8.1084 8.2029 8.2029 11.7044 11.7044 11.7131 11.7131 12.8292 12.8292 13.1729 13.1729 13.1809 13.1809 k = 0.2262 0.2262 0.2262 ( 1433 PWs) bands (ev): -38.4930 -38.4930 -17.4461 -17.4461 -16.9424 -16.9424 -16.9359 -16.9359 6.3260 6.3260 7.7809 7.7809 7.8375 7.8375 8.0607 8.0607 8.1068 8.1068 8.1888 8.1888 11.6859 11.6859 11.6962 11.6962 12.8417 12.8417 13.1549 13.1549 13.1624 13.1624 k = 0.2321 0.2321 0.2321 ( 1433 PWs) bands (ev): -38.4918 -38.4918 -17.4491 -17.4491 -16.9456 -16.9456 -16.9391 -16.9391 6.4239 6.4239 7.7900 7.7900 7.8484 7.8484 8.0548 8.0548 8.1062 8.1062 8.1748 8.1748 11.6638 11.6638 11.6757 11.6757 12.8597 12.8597 13.1422 13.1422 13.1492 13.1492 k = 0.2381 0.2381 0.2381 ( 1442 PWs) bands (ev): -38.4907 -38.4907 -17.4522 -17.4522 -16.9489 -16.9489 -16.9424 -16.9424 6.5222 6.5222 7.7979 7.7979 7.8574 7.8574 8.0505 8.0505 8.1065 8.1065 8.1609 8.1609 11.6378 11.6378 11.6514 11.6514 12.8831 12.8831 13.1349 13.1349 13.1413 13.1413 k = 0.2440 0.2440 0.2440 ( 1442 PWs) bands (ev): -38.4895 -38.4895 -17.4552 -17.4552 -16.9520 -16.9520 -16.9456 -16.9456 6.6209 6.6209 7.8049 7.8049 7.8642 7.8642 8.0483 8.0483 8.1080 8.1080 8.1474 8.1474 11.6080 11.6080 11.6233 11.6233 12.9119 12.9119 13.1332 13.1332 13.1390 13.1390 k = 0.2500 0.2500 0.2500 ( 1442 PWs) bands (ev): -38.4884 -38.4884 -17.4582 -17.4582 -16.9552 -16.9552 -16.9489 -16.9489 6.7196 6.7196 7.8106 7.8106 7.8685 7.8685 8.0483 8.0483 8.1105 8.1105 8.1345 8.1345 11.5745 11.5745 11.5914 11.5914 12.9460 12.9460 13.1370 13.1370 13.1422 13.1422 k = 0.2560 0.2560 0.2560 ( 1442 PWs) bands (ev): -38.4872 -38.4872 -17.4613 -17.4613 -16.9583 -16.9583 -16.9521 -16.9521 6.8180 6.8180 7.8152 7.8152 7.8705 7.8705 8.0503 8.0503 8.1143 8.1143 8.1227 8.1227 11.5374 11.5374 11.5558 11.5558 12.9855 12.9855 13.1463 13.1463 13.1510 13.1510 k = 0.2619 0.2619 0.2619 ( 1439 PWs) bands (ev): -38.4861 -38.4861 -17.4642 -17.4642 -16.9614 -16.9614 -16.9553 -16.9553 6.9159 6.9159 7.8186 7.8186 7.8704 7.8704 8.0537 8.0537 8.1128 8.1128 8.1194 8.1194 11.4969 11.4969 11.5168 11.5168 13.0303 13.0303 13.1609 13.1609 13.1651 13.1651 k = 0.2679 0.2679 0.2679 ( 1439 PWs) bands (ev): -38.4849 -38.4849 -17.4672 -17.4672 -16.9644 -16.9644 -16.9585 -16.9585 7.0128 7.0128 7.8208 7.8208 7.8689 7.8689 8.0565 8.0565 8.1062 8.1062 8.1255 8.1255 11.4533 11.4533 11.4746 11.4746 13.0802 13.0802 13.1807 13.1807 13.1843 13.1843 k = 0.2738 0.2738 0.2738 ( 1439 PWs) bands (ev): -38.4838 -38.4838 -17.4701 -17.4701 -16.9675 -16.9675 -16.9617 -16.9617 7.1082 7.1082 7.8219 7.8219 7.8667 7.8667 8.0563 8.0563 8.1051 8.1051 8.1329 8.1329 11.4069 11.4069 11.4295 11.4295 13.1351 13.1351 13.2053 13.2053 13.2083 13.2083 k = 0.2798 0.2798 0.2798 ( 1439 PWs) bands (ev): -38.4827 -38.4827 -17.4730 -17.4730 -16.9705 -16.9705 -16.9648 -16.9648 7.2015 7.2015 7.8221 7.8221 7.8650 7.8650 8.0521 8.0521 8.1102 8.1102 8.1414 8.1414 11.3581 11.3581 11.3819 11.3819 13.1947 13.1947 13.2350 13.2350 13.2369 13.2369 k = 0.2857 0.2857 0.2857 ( 1439 PWs) bands (ev): -38.4815 -38.4815 -17.4759 -17.4759 -16.9734 -16.9734 -16.9680 -16.9680 7.2915 7.2915 7.8214 7.8214 7.8648 7.8648 8.0456 8.0456 8.1199 8.1199 8.1508 8.1508 11.3072 11.3072 11.3321 11.3321 13.2551 13.2551 13.2697 13.2697 13.2730 13.2730 k = 0.2917 0.2917 0.2917 ( 1439 PWs) bands (ev): -38.4804 -38.4804 -17.4787 -17.4787 -16.9763 -16.9763 -16.9711 -16.9711 7.3767 7.3767 7.8199 7.8199 7.8677 7.8677 8.0387 8.0387 8.1321 8.1321 8.1612 8.1612 11.2545 11.2545 11.2803 11.2803 13.3004 13.3004 13.3065 13.3065 13.3351 13.3351 k = 0.2976 0.2976 0.2976 ( 1439 PWs) bands (ev): -38.4793 -38.4793 -17.4816 -17.4816 -16.9792 -16.9792 -16.9741 -16.9741 7.4547 7.4547 7.8177 7.8177 7.8755 7.8755 8.0329 8.0329 8.1459 8.1459 8.1724 8.1724 11.2003 11.2003 11.2270 11.2270 13.3420 13.3420 13.3469 13.3469 13.4094 13.4094 k = 0.3036 0.3036 0.3036 ( 1439 PWs) bands (ev): -38.4782 -38.4782 -17.4843 -17.4843 -16.9820 -16.9820 -16.9771 -16.9771 7.5223 7.5223 7.8150 7.8150 7.8901 7.8901 8.0301 8.0301 8.1607 8.1607 8.1843 8.1843 11.1448 11.1448 11.1723 11.1723 13.3861 13.3861 13.3907 13.3907 13.4894 13.4894 k = 0.3095 0.3095 0.3095 ( 1445 PWs) bands (ev): -38.4772 -38.4772 -17.4871 -17.4871 -16.9848 -16.9848 -16.9801 -16.9801 7.5758 7.5758 7.8119 7.8119 7.9113 7.9113 8.0340 8.0340 8.1764 8.1764 8.1969 8.1969 11.0884 11.0884 11.1166 11.1166 13.4330 13.4330 13.4375 13.4375 13.5744 13.5744 k = 0.3155 0.3155 0.3155 ( 1445 PWs) bands (ev): -38.4761 -38.4761 -17.4897 -17.4897 -16.9875 -16.9875 -16.9830 -16.9830 7.6142 7.6142 7.8084 7.8084 7.9325 7.9325 8.0528 8.0528 8.1928 8.1928 8.2101 8.2101 11.0313 11.0313 11.0602 11.0602 13.4827 13.4827 13.4872 13.4872 13.6644 13.6644 k = 0.3214 0.3214 0.3214 ( 1445 PWs) bands (ev): -38.4751 -38.4751 -17.4924 -17.4924 -16.9902 -16.9902 -16.9859 -16.9859 7.6390 7.6390 7.8046 7.8046 7.9446 7.9446 8.0937 8.0937 8.2102 8.2102 8.2238 8.2238 10.9738 10.9738 11.0032 11.0032 13.5348 13.5348 13.5394 13.5394 13.7590 13.7590 k = 0.3274 0.3274 0.3274 ( 1442 PWs) bands (ev): -38.4741 -38.4741 -17.4949 -17.4949 -16.9928 -16.9928 -16.9887 -16.9887 7.6539 7.6539 7.8007 7.8007 7.9475 7.9475 8.1515 8.1515 8.2298 8.2298 8.2380 8.2380 10.9160 10.9160 10.9459 10.9459 13.5893 13.5893 13.5941 13.5941 13.8583 13.8583 k = 0.3333 0.3333 0.3333 ( 1436 PWs) bands (ev): -38.4731 -38.4731 -17.4974 -17.4974 -16.9952 -16.9952 -16.9914 -16.9914 7.6626 7.6626 7.7967 7.7967 7.9456 7.9456 8.2111 8.2111 8.2527 8.2527 8.2591 8.2591 10.8581 10.8581 10.8884 10.8884 13.6458 13.6458 13.6508 13.6508 13.9622 13.9622 k = 0.3393 0.3393 0.3393 ( 1436 PWs) bands (ev): -38.4721 -38.4721 -17.4998 -17.4998 -16.9977 -16.9977 -16.9941 -16.9941 7.6675 7.6675 7.7925 7.7925 7.9417 7.9417 8.2465 8.2465 8.2677 8.2677 8.3183 8.3183 10.8002 10.8002 10.8309 10.8309 13.7043 13.7043 13.7094 13.7094 14.0705 14.0705 k = 0.3452 0.3452 0.3452 ( 1442 PWs) bands (ev): -38.4711 -38.4711 -17.5022 -17.5022 -17.0001 -17.0001 -16.9968 -16.9968 7.6704 7.6704 7.7883 7.7883 7.9369 7.9369 8.2679 8.2679 8.2829 8.2829 8.3944 8.3944 10.7426 10.7426 10.7736 10.7736 13.7644 13.7644 13.7697 13.7697 14.1832 14.1832 k = 0.3512 0.3512 0.3512 ( 1442 PWs) bands (ev): -38.4702 -38.4702 -17.5045 -17.5045 -17.0025 -17.0025 -16.9993 -16.9993 7.6721 7.6721 7.7841 7.7841 7.9319 7.9319 8.2866 8.2866 8.2986 8.2986 8.4744 8.4744 10.6854 10.6854 10.7167 10.7167 13.8260 13.8260 13.8315 13.8315 14.3001 14.3001 k = 0.3571 0.3571 0.3571 ( 1442 PWs) bands (ev): -38.4693 -38.4693 -17.5068 -17.5068 -17.0047 -17.0047 -17.0018 -17.0018 7.6733 7.6733 7.7800 7.7800 7.9269 7.9269 8.3047 8.3047 8.3145 8.3145 8.5552 8.5552 10.6287 10.6287 10.6602 10.6602 13.8890 13.8890 13.8947 13.8947 14.4210 14.4210 k = 0.3631 0.3631 0.3631 ( 1442 PWs) bands (ev): -38.4684 -38.4684 -17.5090 -17.5090 -17.0069 -17.0069 -17.0042 -17.0042 7.6744 7.6744 7.7760 7.7760 7.9220 7.9220 8.3226 8.3226 8.3307 8.3307 8.6359 8.6359 10.5727 10.5727 10.6044 10.6044 13.9531 13.9531 13.9589 13.9589 14.5460 14.5460 k = 0.3690 0.3690 0.3690 ( 1442 PWs) bands (ev): -38.4676 -38.4676 -17.5111 -17.5111 -17.0090 -17.0090 -17.0065 -17.0065 7.6756 7.6756 7.7720 7.7720 7.9175 7.9175 8.3404 8.3404 8.3471 8.3471 8.7158 8.7158 10.5176 10.5176 10.5494 10.5494 14.0181 14.0181 14.0240 14.0240 14.6748 14.6748 k = 0.3750 0.3750 0.3750 ( 1436 PWs) bands (ev): -38.4668 -38.4668 -17.5131 -17.5131 -17.0110 -17.0110 -17.0087 -17.0087 7.6771 7.6771 7.7683 7.7683 7.9133 7.9133 8.3582 8.3582 8.3638 8.3638 8.7946 8.7946 10.4634 10.4634 10.4953 10.4953 14.0838 14.0838 14.0898 14.0898 14.8072 14.8072 k = 0.3810 0.3810 0.3810 ( 1436 PWs) bands (ev): -38.4660 -38.4660 -17.5150 -17.5150 -17.0130 -17.0130 -17.0109 -17.0109 7.6789 7.6789 7.7646 7.7646 7.9093 7.9093 8.3760 8.3760 8.3806 8.3806 8.8718 8.8718 10.4101 10.4101 10.4422 10.4422 14.1500 14.1500 14.1561 14.1561 14.9431 14.9431 k = 0.3869 0.3869 0.3869 ( 1442 PWs) bands (ev): -38.4652 -38.4652 -17.5169 -17.5169 -17.0149 -17.0149 -17.0130 -17.0130 7.6811 7.6811 7.7611 7.7611 7.9057 7.9057 8.3937 8.3937 8.3975 8.3975 8.9474 8.9474 10.3580 10.3580 10.3900 10.3900 14.2164 14.2164 14.2226 14.2226 15.0822 15.0822 k = 0.3929 0.3929 0.3929 ( 1445 PWs) bands (ev): -38.4645 -38.4645 -17.5187 -17.5187 -17.0167 -17.0167 -17.0150 -17.0150 7.6835 7.6835 7.7577 7.7577 7.9025 7.9025 8.4114 8.4114 8.4145 8.4145 9.0210 9.0210 10.3072 10.3072 10.3393 10.3393 14.2830 14.2830 14.2891 14.2891 15.2242 15.2242 k = 0.3988 0.3988 0.3988 ( 1445 PWs) bands (ev): -38.4638 -38.4638 -17.5204 -17.5204 -17.0184 -17.0184 -17.0169 -17.0169 7.6864 7.6864 7.7545 7.7545 7.8996 7.8996 8.4290 8.4290 8.4315 8.4315 9.0927 9.0927 10.2578 10.2578 10.2899 10.2899 14.3493 14.3493 14.3553 14.3553 15.3684 15.3684 k = 0.4048 0.4048 0.4048 ( 1439 PWs) bands (ev): -38.4632 -38.4632 -17.5220 -17.5220 -17.0200 -17.0200 -17.0186 -17.0186 7.6895 7.6895 7.7516 7.7516 7.8972 7.8972 8.4466 8.4466 8.4486 8.4486 9.1622 9.1622 10.2100 10.2100 10.2421 10.2421 14.4151 14.4151 14.4210 14.4210 15.4059 15.4059 k = 0.4107 0.4107 0.4107 ( 1442 PWs) bands (ev): -38.4625 -38.4625 -17.5236 -17.5236 -17.0215 -17.0215 -17.0203 -17.0203 7.6927 7.6927 7.7488 7.7488 7.8951 7.8951 8.4639 8.4639 8.4655 8.4655 9.2290 9.2290 10.1639 10.1639 10.1958 10.1958 14.4802 14.4802 14.4859 14.4859 15.2927 15.2927 k = 0.4167 0.4167 0.4167 ( 1430 PWs) bands (ev): -38.4620 -38.4620 -17.5250 -17.5250 -17.0229 -17.0229 -17.0219 -17.0219 7.6964 7.6964 7.7462 7.7462 7.8934 7.8934 8.4810 8.4810 8.4823 8.4823 9.2936 9.2936 10.1196 10.1196 10.1515 10.1515 14.5442 14.5442 14.5497 14.5497 15.1824 15.1824 k = 0.4226 0.4226 0.4226 ( 1430 PWs) bands (ev): -38.4614 -38.4614 -17.5263 -17.5263 -17.0242 -17.0242 -17.0234 -17.0234 7.7000 7.7000 7.7437 7.7437 7.8919 7.8919 8.4978 8.4978 8.4988 8.4988 9.3552 9.3552 10.0771 10.0771 10.1089 10.1089 14.6068 14.6068 14.6119 14.6119 15.0763 15.0763 k = 0.4286 0.4286 0.4286 ( 1430 PWs) bands (ev): -38.4609 -38.4609 -17.5276 -17.5276 -17.0255 -17.0255 -17.0247 -17.0247 7.7035 7.7035 7.7415 7.7415 7.8908 7.8908 8.5142 8.5142 8.5149 8.5149 9.4139 9.4139 10.0368 10.0368 10.0685 10.0685 14.6675 14.6675 14.6723 14.6723 14.9749 14.9749 k = 0.4345 0.4345 0.4345 ( 1430 PWs) bands (ev): -38.4604 -38.4604 -17.5287 -17.5287 -17.0266 -17.0266 -17.0260 -17.0260 7.7070 7.7070 7.7394 7.7394 7.8900 7.8900 8.5300 8.5300 8.5306 8.5306 9.4692 9.4692 9.9987 9.9987 10.0302 10.0302 14.7260 14.7260 14.7305 14.7305 14.8789 14.8789 k = 0.4405 0.4405 0.4405 ( 1430 PWs) bands (ev): -38.4600 -38.4600 -17.5298 -17.5298 -17.0277 -17.0277 -17.0272 -17.0272 7.7104 7.7104 7.7375 7.7375 7.8894 7.8894 8.5453 8.5453 8.5457 8.5457 9.5211 9.5211 9.9631 9.9631 9.9943 9.9943 14.7802 14.7802 14.7860 14.7860 14.7905 14.7905 k = 0.4464 0.4464 0.4464 ( 1430 PWs) bands (ev): -38.4596 -38.4596 -17.5308 -17.5308 -17.0287 -17.0287 -17.0283 -17.0283 7.7137 7.7137 7.7358 7.7358 7.8891 7.8891 8.5598 8.5598 8.5601 8.5601 9.5691 9.5691 9.9301 9.9301 9.9611 9.9611 14.7050 14.7050 14.8350 14.8350 14.8383 14.8383 k = 0.4524 0.4524 0.4524 ( 1430 PWs) bands (ev): -38.4592 -38.4592 -17.5316 -17.5316 -17.0295 -17.0295 -17.0292 -17.0292 7.7166 7.7166 7.7343 7.7343 7.8890 7.8890 8.5734 8.5734 8.5736 8.5736 9.6131 9.6131 9.9000 9.9000 9.9305 9.9305 14.6284 14.6284 14.8842 14.8842 14.8870 14.8870 k = 0.4583 0.4583 0.4583 ( 1430 PWs) bands (ev): -38.4589 -38.4589 -17.5324 -17.5324 -17.0303 -17.0303 -17.0301 -17.0301 7.7194 7.7194 7.7330 7.7330 7.8890 7.8890 8.5859 8.5859 8.5861 8.5861 9.6525 9.6525 9.8730 9.8730 9.9030 9.9030 14.5594 14.5594 14.9293 14.9293 14.9316 14.9316 k = 0.4643 0.4643 0.4643 ( 1430 PWs) bands (ev): -38.4587 -38.4587 -17.5331 -17.5331 -17.0310 -17.0310 -17.0308 -17.0308 7.7218 7.7218 7.7319 7.7319 7.8891 7.8891 8.5972 8.5972 8.5974 8.5974 9.6870 9.6870 9.8495 9.8495 9.8786 9.8786 14.4984 14.4984 14.9698 14.9698 14.9716 14.9716 k = 0.4702 0.4702 0.4702 ( 1430 PWs) bands (ev): -38.4584 -38.4584 -17.5336 -17.5336 -17.0315 -17.0315 -17.0314 -17.0314 7.7239 7.7239 7.7309 7.7309 7.8893 7.8893 8.6072 8.6072 8.6073 8.6073 9.7161 9.7161 9.8299 9.8299 9.8575 9.8575 14.4458 14.4458 15.0052 15.0052 15.0065 15.0065 k = 0.4762 0.4762 0.4762 ( 1430 PWs) bands (ev): -38.4582 -38.4582 -17.5341 -17.5341 -17.0320 -17.0320 -17.0319 -17.0319 7.7256 7.7256 7.7301 7.7301 7.8895 7.8895 8.6156 8.6156 8.6156 8.6156 9.7388 9.7388 9.8151 9.8151 9.8399 9.8399 14.4022 14.4022 15.0350 15.0350 15.0359 15.0359 k = 0.4821 0.4821 0.4821 ( 1436 PWs) bands (ev): -38.4581 -38.4581 -17.5345 -17.5345 -17.0324 -17.0324 -17.0324 -17.0324 7.7269 7.7269 7.7295 7.7295 7.8897 7.8897 8.6222 8.6222 8.6222 8.6222 9.7535 9.7535 9.8065 9.8065 9.8261 9.8261 14.3679 14.3679 15.0587 15.0587 15.0592 15.0592 k = 0.4881 0.4881 0.4881 ( 1454 PWs) bands (ev): -38.4580 -38.4580 -17.5349 -17.5349 -17.0328 -17.0328 -17.0327 -17.0327 7.7279 7.7279 7.7289 7.7289 7.8898 7.8898 8.6270 8.6270 8.6270 8.6270 9.7595 9.7595 9.8047 9.8047 9.8158 9.8158 14.3432 14.3432 15.0759 15.0759 15.0761 15.0761 k = 0.4940 0.4940 0.4940 ( 1472 PWs) bands (ev): -38.4579 -38.4579 -17.5351 -17.5351 -17.0330 -17.0330 -17.0330 -17.0330 7.7283 7.7283 7.7286 7.7286 7.8898 7.8898 8.6298 8.6298 8.6298 8.6298 9.7599 9.7599 9.8065 9.8065 9.8097 9.8097 14.3282 14.3282 15.0863 15.0863 15.0864 15.0864 k = 0.5000 0.5000 0.5000 ( 1472 PWs) bands (ev): -38.4579 -38.4579 -17.5352 -17.5352 -17.0331 -17.0331 -17.0331 -17.0331 7.7285 7.7285 7.7285 7.7285 7.8899 7.8899 8.6308 8.6308 8.6308 8.6308 9.7597 9.7597 9.8077 9.8077 9.8077 9.8077 14.3232 14.3232 15.0898 15.0898 15.0898 15.0898 k = 0.5000 0.5000 0.5000 ( 1472 PWs) bands (ev): -38.4579 -38.4579 -17.5352 -17.5352 -17.0331 -17.0331 -17.0331 -17.0331 7.7285 7.7285 7.7285 7.7285 7.8899 7.8899 8.6308 8.6308 8.6308 8.6308 9.7597 9.7597 9.8077 9.8077 9.8077 9.8077 14.3232 14.3232 15.0898 15.0898 15.0898 15.0898 k = 0.4928 0.5000 0.4928 ( 1472 PWs) bands (ev): -38.4579 -38.4579 -17.5351 -17.5351 -17.0331 -17.0331 -17.0330 -17.0330 7.7283 7.7283 7.7286 7.7286 7.8898 7.8898 8.6294 8.6294 8.6303 8.6303 9.7600 9.7600 9.8066 9.8066 9.8095 9.8095 14.3281 14.3281 15.0847 15.0847 15.0881 15.0881 k = 0.4855 0.5000 0.4855 ( 1448 PWs) bands (ev): -38.4580 -38.4580 -17.5348 -17.5348 -17.0329 -17.0329 -17.0325 -17.0325 7.7279 7.7279 7.7290 7.7290 7.8898 7.8898 8.6252 8.6252 8.6289 8.6289 9.7600 9.7600 9.8048 9.8048 9.8153 9.8153 14.3429 14.3429 15.0695 15.0695 15.0828 15.0828 k = 0.4783 0.5000 0.4783 ( 1444 PWs) bands (ev): -38.4581 -38.4581 -17.5346 -17.5346 -17.0329 -17.0329 -17.0320 -17.0320 7.7269 7.7269 7.7294 7.7294 7.8897 7.8897 8.6181 8.6181 8.6264 8.6264 9.7561 9.7561 9.8046 9.8046 9.8251 9.8251 14.3674 14.3674 15.0448 15.0448 15.0739 15.0739 k = 0.4710 0.5000 0.4710 ( 1436 PWs) bands (ev): -38.4582 -38.4582 -17.5341 -17.5341 -17.0327 -17.0327 -17.0313 -17.0313 7.7255 7.7255 7.7301 7.7301 7.8895 7.8895 8.6084 8.6084 8.6228 8.6228 9.7455 9.7455 9.8089 9.8089 9.8394 9.8394 14.4013 14.4013 15.0112 15.0112 15.0613 15.0613 k = 0.4638 0.5000 0.4638 ( 1436 PWs) bands (ev): -38.4584 -38.4584 -17.5337 -17.5337 -17.0326 -17.0326 -17.0305 -17.0305 7.7237 7.7237 7.7309 7.7309 7.8893 7.8893 8.5963 8.5963 8.6180 8.6180 9.7282 9.7282 9.8173 9.8173 9.8582 9.8582 14.4444 14.4444 14.9696 14.9696 15.0449 15.0449 k = 0.4565 0.5000 0.4565 ( 1428 PWs) bands (ev): -38.4586 -38.4586 -17.5331 -17.5331 -17.0324 -17.0324 -17.0294 -17.0294 7.7216 7.7216 7.7320 7.7320 7.8891 7.8891 8.5822 8.5822 8.6122 8.6122 9.7058 9.7058 9.8286 9.8286 9.8816 9.8816 14.4963 14.4963 14.9209 14.9209 15.0245 15.0245 k = 0.4493 0.5000 0.4493 ( 1428 PWs) bands (ev): -38.4589 -38.4589 -17.5324 -17.5324 -17.0322 -17.0322 -17.0282 -17.0282 7.7190 7.7190 7.7332 7.7332 7.8890 7.8890 8.5662 8.5662 8.6049 8.6049 9.6795 9.6795 9.8420 9.8420 9.9090 9.9090 14.5566 14.5566 14.8663 14.8663 14.9998 14.9998 k = 0.4420 0.5000 0.4420 ( 1428 PWs) bands (ev): -38.4592 -38.4592 -17.5317 -17.5317 -17.0320 -17.0320 -17.0268 -17.0268 7.7160 7.7160 7.7345 7.7345 7.8889 7.8889 8.5486 8.5486 8.5963 8.5963 9.6500 9.6500 9.8570 9.8570 9.9401 9.9401 14.6248 14.6248 14.8064 14.8064 14.9708 14.9708 k = 0.4348 0.5000 0.4348 ( 1428 PWs) bands (ev): -38.4596 -38.4596 -17.5309 -17.5309 -17.0318 -17.0318 -17.0252 -17.0252 7.7126 7.7126 7.7361 7.7361 7.8890 7.8890 8.5298 8.5298 8.5862 8.5862 9.6181 9.6181 9.8735 9.8735 9.9746 9.9746 14.7005 14.7005 14.7423 14.7423 14.9372 14.9372 k = 0.4275 0.5000 0.4275 ( 1428 PWs) bands (ev): -38.4600 -38.4600 -17.5299 -17.5299 -17.0315 -17.0315 -17.0235 -17.0235 7.7089 7.7089 7.7378 7.7378 7.8893 7.8893 8.5100 8.5100 8.5744 8.5744 9.5844 9.5844 9.8913 9.8913 10.0121 10.0121 14.6746 14.6746 14.7833 14.7833 14.8988 14.8988 k = 0.4203 0.5000 0.4203 ( 1424 PWs) bands (ev): -38.4604 -38.4604 -17.5289 -17.5289 -17.0312 -17.0312 -17.0215 -17.0215 7.7049 7.7049 7.7398 7.7398 7.8898 7.8898 8.4894 8.4894 8.5610 8.5610 9.5496 9.5496 9.9100 9.9100 10.0524 10.0524 14.6040 14.6040 14.8545 14.8545 14.8736 14.8736 k = 0.4130 0.5000 0.4130 ( 1424 PWs) bands (ev): -38.4608 -38.4608 -17.5278 -17.5278 -17.0309 -17.0309 -17.0194 -17.0194 7.7005 7.7005 7.7419 7.7419 7.8905 7.8905 8.4683 8.4683 8.5456 8.5456 9.5141 9.5141 9.9296 9.9296 10.0950 10.0950 14.5312 14.5312 14.8071 14.8071 14.9680 14.9680 k = 0.4058 0.5000 0.4058 ( 1428 PWs) bands (ev): -38.4613 -38.4613 -17.5266 -17.5266 -17.0306 -17.0306 -17.0172 -17.0172 7.6958 7.6958 7.7441 7.7441 7.8914 7.8914 8.4468 8.4468 8.5281 8.5281 9.4786 9.4786 9.9495 9.9495 10.1398 10.1398 14.4565 14.4565 14.7541 14.7541 15.0686 15.0686 k = 0.3986 0.5000 0.3986 ( 1428 PWs) bands (ev): -38.4619 -38.4619 -17.5254 -17.5254 -17.0302 -17.0302 -17.0148 -17.0148 7.6909 7.6909 7.7466 7.7466 7.8926 7.8926 8.4251 8.4251 8.5086 8.5086 9.4435 9.4435 9.9698 9.9698 10.1866 10.1866 14.3805 14.3805 14.6966 14.6966 15.1740 15.1740 k = 0.3913 0.5000 0.3913 ( 1432 PWs) bands (ev): -38.4624 -38.4624 -17.5241 -17.5241 -17.0298 -17.0298 -17.0122 -17.0122 7.6857 7.6857 7.7493 7.7493 7.8941 7.8941 8.4032 8.4032 8.4868 8.4868 9.4094 9.4094 9.9901 9.9901 10.2352 10.2352 14.3033 14.3033 14.6348 14.6348 15.2835 15.2835 k = 0.3841 0.5000 0.3841 ( 1432 PWs) bands (ev): -38.4630 -38.4630 -17.5227 -17.5227 -17.0294 -17.0294 -17.0095 -17.0095 7.6805 7.6805 7.7521 7.7521 7.8958 7.8958 8.3815 8.3815 8.4627 8.4627 9.3766 9.3766 10.0099 10.0099 10.2854 10.2854 14.2255 14.2255 14.5695 14.5695 15.3958 15.3958 k = 0.3768 0.5000 0.3768 ( 1434 PWs) bands (ev): -38.4636 -38.4636 -17.5213 -17.5213 -17.0289 -17.0289 -17.0066 -17.0066 7.6751 7.6751 7.7552 7.7552 7.8978 7.8978 8.3599 8.3599 8.4364 8.4364 9.3454 9.3454 10.0291 10.0291 10.3371 10.3371 14.1472 14.1472 14.5012 14.5012 15.5090 15.5090 k = 0.3696 0.5000 0.3696 ( 1434 PWs) bands (ev): -38.4643 -38.4643 -17.5198 -17.5198 -17.0284 -17.0284 -17.0036 -17.0036 7.6696 7.6696 7.7585 7.7585 7.9000 7.9000 8.3385 8.3385 8.4078 8.4078 9.3162 9.3162 10.0472 10.0472 10.3901 10.3901 14.0686 14.0686 14.4308 14.4308 15.6177 15.6177 k = 0.3623 0.5000 0.3623 ( 1430 PWs) bands (ev): -38.4650 -38.4650 -17.5182 -17.5182 -17.0278 -17.0278 -17.0004 -17.0004 7.6641 7.6641 7.7619 7.7619 7.9024 7.9024 8.3175 8.3175 8.3772 8.3772 9.2891 9.2891 10.0639 10.0639 10.4444 10.4444 13.9900 13.9900 14.3592 14.3592 15.7045 15.7045 k = 0.3551 0.5000 0.3551 ( 1430 PWs) bands (ev): -38.4657 -38.4657 -17.5166 -17.5166 -17.0272 -17.0272 -16.9971 -16.9971 7.6585 7.6585 7.7655 7.7655 7.9050 7.9050 8.2967 8.2967 8.3447 8.3447 9.2642 9.2642 10.0786 10.0786 10.4997 10.4997 13.9115 13.9115 14.2874 14.2874 15.7243 15.7243 k = 0.3478 0.5000 0.3478 ( 1426 PWs) bands (ev): -38.4664 -38.4664 -17.5149 -17.5149 -17.0266 -17.0266 -16.9936 -16.9936 7.6531 7.6531 7.7693 7.7693 7.9076 7.9076 8.2759 8.2759 8.3111 8.3111 9.2417 9.2417 10.0911 10.0911 10.5560 10.5560 13.8332 13.8332 14.2163 14.2163 15.6703 15.6703 k = 0.3406 0.5000 0.3406 ( 1430 PWs) bands (ev): -38.4672 -38.4672 -17.5133 -17.5133 -17.0259 -17.0259 -16.9901 -16.9901 7.6476 7.6476 7.7733 7.7733 7.9101 7.9101 8.2538 8.2538 8.2778 8.2778 9.2212 9.2212 10.1009 10.1009 10.6130 10.6130 13.7553 13.7553 14.1467 14.1467 15.5872 15.5872 k = 0.3333 0.5000 0.3333 ( 1430 PWs) bands (ev): -38.4680 -38.4680 -17.5116 -17.5116 -17.0252 -17.0252 -16.9865 -16.9865 7.6423 7.6423 7.7774 7.7774 7.9123 7.9123 8.2266 8.2266 8.2494 8.2494 9.2029 9.2029 10.1077 10.1077 10.6709 10.6709 13.6778 13.6778 14.0797 14.0797 15.4952 15.4952 k = 0.3261 0.5000 0.3261 ( 1430 PWs) bands (ev): -38.4688 -38.4688 -17.5098 -17.5098 -17.0245 -17.0245 -16.9827 -16.9827 7.6370 7.6370 7.7816 7.7816 7.9141 7.9141 8.1927 8.1927 8.2279 8.2279 9.1867 9.1867 10.1110 10.1110 10.7295 10.7295 13.6009 13.6009 14.0160 14.0160 15.4001 15.4001 k = 0.3188 0.5000 0.3188 ( 1430 PWs) bands (ev): -38.4696 -38.4696 -17.5081 -17.5081 -17.0237 -17.0237 -16.9789 -16.9789 7.6319 7.6319 7.7860 7.7860 7.9147 7.9147 8.1566 8.1566 8.2097 8.2097 9.1724 9.1724 10.1104 10.1104 10.7886 10.7886 13.5246 13.5246 13.9565 13.9565 15.3039 15.3039 k = 0.3116 0.5000 0.3116 ( 1430 PWs) bands (ev): -38.4705 -38.4705 -17.5063 -17.5063 -17.0229 -17.0229 -16.9749 -16.9749 7.6268 7.6268 7.7906 7.7906 7.9136 7.9136 8.1210 8.1210 8.1931 8.1931 9.1599 9.1599 10.1058 10.1058 10.8482 10.8482 13.4490 13.4490 13.9016 13.9016 15.2076 15.2076 k = 0.3043 0.5000 0.3043 ( 1442 PWs) bands (ev): -38.4713 -38.4713 -17.5046 -17.5046 -17.0221 -17.0221 -16.9710 -16.9710 7.6218 7.6218 7.7950 7.7950 7.9093 7.9093 8.0879 8.0879 8.1777 8.1777 9.1488 9.1488 10.0966 10.0966 10.9080 10.9080 13.3742 13.3742 13.8521 13.8521 15.1115 15.1115 k = 0.2971 0.5000 0.2971 ( 1446 PWs) bands (ev): -38.4722 -38.4722 -17.5028 -17.5028 -17.0212 -17.0212 -16.9669 -16.9669 7.6169 7.6169 7.7997 7.7997 7.9001 7.9001 8.0596 8.0596 8.1637 8.1637 9.1393 9.1393 10.0829 10.0829 10.9682 10.9682 13.3002 13.3002 13.8082 13.8082 15.0159 15.0159 k = 0.2899 0.5000 0.2899 ( 1442 PWs) bands (ev): -38.4731 -38.4731 -17.5010 -17.5010 -17.0203 -17.0203 -16.9627 -16.9627 7.6120 7.6120 7.8044 7.8044 7.8841 7.8841 8.0382 8.0382 8.1510 8.1510 9.1312 9.1312 10.0645 10.0645 11.0287 11.0287 13.2271 13.2271 13.7704 13.7704 14.9212 14.9212 k = 0.2826 0.5000 0.2826 ( 1442 PWs) bands (ev): -38.4740 -38.4740 -17.4993 -17.4993 -17.0193 -17.0193 -16.9585 -16.9585 7.6070 7.6070 7.8091 7.8091 7.8608 7.8608 8.0244 8.0244 8.1398 8.1398 9.1242 9.1242 10.0412 10.0412 11.0893 11.0893 13.1550 13.1550 13.7388 13.7388 14.8273 14.8273 k = 0.2754 0.5000 0.2754 ( 1444 PWs) bands (ev): -38.4749 -38.4749 -17.4975 -17.4975 -17.0183 -17.0183 -16.9542 -16.9542 7.6016 7.6016 7.8137 7.8137 7.8318 7.8318 8.0168 8.0168 8.1301 8.1301 9.1183 9.1183 10.0131 10.0131 11.1498 11.1498 13.0838 13.0838 13.7136 13.7136 14.7343 14.7343 k = 0.2681 0.5000 0.2681 ( 1440 PWs) bands (ev): -38.4758 -38.4758 -17.4958 -17.4958 -17.0172 -17.0172 -16.9499 -16.9499 7.5957 7.5957 7.7997 7.7997 7.8184 7.8184 8.0133 8.0133 8.1223 8.1223 9.1134 9.1134 9.9805 9.9805 11.2103 11.2103 13.0137 13.0137 13.6946 13.6946 14.6425 14.6425 k = 0.2609 0.5000 0.2609 ( 1440 PWs) bands (ev): -38.4767 -38.4767 -17.4940 -17.4940 -17.0161 -17.0161 -16.9455 -16.9455 7.5886 7.5886 7.7669 7.7669 7.8227 7.8227 8.0119 8.0119 8.1166 8.1166 9.1094 9.1094 9.9432 9.9432 11.2707 11.2707 12.9446 12.9446 13.6817 13.6817 14.5517 14.5517 k = 0.2536 0.5000 0.2536 ( 1452 PWs) bands (ev): -38.4776 -38.4776 -17.4924 -17.4924 -17.0150 -17.0150 -16.9412 -16.9412 7.5795 7.5795 7.7353 7.7353 7.8267 7.8267 8.0113 8.0113 8.1129 8.1129 9.1060 9.1060 9.9016 9.9016 11.3307 11.3307 12.8766 12.8766 13.6746 13.6746 14.4621 14.4621 k = 0.2464 0.5000 0.2464 ( 1448 PWs) bands (ev): -38.4785 -38.4785 -17.4907 -17.4907 -17.0139 -17.0139 -16.9368 -16.9368 7.5672 7.5672 7.7070 7.7070 7.8306 7.8306 8.0112 8.0112 8.1118 8.1118 9.1034 9.1034 9.8563 9.8563 11.3905 11.3905 12.8098 12.8098 13.6731 13.6731 14.3738 14.3738 k = 0.2391 0.5000 0.2391 ( 1448 PWs) bands (ev): -38.4795 -38.4795 -17.4891 -17.4891 -17.0127 -17.0127 -16.9324 -16.9324 7.5504 7.5504 7.6838 7.6838 7.8340 7.8340 8.0111 8.0111 8.1130 8.1130 9.1013 9.1013 9.8073 9.8073 11.4498 11.4498 12.7442 12.7442 13.6768 13.6768 14.2868 14.2868 k = 0.2319 0.5000 0.2319 ( 1448 PWs) bands (ev): -38.4804 -38.4804 -17.4875 -17.4875 -17.0114 -17.0114 -16.9280 -16.9280 7.5283 7.5283 7.6666 7.6666 7.8370 7.8370 8.0110 8.0110 8.1163 8.1163 9.0998 9.0998 9.7552 9.7552 11.5086 11.5086 12.6798 12.6798 13.6851 13.6851 14.2011 14.2011 k = 0.2246 0.5000 0.2246 ( 1448 PWs) bands (ev): -38.4813 -38.4813 -17.4859 -17.4859 -17.0102 -17.0102 -16.9237 -16.9237 7.5016 7.5016 7.6552 7.6552 7.8394 7.8394 8.0110 8.0110 8.1215 8.1215 9.0988 9.0988 9.7002 9.7002 11.5668 11.5668 12.6166 12.6166 13.6977 13.6977 14.1169 14.1169 k = 0.2174 0.5000 0.2174 ( 1448 PWs) bands (ev): -38.4822 -38.4822 -17.4844 -17.4844 -17.0089 -17.0089 -16.9193 -16.9193 7.4718 7.4718 7.6480 7.6480 7.8411 7.8411 8.0114 8.0114 8.1283 8.1283 9.0982 9.0982 9.6429 9.6429 11.6243 11.6243 12.5548 12.5548 13.7140 13.7140 14.0342 14.0342 k = 0.2101 0.5000 0.2101 ( 1442 PWs) bands (ev): -38.4831 -38.4831 -17.4829 -17.4829 -17.0076 -17.0076 -16.9149 -16.9149 7.4404 7.4404 7.6440 7.6440 7.8423 7.8423 8.0124 8.0124 8.1365 8.1365 9.0981 9.0981 9.5838 9.5838 11.6810 11.6810 12.4943 12.4943 13.7335 13.7335 13.9530 13.9530 k = 0.2029 0.5000 0.2029 ( 1442 PWs) bands (ev): -38.4840 -38.4840 -17.4815 -17.4815 -17.0063 -17.0063 -16.9107 -16.9107 7.4082 7.4082 7.6422 7.6422 7.8428 7.8428 8.0141 8.0141 8.1456 8.1456 9.0981 9.0981 9.5231 9.5231 11.7368 11.7368 12.4352 12.4352 13.7556 13.7556 13.8735 13.8735 k = 0.1957 0.5000 0.1957 ( 1446 PWs) bands (ev): -38.4849 -38.4849 -17.4801 -17.4801 -17.0050 -17.0050 -16.9065 -16.9065 7.3759 7.3759 7.6419 7.6419 7.8426 7.8426 8.0165 8.0165 8.1555 8.1555 9.0982 9.0982 9.4614 9.4614 11.7916 11.7916 12.3775 12.3775 13.7775 13.7775 13.7983 13.7983 k = 0.1884 0.5000 0.1884 ( 1446 PWs) bands (ev): -38.4857 -38.4857 -17.4788 -17.4788 -17.0036 -17.0036 -16.9023 -16.9023 7.3441 7.3441 7.6429 7.6429 7.8419 7.8419 8.0198 8.0198 8.1662 8.1662 9.0983 9.0983 9.3992 9.3992 11.8453 11.8453 12.3212 12.3212 13.7182 13.7182 13.8077 13.8077 k = 0.1812 0.5000 0.1812 ( 1446 PWs) bands (ev): -38.4866 -38.4866 -17.4776 -17.4776 -17.0023 -17.0023 -16.8982 -16.8982 7.3129 7.3129 7.6450 7.6450 7.8408 7.8408 8.0239 8.0239 8.1774 8.1774 9.0982 9.0982 9.3370 9.3370 11.8979 11.8979 12.2665 12.2665 13.6441 13.6441 13.8351 13.8351 k = 0.1739 0.5000 0.1739 ( 1444 PWs) bands (ev): -38.4874 -38.4874 -17.4763 -17.4763 -17.0009 -17.0009 -16.8942 -16.8942 7.2825 7.2825 7.6480 7.6480 7.8392 7.8392 8.0287 8.0287 8.1890 8.1890 9.0972 9.0972 9.2758 9.2758 11.9492 11.9492 12.2133 12.2133 13.5715 13.5715 13.8637 13.8637 k = 0.1667 0.5000 0.1667 ( 1434 PWs) bands (ev): -38.4882 -38.4882 -17.4751 -17.4751 -16.9995 -16.9995 -16.8902 -16.8902 7.2531 7.2531 7.6519 7.6519 7.8374 7.8374 8.0341 8.0341 8.2010 8.2010 9.0935 9.0935 9.2176 9.2176 11.9992 11.9992 12.1619 12.1619 13.5009 13.5009 13.8930 13.8930 k = 0.1594 0.5000 0.1594 ( 1446 PWs) bands (ev): -38.4890 -38.4890 -17.4741 -17.4741 -16.9983 -16.9983 -16.8864 -16.8864 7.2246 7.2246 7.6564 7.6564 7.8353 7.8353 8.0400 8.0400 8.2130 8.2130 9.0812 9.0812 9.1684 9.1684 12.0476 12.0476 12.1119 12.1119 13.4322 13.4322 13.9223 13.9223 k = 0.1522 0.5000 0.1522 ( 1446 PWs) bands (ev): -38.4898 -38.4898 -17.4730 -17.4730 -16.9969 -16.9969 -16.8826 -16.8826 7.1973 7.1973 7.6618 7.6618 7.8331 7.8331 8.0463 8.0463 8.2252 8.2252 9.0485 9.0485 9.1404 9.1404 12.0635 12.0635 12.0948 12.0948 13.3657 13.3657 13.9516 13.9516 k = 0.1449 0.5000 0.1449 ( 1446 PWs) bands (ev): -38.4905 -38.4905 -17.4721 -17.4721 -16.9956 -16.9956 -16.8790 -16.8790 7.1711 7.1711 7.6679 7.6679 7.8309 7.8309 8.0530 8.0530 8.2375 8.2375 8.9980 8.9980 9.1311 9.1311 12.0171 12.0171 12.1401 12.1401 13.3013 13.3013 13.9805 13.9805 k = 0.1377 0.5000 0.1377 ( 1446 PWs) bands (ev): -38.4912 -38.4912 -17.4711 -17.4711 -16.9944 -16.9944 -16.8755 -16.8755 7.1461 7.1461 7.6748 7.6748 7.8288 7.8288 8.0600 8.0600 8.2498 8.2498 8.9416 8.9416 9.1290 9.1290 11.9724 11.9724 12.1838 12.1838 13.2392 13.2392 14.0087 14.0087 k = 0.1304 0.5000 0.1304 ( 1442 PWs) bands (ev): -38.4919 -38.4919 -17.4702 -17.4702 -16.9931 -16.9931 -16.8721 -16.8721 7.1223 7.1223 7.6824 7.6824 7.8268 7.8268 8.0670 8.0670 8.2619 8.2619 8.8840 8.8840 9.1293 9.1293 11.9296 11.9296 12.2258 12.2258 13.1795 13.1795 14.0360 14.0360 k = 0.1232 0.5000 0.1232 ( 1442 PWs) bands (ev): -38.4926 -38.4926 -17.4694 -17.4694 -16.9919 -16.9919 -16.8689 -16.8689 7.0998 7.0998 7.6906 7.6906 7.8249 7.8249 8.0741 8.0741 8.2738 8.2738 8.8268 8.8268 9.1307 9.1307 11.8887 11.8887 12.2659 12.2659 13.1222 13.1222 14.0622 14.0622 k = 0.1159 0.5000 0.1159 ( 1442 PWs) bands (ev): -38.4932 -38.4932 -17.4686 -17.4686 -16.9907 -16.9907 -16.8658 -16.8658 7.0785 7.0785 7.6994 7.6994 7.8233 7.8233 8.0812 8.0812 8.2854 8.2854 8.7706 8.7706 9.1327 9.1327 11.8497 11.8497 12.3042 12.3042 13.0674 13.0674 14.0871 14.0871 k = 0.1087 0.5000 0.1087 ( 1434 PWs) bands (ev): -38.4938 -38.4938 -17.4679 -17.4679 -16.9895 -16.9895 -16.8628 -16.8628 7.0586 7.0586 7.7089 7.7089 7.8222 7.8222 8.0882 8.0882 8.2965 8.2965 8.7158 8.7158 9.1351 9.1351 11.8128 11.8128 12.3404 12.3404 13.0154 13.0154 14.1107 14.1107 k = 0.1014 0.5000 0.1014 ( 1434 PWs) bands (ev): -38.4944 -38.4944 -17.4672 -17.4672 -16.9884 -16.9884 -16.8600 -16.8600 7.0398 7.0398 7.7188 7.7188 7.8215 7.8215 8.0950 8.0950 8.3072 8.3072 8.6627 8.6627 9.1376 9.1376 11.7779 11.7779 12.3746 12.3746 12.9660 12.9660 14.1328 14.1328 k = 0.0942 0.5000 0.0942 ( 1434 PWs) bands (ev): -38.4949 -38.4949 -17.4666 -17.4666 -16.9874 -16.9874 -16.8573 -16.8573 7.0223 7.0223 7.7289 7.7289 7.8215 7.8215 8.1014 8.1014 8.3170 8.3170 8.6115 8.6115 9.1402 9.1402 11.7451 11.7451 12.4067 12.4067 12.9195 12.9195 14.1533 14.1533 k = 0.0870 0.5000 0.0870 ( 1442 PWs) bands (ev): -38.4954 -38.4954 -17.4661 -17.4661 -16.9864 -16.9864 -16.8549 -16.8549 7.0061 7.0061 7.7391 7.7391 7.8224 7.8224 8.1075 8.1075 8.3258 8.3258 8.5627 8.5627 9.1428 9.1428 11.7144 11.7144 12.4367 12.4367 12.8759 12.8759 14.1722 14.1722 k = 0.0797 0.5000 0.0797 ( 1438 PWs) bands (ev): -38.4959 -38.4959 -17.4656 -17.4656 -16.9855 -16.9855 -16.8526 -16.8526 6.9912 6.9912 7.7490 7.7490 7.8248 7.8248 8.1131 8.1131 8.3333 8.3333 8.5168 8.5168 9.1455 9.1455 11.6861 11.6861 12.4644 12.4644 12.8354 12.8354 14.1895 14.1895 k = 0.0725 0.5000 0.0725 ( 1438 PWs) bands (ev): -38.4963 -38.4963 -17.4651 -17.4651 -16.9846 -16.9846 -16.8505 -16.8505 6.9776 6.9776 7.7580 7.7580 7.8290 7.8290 8.1180 8.1180 8.3384 8.3384 8.4747 8.4747 9.1480 9.1480 11.6600 11.6600 12.4898 12.4898 12.7981 12.7981 14.2052 14.2052 k = 0.0652 0.5000 0.0652 ( 1436 PWs) bands (ev): -38.4967 -38.4967 -17.4647 -17.4647 -16.9838 -16.9838 -16.8486 -16.8486 6.9653 6.9653 7.7656 7.7656 7.8357 7.8357 8.1222 8.1222 8.3391 8.3391 8.4388 8.4388 9.1505 9.1505 11.6362 11.6362 12.5129 12.5129 12.7641 12.7641 14.2192 14.2192 k = 0.0580 0.5000 0.0580 ( 1432 PWs) bands (ev): -38.4970 -38.4970 -17.4643 -17.4643 -16.9831 -16.9831 -16.8468 -16.8468 6.9543 6.9543 7.7714 7.7714 7.8452 7.8452 8.1254 8.1254 8.3311 8.3311 8.4137 8.4137 9.1529 9.1529 11.6148 11.6148 12.5336 12.5336 12.7334 12.7334 14.2316 14.2316 k = 0.0507 0.5000 0.0507 ( 1438 PWs) bands (ev): -38.4973 -38.4973 -17.4640 -17.4640 -16.9825 -16.9825 -16.8453 -16.8453 6.9446 6.9446 7.7754 7.7754 7.8572 7.8572 8.1272 8.1272 8.3117 8.3117 8.4020 8.4020 9.1550 9.1550 11.5957 11.5957 12.5519 12.5519 12.7061 12.7061 14.2425 14.2425 k = 0.0435 0.5000 0.0435 ( 1438 PWs) bands (ev): -38.4976 -38.4976 -17.4638 -17.4638 -16.9819 -16.9819 -16.8440 -16.8440 6.9361 6.9361 7.7781 7.7781 7.8714 7.8714 8.1271 8.1271 8.2862 8.2862 8.3994 8.3994 9.1570 9.1570 11.5791 11.5791 12.5676 12.5676 12.6826 12.6826 14.2518 14.2518 k = 0.0362 0.5000 0.0362 ( 1438 PWs) bands (ev): -38.4978 -38.4978 -17.4635 -17.4635 -16.9814 -16.9814 -16.8428 -16.8428 6.9290 6.9290 7.7798 7.7798 7.8871 7.8871 8.1246 8.1246 8.2610 8.2610 8.4003 8.4003 9.1587 9.1587 11.5650 11.5650 12.5806 12.5806 12.6628 12.6628 14.2596 14.2596 k = 0.0290 0.5000 0.0290 ( 1434 PWs) bands (ev): -38.4980 -38.4980 -17.4633 -17.4633 -16.9810 -16.9810 -16.8418 -16.8418 6.9232 6.9232 7.7809 7.7809 7.9036 7.9036 8.1189 8.1189 8.2396 8.2396 8.4023 8.4023 9.1601 9.1601 11.5535 11.5535 12.5907 12.5907 12.6472 12.6472 14.2659 14.2659 k = 0.0217 0.5000 0.0217 ( 1422 PWs) bands (ev): -38.4982 -38.4982 -17.4631 -17.4631 -16.9806 -16.9806 -16.8410 -16.8410 6.9187 6.9187 7.7817 7.7817 7.9199 7.9199 8.1100 8.1100 8.2237 8.2237 8.4044 8.4044 9.1613 9.1613 11.5447 11.5447 12.5975 12.5975 12.6361 12.6361 14.2708 14.2708 k = 0.0145 0.5000 0.0145 ( 1422 PWs) bands (ev): -38.4983 -38.4983 -17.4630 -17.4630 -16.9804 -16.9804 -16.8405 -16.8405 6.9154 6.9154 7.7821 7.7821 7.9345 7.9345 8.0993 8.0993 8.2135 8.2135 8.4060 8.4060 9.1621 9.1621 11.5383 11.5383 12.6005 12.6005 12.6300 12.6300 14.2742 14.2742 k = 0.0072 0.5000 0.0072 ( 1422 PWs) bands (ev): -38.4983 -38.4983 -17.4629 -17.4629 -16.9803 -16.9803 -16.8402 -16.8402 6.9135 6.9135 7.7823 7.7823 7.9453 7.9453 8.0902 8.0902 8.2081 8.2081 8.4070 8.4070 9.1626 9.1626 11.5344 11.5344 12.6008 12.6008 12.6278 12.6278 14.2763 14.2763 k = 0.0000 0.5000-0.0000 ( 1422 PWs) bands (ev): -38.4983 -38.4983 -17.4629 -17.4629 -16.9802 -16.9802 -16.8401 -16.8401 6.9129 6.9129 7.7824 7.7824 7.9493 7.9493 8.0866 8.0866 8.2064 8.2064 8.4074 8.4074 9.1628 9.1628 11.5331 11.5331 12.6006 12.6006 12.6274 12.6274 14.2770 14.2770 k = 0.5000 0.5000-0.0000 ( 1452 PWs) bands (ev): -38.4780 -38.4780 -17.5045 -17.5045 -17.0601 -17.0601 -16.8792 -16.8792 7.0468 7.0468 7.3175 7.3175 7.8915 7.8915 7.9898 7.9898 8.6131 8.6131 9.4483 9.4483 11.3432 11.3432 11.3592 11.3592 12.1252 12.1252 13.7224 13.7224 13.7239 13.7239 k = 0.5000 0.5000 0.0102 ( 1452 PWs) bands (ev): -38.4780 -38.4780 -17.5046 -17.5046 -17.0601 -17.0601 -16.8794 -16.8794 7.0481 7.0481 7.3181 7.3181 7.8914 7.8914 7.9897 7.9897 8.6131 8.6131 9.4485 9.4485 11.3402 11.3402 11.3562 11.3562 12.1270 12.1270 13.7264 13.7264 13.7279 13.7279 k = 0.5000 0.5000 0.0204 ( 1452 PWs) bands (ev): -38.4779 -38.4779 -17.5046 -17.5046 -17.0600 -17.0600 -16.8799 -16.8799 7.0517 7.0517 7.3197 7.3197 7.8910 7.8910 7.9892 7.9892 8.6132 8.6132 9.4489 9.4489 11.3314 11.3314 11.3475 11.3475 12.1323 12.1323 13.7385 13.7385 13.7399 13.7399 k = 0.5000 0.5000 0.0306 ( 1452 PWs) bands (ev): -38.4778 -38.4778 -17.5047 -17.5047 -17.0599 -17.0599 -16.8808 -16.8808 7.0579 7.0579 7.3225 7.3225 7.8903 7.8903 7.9884 7.9884 8.6133 8.6133 9.4497 9.4497 11.3169 11.3169 11.3332 11.3332 12.1412 12.1412 13.7584 13.7584 13.7597 13.7597 k = 0.5000 0.5000 0.0408 ( 1440 PWs) bands (ev): -38.4777 -38.4777 -17.5047 -17.5047 -17.0596 -17.0596 -16.8819 -16.8819 7.0665 7.0665 7.3263 7.3263 7.8895 7.8895 7.9875 7.9875 8.6134 8.6134 9.4509 9.4509 11.2971 11.2971 11.3135 11.3135 12.1537 12.1537 13.7859 13.7859 13.7870 13.7870 k = 0.5000 0.5000 0.0510 ( 1428 PWs) bands (ev): -38.4775 -38.4775 -17.5048 -17.5048 -17.0593 -17.0593 -16.8834 -16.8834 7.0776 7.0776 7.3312 7.3312 7.8886 7.8886 7.9864 7.9864 8.6136 8.6136 9.4523 9.4523 11.2723 11.2723 11.2889 11.2889 12.1696 12.1696 13.8206 13.8206 13.8215 13.8215 k = 0.5000 0.5000 0.0612 ( 1432 PWs) bands (ev): -38.4773 -38.4773 -17.5050 -17.5050 -17.0590 -17.0590 -16.8854 -16.8854 7.0909 7.0909 7.3370 7.3370 7.8870 7.8870 7.9847 7.9847 8.6138 8.6138 9.4540 9.4540 11.2429 11.2429 11.2598 11.2598 12.1892 12.1892 13.8619 13.8619 13.8626 13.8626 k = 0.5000 0.5000 0.0714 ( 1432 PWs) bands (ev): -38.4770 -38.4770 -17.5052 -17.5052 -17.0587 -17.0587 -16.8876 -16.8876 7.1067 7.1067 7.3438 7.3438 7.8854 7.8854 7.9828 7.9828 8.6140 8.6140 9.4561 9.4561 11.2095 11.2095 11.2267 11.2267 12.2123 12.2123 13.9096 13.9096 13.9100 13.9100 k = 0.5000 0.5000 0.0816 ( 1432 PWs) bands (ev): -38.4767 -38.4767 -17.5054 -17.5054 -17.0583 -17.0583 -16.8901 -16.8901 7.1248 7.1248 7.3516 7.3516 7.8835 7.8835 7.9806 7.9806 8.6142 8.6142 9.4584 9.4584 11.1725 11.1725 11.1901 11.1901 12.2389 12.2389 13.9629 13.9629 13.9630 13.9630 k = 0.5000 0.5000 0.0918 ( 1432 PWs) bands (ev): -38.4764 -38.4764 -17.5057 -17.5057 -17.0578 -17.0578 -16.8930 -16.8930 7.1452 7.1452 7.3602 7.3602 7.8815 7.8815 7.9782 7.9782 8.6145 8.6145 9.4610 9.4610 11.1325 11.1325 11.1505 11.1505 12.2691 12.2691 14.0214 14.0214 14.0216 14.0216 k = 0.5000 0.5000 0.1020 ( 1428 PWs) bands (ev): -38.4760 -38.4760 -17.5060 -17.5060 -17.0573 -17.0573 -16.8961 -16.8961 7.1678 7.1678 7.3697 7.3697 7.8792 7.8792 7.9755 7.9755 8.6149 8.6149 9.4640 9.4640 11.0898 11.0898 11.1082 11.1082 12.3029 12.3029 14.0845 14.0845 14.0851 14.0851 k = 0.5000 0.5000 0.1122 ( 1428 PWs) bands (ev): -38.4756 -38.4756 -17.5064 -17.5064 -17.0568 -17.0568 -16.8995 -16.8995 7.1926 7.1926 7.3799 7.3799 7.8768 7.8768 7.9727 7.9727 8.6152 8.6152 9.4673 9.4673 11.0450 11.0450 11.0638 11.0638 12.3402 12.3402 14.1521 14.1521 14.1531 14.1531 k = 0.5000 0.5000 0.1224 ( 1428 PWs) bands (ev): -38.4752 -38.4752 -17.5068 -17.5068 -17.0562 -17.0562 -16.9031 -16.9031 7.2196 7.2196 7.3909 7.3909 7.8744 7.8744 7.9696 7.9696 8.6156 8.6156 9.4709 9.4709 10.9985 10.9985 11.0177 11.0177 12.3811 12.3811 14.2236 14.2236 14.2250 14.2250 k = 0.5000 0.5000 0.1327 ( 1428 PWs) bands (ev): -38.4747 -38.4747 -17.5072 -17.5072 -17.0555 -17.0555 -16.9070 -16.9070 7.2487 7.2487 7.4025 7.4025 7.8718 7.8718 7.9663 7.9663 8.6160 8.6160 9.4748 9.4748 10.9506 10.9506 10.9703 10.9703 12.4255 12.4255 14.2988 14.2988 14.3006 14.3006 k = 0.5000 0.5000 0.1429 ( 1428 PWs) bands (ev): -38.4742 -38.4742 -17.5077 -17.5077 -17.0549 -17.0549 -16.9111 -16.9111 7.2797 7.2797 7.4146 7.4146 7.8692 7.8692 7.9629 7.9629 8.6164 8.6164 9.4789 9.4789 10.9015 10.9015 10.9217 10.9217 12.4734 12.4734 14.3773 14.3773 14.3795 14.3795 k = 0.5000 0.5000 0.1531 ( 1428 PWs) bands (ev): -38.4737 -38.4737 -17.5082 -17.5082 -17.0542 -17.0542 -16.9153 -16.9153 7.3126 7.3126 7.4273 7.4273 7.8667 7.8667 7.9593 7.9593 8.6168 8.6168 9.4835 9.4835 10.8518 10.8518 10.8725 10.8725 12.5248 12.5248 14.4588 14.4588 14.4615 14.4615 k = 0.5000 0.5000 0.1633 ( 1428 PWs) bands (ev): -38.4732 -38.4732 -17.5088 -17.5088 -17.0534 -17.0534 -16.9198 -16.9198 7.3472 7.3472 7.4404 7.4404 7.8642 7.8642 7.9556 7.9556 8.6172 8.6172 9.4883 9.4883 10.8017 10.8017 10.8229 10.8229 12.5797 12.5797 14.5431 14.5431 14.5462 14.5462 k = 0.5000 0.5000 0.1735 ( 1428 PWs) bands (ev): -38.4726 -38.4726 -17.5094 -17.5094 -17.0527 -17.0527 -16.9243 -16.9243 7.3834 7.3834 7.4539 7.4539 7.8620 7.8620 7.9517 7.9517 8.6177 8.6177 9.4935 9.4935 10.7513 10.7513 10.7730 10.7730 12.6380 12.6380 14.6299 14.6299 14.6334 14.6334 k = 0.5000 0.5000 0.1837 ( 1428 PWs) bands (ev): -38.4720 -38.4720 -17.5100 -17.5100 -17.0519 -17.0519 -16.9290 -16.9290 7.4210 7.4210 7.4677 7.4677 7.8600 7.8600 7.9478 7.9478 8.6182 8.6182 9.4990 9.4990 10.7010 10.7010 10.7231 10.7231 12.6997 12.6997 14.7190 14.7190 14.7230 14.7230 k = 0.5000 0.5000 0.1939 ( 1436 PWs) bands (ev): -38.4714 -38.4714 -17.5108 -17.5108 -17.0511 -17.0511 -16.9340 -16.9340 7.4597 7.4597 7.4816 7.4816 7.8586 7.8586 7.9438 7.9438 8.6187 8.6187 9.5047 9.5047 10.6509 10.6509 10.6735 10.6735 12.7647 12.7647 14.8102 14.8102 14.8146 14.8146 k = 0.5000 0.5000 0.2041 ( 1436 PWs) bands (ev): -38.4708 -38.4708 -17.5115 -17.5115 -17.0503 -17.0503 -16.9389 -16.9389 7.4958 7.4958 7.4992 7.4992 7.8579 7.8579 7.9398 7.9398 8.6192 8.6192 9.5109 9.5109 10.6012 10.6012 10.6243 10.6243 12.8331 12.8331 14.9034 14.9034 14.9081 14.9081 k = 0.5000 0.5000 0.2143 ( 1436 PWs) bands (ev): -38.4702 -38.4702 -17.5123 -17.5123 -17.0494 -17.0494 -16.9438 -16.9438 7.5099 7.5099 7.5391 7.5391 7.8583 7.8583 7.9358 7.9358 8.6198 8.6198 9.5175 9.5175 10.5520 10.5520 10.5756 10.5756 12.9046 12.9046 14.9983 14.9983 15.0025 15.0025 k = 0.5000 0.5000 0.2245 ( 1436 PWs) bands (ev): -38.4696 -38.4696 -17.5131 -17.5131 -17.0486 -17.0486 -16.9488 -16.9488 7.5241 7.5241 7.5786 7.5786 7.8605 7.8605 7.9318 7.9318 8.6203 8.6203 9.5244 9.5244 10.5036 10.5036 10.5276 10.5276 12.9793 12.9793 15.0491 15.0491 15.0949 15.0949 k = 0.5000 0.5000 0.2347 ( 1436 PWs) bands (ev): -38.4689 -38.4689 -17.5140 -17.5140 -17.0477 -17.0477 -16.9538 -16.9538 7.5382 7.5382 7.6167 7.6167 7.8652 7.8652 7.9279 7.9279 8.6209 8.6209 9.5316 9.5316 10.4560 10.4560 10.4805 10.4805 13.0570 13.0570 15.0521 15.0521 15.1929 15.1929 k = 0.5000 0.5000 0.2449 ( 1436 PWs) bands (ev): -38.4683 -38.4683 -17.5149 -17.5149 -17.0469 -17.0469 -16.9588 -16.9588 7.5521 7.5521 7.6520 7.6520 7.8739 7.8739 7.9240 7.9240 8.6214 8.6214 9.5393 9.5393 10.4093 10.4093 10.4343 10.4343 13.1376 13.1376 15.0544 15.0544 15.2923 15.2923 k = 0.5000 0.5000 0.2551 ( 1436 PWs) bands (ev): -38.4676 -38.4676 -17.5159 -17.5159 -17.0460 -17.0460 -16.9637 -16.9637 7.5658 7.5658 7.6826 7.6826 7.8882 7.8882 7.9202 7.9202 8.6220 8.6220 9.5474 9.5474 10.3638 10.3638 10.3892 10.3892 13.2210 13.2210 15.0567 15.0567 15.3929 15.3929 k = 0.5000 0.5000 0.2653 ( 1436 PWs) bands (ev): -38.4670 -38.4670 -17.5168 -17.5168 -17.0451 -17.0451 -16.9686 -16.9686 7.5792 7.5792 7.7069 7.7069 7.9097 7.9097 7.9165 7.9165 8.6226 8.6226 9.5558 9.5558 10.3194 10.3194 10.3452 10.3452 13.3071 13.3071 15.0589 15.0589 15.4946 15.4946 k = 0.5000 0.5000 0.2755 ( 1444 PWs) bands (ev): -38.4664 -38.4664 -17.5179 -17.5179 -17.0443 -17.0443 -16.9735 -16.9735 7.5922 7.5922 7.7240 7.7240 7.9129 7.9129 7.9387 7.9387 8.6231 8.6231 9.5647 9.5647 10.2762 10.2762 10.3024 10.3024 13.3955 13.3955 15.0611 15.0611 15.5971 15.5971 k = 0.5000 0.5000 0.2857 ( 1444 PWs) bands (ev): -38.4657 -38.4657 -17.5190 -17.5190 -17.0435 -17.0435 -16.9782 -16.9782 7.6049 7.6049 7.7352 7.7352 7.9095 7.9095 7.9742 7.9742 8.6237 8.6237 9.5741 9.5741 10.2345 10.2345 10.2611 10.2611 13.4862 13.4862 15.0632 15.0632 15.7006 15.7006 k = 0.5000 0.5000 0.2959 ( 1436 PWs) bands (ev): -38.4651 -38.4651 -17.5200 -17.5200 -17.0426 -17.0426 -16.9828 -16.9828 7.6171 7.6171 7.7420 7.7420 7.9065 7.9065 8.0146 8.0146 8.6243 8.6243 9.5839 9.5839 10.1943 10.1943 10.2213 10.2213 13.5790 13.5790 15.0653 15.0653 15.8047 15.8047 k = 0.5000 0.5000 0.3061 ( 1436 PWs) bands (ev): -38.4645 -38.4645 -17.5210 -17.5210 -17.0417 -17.0417 -16.9873 -16.9873 7.6287 7.6287 7.7456 7.7456 7.9035 7.9035 8.0579 8.0579 8.6249 8.6249 9.5942 9.5942 10.1556 10.1556 10.1829 10.1829 13.6736 13.6736 15.0674 15.0674 15.7087 15.7087 k = 0.5000 0.5000 0.3163 ( 1436 PWs) bands (ev): -38.4639 -38.4639 -17.5221 -17.5221 -17.0409 -17.0409 -16.9917 -16.9917 7.6399 7.6399 7.7472 7.7472 7.9008 7.9008 8.1030 8.1030 8.6254 8.6254 9.6049 9.6049 10.1185 10.1185 10.1461 10.1461 13.7696 13.7696 15.0694 15.0694 15.5944 15.5944 k = 0.5000 0.5000 0.3265 ( 1436 PWs) bands (ev): -38.4633 -38.4633 -17.5232 -17.5232 -17.0402 -17.0402 -16.9958 -16.9958 7.6504 7.6504 7.7475 7.7475 7.8984 7.8984 8.1489 8.1489 8.6260 8.6260 9.6162 9.6162 10.0831 10.0831 10.1110 10.1110 13.8668 13.8668 15.0714 15.0714 15.4814 15.4814 k = 0.5000 0.5000 0.3367 ( 1432 PWs) bands (ev): -38.4627 -38.4627 -17.5243 -17.5243 -17.0394 -17.0394 -16.9998 -16.9998 7.6602 7.6602 7.7471 7.7471 7.8963 7.8963 8.1949 8.1949 8.6265 8.6265 9.6278 9.6278 10.0494 10.0494 10.0776 10.0776 13.9649 13.9649 15.0732 15.0732 15.3702 15.3702 k = 0.5000 0.5000 0.3469 ( 1432 PWs) bands (ev): -38.4622 -38.4622 -17.5253 -17.5253 -17.0386 -17.0386 -17.0037 -17.0037 7.6694 7.6694 7.7461 7.7461 7.8944 7.8944 8.2404 8.2404 8.6270 8.6270 9.6399 9.6399 10.0176 10.0176 10.0459 10.0459 14.0634 14.0634 15.0750 15.0750 15.2616 15.2616 k = 0.5000 0.5000 0.3571 ( 1424 PWs) bands (ev): -38.4617 -38.4617 -17.5263 -17.5263 -17.0379 -17.0379 -17.0072 -17.0072 7.6780 7.6780 7.7448 7.7448 7.8929 7.8929 8.2850 8.2850 8.6275 8.6275 9.6524 9.6524 9.9876 9.9876 10.0161 10.0161 14.1618 14.1618 15.0765 15.0765 15.1563 15.1563 k = 0.5000 0.5000 0.3673 ( 1432 PWs) bands (ev): -38.4612 -38.4612 -17.5274 -17.5274 -17.0373 -17.0373 -17.0107 -17.0107 7.6857 7.6857 7.7432 7.7432 7.8916 7.8916 8.3281 8.3281 8.6279 8.6279 9.6650 9.6650 9.9595 9.9595 9.9881 9.9881 14.2597 14.2597 15.0528 15.0528 15.0799 15.0799 k = 0.5000 0.5000 0.3776 ( 1432 PWs) bands (ev): -38.4607 -38.4607 -17.5284 -17.5284 -17.0367 -17.0367 -17.0138 -17.0138 7.6927 7.6927 7.7415 7.7415 7.8906 7.8906 8.3693 8.3693 8.6283 8.6283 9.6780 9.6780 9.9333 9.9333 9.9619 9.9619 14.3563 14.3563 14.9562 14.9562 15.0804 15.0804 k = 0.5000 0.5000 0.3878 ( 1432 PWs) bands (ev): -38.4603 -38.4603 -17.5294 -17.5294 -17.0361 -17.0361 -17.0168 -17.0168 7.6991 7.6991 7.7398 7.7398 7.8898 7.8898 8.4085 8.4085 8.6287 8.6287 9.6911 9.6911 9.9092 9.9092 9.9378 9.9378 14.4512 14.4512 14.8637 14.8637 15.0818 15.0818 k = 0.5000 0.5000 0.3980 ( 1432 PWs) bands (ev): -38.4599 -38.4599 -17.5302 -17.5302 -17.0356 -17.0356 -17.0195 -17.0195 7.7047 7.7047 7.7381 7.7381 7.8893 7.8893 8.4452 8.4452 8.6291 8.6291 9.7041 9.7041 9.8872 9.8872 9.9156 9.9156 14.5434 14.5434 14.7766 14.7766 15.0831 15.0831 k = 0.5000 0.5000 0.4082 ( 1432 PWs) bands (ev): -38.4595 -38.4595 -17.5311 -17.5311 -17.0351 -17.0351 -17.0220 -17.0220 7.7097 7.7097 7.7365 7.7365 7.8890 7.8890 8.4791 8.4791 8.6295 8.6295 9.7167 9.7167 9.8675 9.8675 9.8954 9.8954 14.6321 14.6321 14.6956 14.6956 15.0843 15.0843 k = 0.5000 0.5000 0.4184 ( 1432 PWs) bands (ev): -38.4592 -38.4592 -17.5318 -17.5318 -17.0346 -17.0346 -17.0243 -17.0243 7.7139 7.7139 7.7349 7.7349 7.8889 7.8889 8.5101 8.5101 8.6298 8.6298 9.7287 9.7287 9.8500 9.8500 9.8772 9.8772 14.6212 14.6212 14.7164 14.7164 15.0855 15.0855 k = 0.5000 0.5000 0.4286 ( 1432 PWs) bands (ev): -38.4589 -38.4589 -17.5325 -17.5325 -17.0342 -17.0342 -17.0263 -17.0263 7.7176 7.7176 7.7336 7.7336 7.8890 7.8890 8.5378 8.5378 8.6301 8.6301 9.7397 9.7397 9.8350 9.8350 9.8612 9.8612 14.5540 14.5540 14.7952 14.7952 15.0865 15.0865 k = 0.5000 0.5000 0.4388 ( 1432 PWs) bands (ev): -38.4586 -38.4586 -17.5332 -17.5332 -17.0339 -17.0339 -17.0280 -17.0280 7.7207 7.7207 7.7323 7.7323 7.8891 7.8891 8.5622 8.5622 8.6303 8.6303 9.7490 9.7490 9.8229 9.8229 9.8472 9.8472 14.4945 14.4945 14.8672 14.8672 15.0873 15.0873 k = 0.5000 0.5000 0.4490 ( 1432 PWs) bands (ev): -38.4584 -38.4584 -17.5337 -17.5337 -17.0336 -17.0336 -17.0295 -17.0295 7.7232 7.7232 7.7313 7.7313 7.8893 7.8893 8.5830 8.5830 8.6306 8.6306 9.7561 9.7561 9.8140 9.8140 9.8353 9.8353 14.4432 14.4432 14.9313 14.9313 15.0881 15.0881 k = 0.5000 0.5000 0.4592 ( 1432 PWs) bands (ev): -38.4582 -38.4582 -17.5341 -17.5341 -17.0333 -17.0333 -17.0307 -17.0307 7.7252 7.7252 7.7304 7.7304 7.8895 7.8895 8.6002 8.6002 8.6307 8.6307 9.7603 9.7603 9.8087 9.8087 9.8255 9.8255 14.4005 14.4005 14.9862 14.9862 15.0887 15.0887 k = 0.5000 0.5000 0.4694 ( 1448 PWs) bands (ev): -38.4581 -38.4581 -17.5346 -17.5346 -17.0333 -17.0333 -17.0317 -17.0317 7.7267 7.7267 7.7296 7.7296 7.8897 7.8897 8.6137 8.6137 8.6307 8.6307 9.7615 9.7615 9.8066 9.8066 9.8178 9.8178 14.3670 14.3670 15.0305 15.0305 15.0892 15.0892 k = 0.5000 0.5000 0.4796 ( 1456 PWs) bands (ev): -38.4580 -38.4580 -17.5349 -17.5349 -17.0332 -17.0332 -17.0324 -17.0324 7.7277 7.7277 7.7290 7.7290 7.8898 7.8898 8.6233 8.6233 8.6307 8.6307 9.7610 9.7610 9.8067 9.8067 9.8122 9.8122 14.3427 14.3427 15.0631 15.0631 15.0895 15.0895 k = 0.5000 0.5000 0.4898 ( 1472 PWs) bands (ev): -38.4579 -38.4579 -17.5351 -17.5351 -17.0331 -17.0331 -17.0330 -17.0330 7.7283 7.7283 7.7286 7.7286 7.8898 7.8898 8.6289 8.6289 8.6308 8.6308 9.7600 9.7600 9.8073 9.8073 9.8087 9.8087 14.3281 14.3281 15.0831 15.0831 15.0898 15.0898 k = 0.5000 0.5000 0.5000 ( 1472 PWs) bands (ev): -38.4579 -38.4579 -17.5352 -17.5352 -17.0331 -17.0331 -17.0331 -17.0331 7.7285 7.7285 7.7285 7.7285 7.8899 7.8899 8.6308 8.6308 8.6308 8.6308 9.7597 9.7597 9.8077 9.8077 9.8077 9.8077 14.3232 14.3232 15.0898 15.0898 15.0898 15.0898 Writing output data file ScCu.save init_run : 0.16s CPU 0.29s WALL ( 1 calls) electrons : 39.49s CPU 40.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 39.48s CPU 40.90s 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 : 0.04s CPU 0.04s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.02s WALL ( 375 calls) cegterg : 35.58s CPU 36.35s WALL ( 375 calls) Called by sum_band: Called by *egterg: h_psi : 16.99s CPU 17.97s WALL ( 5363 calls) s_psi : 0.98s CPU 0.98s WALL ( 5363 calls) g_psi : 0.02s CPU 0.05s WALL ( 4613 calls) cdiaghg : 17.20s CPU 17.20s WALL ( 4988 calls) cegterg:over : 1.20s CPU 1.26s WALL ( 4613 calls) cegterg:upda : 0.91s CPU 0.88s WALL ( 4613 calls) cegterg:last : 0.59s CPU 0.54s WALL ( 1129 calls) cdiaghg:chol : 0.79s CPU 0.86s WALL ( 4988 calls) cdiaghg:inve : 0.35s CPU 0.41s WALL ( 4988 calls) cdiaghg:para : 1.00s CPU 1.01s WALL ( 9976 calls) Called by h_psi: h_psi:vloc : 14.88s CPU 15.73s WALL ( 5363 calls) h_psi:vnl : 2.08s CPU 2.21s WALL ( 5363 calls) add_vuspsi : 1.22s CPU 1.31s WALL ( 5363 calls) General routines calbec : 0.86s CPU 0.89s WALL ( 5363 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 13.80s CPU 14.61s WALL ( 439380 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.09s CPU 0.12s WALL ( 750 calls) Parallel routines fft_scatter : 7.90s CPU 8.25s WALL ( 439403 calls) PWSCF : 47.58s CPU 58.84s WALL This run was terminated on: 17:57:36 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=