Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:17: 0 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: ./VTc.save/ file Tc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized file V.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3P 3P 3D 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 46 16 5 1438 311 55 Max 47 17 6 1443 323 58 Sum 1685 609 193 51867 11459 2007 bravais-lattice index = 14 lattice parameter (alat) = 5.7164 a.u. unit-cell volume = 186.7982 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 number of electrons = 28.00 number of Kohn-Sham states= 36 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 646.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.716421 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 Tc read from file: /users/gautes/Pseudo/Tc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 20e1f658a7aa6a4afb3e3f899e3635d1 Pseudo is Ultrasoft + core correction, Zval = 15.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1231 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 V read from file: /users/gautes/Pseudo/V.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 97c593a54d8a0043da5648c660d67431 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1181 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 Tc 15.00 98.00000 Tc( 1.00) V 13.00 50.94150 V( 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= 400 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025000 k( 2) = ( 0.0000000 0.0096154 -0.0000000), wk = 0.0025000 k( 3) = ( 0.0000000 0.0192308 -0.0000000), wk = 0.0025000 k( 4) = ( 0.0000000 0.0288462 -0.0000000), wk = 0.0025000 k( 5) = ( 0.0000000 0.0384615 -0.0000000), wk = 0.0025000 k( 6) = ( 0.0000000 0.0480769 -0.0000000), wk = 0.0025000 k( 7) = ( 0.0000000 0.0576923 -0.0000000), wk = 0.0025000 k( 8) = ( 0.0000000 0.0673077 -0.0000000), wk = 0.0025000 k( 9) = ( 0.0000000 0.0769231 -0.0000000), wk = 0.0025000 k( 10) = ( 0.0000000 0.0865385 -0.0000000), wk = 0.0025000 k( 11) = ( 0.0000000 0.0961538 -0.0000000), wk = 0.0025000 k( 12) = ( 0.0000000 0.1057692 -0.0000000), wk = 0.0025000 k( 13) = ( 0.0000000 0.1153846 -0.0000000), wk = 0.0025000 k( 14) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0025000 k( 15) = ( 0.0000000 0.1346154 -0.0000000), wk = 0.0025000 k( 16) = ( 0.0000000 0.1442308 -0.0000000), wk = 0.0025000 k( 17) = ( 0.0000000 0.1538461 -0.0000000), wk = 0.0025000 k( 18) = ( 0.0000000 0.1634615 -0.0000000), wk = 0.0025000 k( 19) = ( 0.0000000 0.1730769 -0.0000000), wk = 0.0025000 k( 20) = ( 0.0000000 0.1826923 -0.0000000), wk = 0.0025000 k( 21) = ( 0.0000000 0.1923077 -0.0000000), wk = 0.0025000 k( 22) = ( 0.0000000 0.2019231 -0.0000000), wk = 0.0025000 k( 23) = ( 0.0000000 0.2115385 -0.0000000), wk = 0.0025000 k( 24) = ( 0.0000000 0.2211539 -0.0000000), wk = 0.0025000 k( 25) = ( 0.0000000 0.2307692 -0.0000000), wk = 0.0025000 k( 26) = ( 0.0000000 0.2403846 -0.0000000), wk = 0.0025000 k( 27) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0025000 k( 28) = ( 0.0000000 0.2596154 -0.0000000), wk = 0.0025000 k( 29) = ( 0.0000000 0.2692308 -0.0000000), wk = 0.0025000 k( 30) = ( 0.0000000 0.2788462 -0.0000000), wk = 0.0025000 k( 31) = ( 0.0000000 0.2884615 -0.0000000), wk = 0.0025000 k( 32) = ( 0.0000000 0.2980769 -0.0000000), wk = 0.0025000 k( 33) = ( 0.0000000 0.3076923 -0.0000000), wk = 0.0025000 k( 34) = ( 0.0000000 0.3173077 -0.0000000), wk = 0.0025000 k( 35) = ( 0.0000000 0.3269231 -0.0000000), wk = 0.0025000 k( 36) = ( 0.0000000 0.3365385 -0.0000000), wk = 0.0025000 k( 37) = ( 0.0000000 0.3461538 -0.0000000), wk = 0.0025000 k( 38) = ( 0.0000000 0.3557692 -0.0000000), wk = 0.0025000 k( 39) = ( 0.0000000 0.3653846 -0.0000000), wk = 0.0025000 k( 40) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0025000 k( 41) = ( 0.0000000 0.3846154 -0.0000000), wk = 0.0025000 k( 42) = ( 0.0000000 0.3942308 -0.0000000), wk = 0.0025000 k( 43) = ( 0.0000000 0.4038462 -0.0000000), wk = 0.0025000 k( 44) = ( 0.0000000 0.4134615 -0.0000000), wk = 0.0025000 k( 45) = ( 0.0000000 0.4230769 -0.0000000), wk = 0.0025000 k( 46) = ( 0.0000000 0.4326923 -0.0000000), wk = 0.0025000 k( 47) = ( 0.0000000 0.4423077 -0.0000000), wk = 0.0025000 k( 48) = ( 0.0000000 0.4519231 -0.0000000), wk = 0.0025000 k( 49) = ( 0.0000000 0.4615385 -0.0000000), wk = 0.0025000 k( 50) = ( 0.0000000 0.4711538 -0.0000000), wk = 0.0025000 k( 51) = ( 0.0000000 0.4807692 -0.0000000), wk = 0.0025000 k( 52) = ( 0.0000000 0.4903846 -0.0000000), wk = 0.0025000 k( 53) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025000 k( 54) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025000 k( 55) = ( 0.0096154 0.5000000 -0.0000000), wk = 0.0025000 k( 56) = ( 0.0192308 0.5000000 -0.0000000), wk = 0.0025000 k( 57) = ( 0.0288462 0.5000000 -0.0000000), wk = 0.0025000 k( 58) = ( 0.0384615 0.5000000 -0.0000000), wk = 0.0025000 k( 59) = ( 0.0480769 0.5000000 -0.0000000), wk = 0.0025000 k( 60) = ( 0.0576923 0.5000000 -0.0000000), wk = 0.0025000 k( 61) = ( 0.0673077 0.5000000 -0.0000000), wk = 0.0025000 k( 62) = ( 0.0769231 0.5000000 -0.0000000), wk = 0.0025000 k( 63) = ( 0.0865385 0.5000000 -0.0000000), wk = 0.0025000 k( 64) = ( 0.0961538 0.5000000 -0.0000000), wk = 0.0025000 k( 65) = ( 0.1057692 0.5000000 -0.0000000), wk = 0.0025000 k( 66) = ( 0.1153846 0.5000000 -0.0000000), wk = 0.0025000 k( 67) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0025000 k( 68) = ( 0.1346154 0.5000000 -0.0000000), wk = 0.0025000 k( 69) = ( 0.1442308 0.5000000 -0.0000000), wk = 0.0025000 k( 70) = ( 0.1538461 0.5000000 -0.0000000), wk = 0.0025000 k( 71) = ( 0.1634615 0.5000000 -0.0000000), wk = 0.0025000 k( 72) = ( 0.1730769 0.5000000 -0.0000000), wk = 0.0025000 k( 73) = ( 0.1826923 0.5000000 -0.0000000), wk = 0.0025000 k( 74) = ( 0.1923077 0.5000000 -0.0000000), wk = 0.0025000 k( 75) = ( 0.2019231 0.5000000 -0.0000000), wk = 0.0025000 k( 76) = ( 0.2115385 0.5000000 -0.0000000), wk = 0.0025000 k( 77) = ( 0.2211539 0.5000000 -0.0000000), wk = 0.0025000 k( 78) = ( 0.2307692 0.5000000 -0.0000000), wk = 0.0025000 k( 79) = ( 0.2403846 0.5000000 -0.0000000), wk = 0.0025000 k( 80) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0025000 k( 81) = ( 0.2596154 0.5000000 -0.0000000), wk = 0.0025000 k( 82) = ( 0.2692308 0.5000000 -0.0000000), wk = 0.0025000 k( 83) = ( 0.2788462 0.5000000 -0.0000000), wk = 0.0025000 k( 84) = ( 0.2884615 0.5000000 -0.0000000), wk = 0.0025000 k( 85) = ( 0.2980769 0.5000000 -0.0000000), wk = 0.0025000 k( 86) = ( 0.3076923 0.5000000 -0.0000000), wk = 0.0025000 k( 87) = ( 0.3173077 0.5000000 -0.0000000), wk = 0.0025000 k( 88) = ( 0.3269231 0.5000000 -0.0000000), wk = 0.0025000 k( 89) = ( 0.3365385 0.5000000 -0.0000000), wk = 0.0025000 k( 90) = ( 0.3461538 0.5000000 -0.0000000), wk = 0.0025000 k( 91) = ( 0.3557692 0.5000000 -0.0000000), wk = 0.0025000 k( 92) = ( 0.3653846 0.5000000 -0.0000000), wk = 0.0025000 k( 93) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0025000 k( 94) = ( 0.3846154 0.5000000 -0.0000000), wk = 0.0025000 k( 95) = ( 0.3942308 0.5000000 -0.0000000), wk = 0.0025000 k( 96) = ( 0.4038462 0.5000000 -0.0000000), wk = 0.0025000 k( 97) = ( 0.4134615 0.5000000 -0.0000000), wk = 0.0025000 k( 98) = ( 0.4230769 0.5000000 -0.0000000), wk = 0.0025000 k( 99) = ( 0.4326923 0.5000000 -0.0000000), wk = 0.0025000 k( 100) = ( 0.4423077 0.5000000 -0.0000000), wk = 0.0025000 k( 101) = ( 0.4519231 0.5000000 -0.0000000), wk = 0.0025000 k( 102) = ( 0.4615385 0.5000000 -0.0000000), wk = 0.0025000 k( 103) = ( 0.4711538 0.5000000 -0.0000000), wk = 0.0025000 k( 104) = ( 0.4807692 0.5000000 -0.0000000), wk = 0.0025000 k( 105) = ( 0.4903846 0.5000000 -0.0000000), wk = 0.0025000 k( 106) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025000 k( 107) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025000 k( 108) = ( 0.4932432 0.4932432 -0.0000000), wk = 0.0025000 k( 109) = ( 0.4864865 0.4864865 -0.0000000), wk = 0.0025000 k( 110) = ( 0.4797297 0.4797297 -0.0000000), wk = 0.0025000 k( 111) = ( 0.4729730 0.4729730 -0.0000000), wk = 0.0025000 k( 112) = ( 0.4662162 0.4662162 -0.0000000), wk = 0.0025000 k( 113) = ( 0.4594595 0.4594595 -0.0000000), wk = 0.0025000 k( 114) = ( 0.4527027 0.4527027 -0.0000000), wk = 0.0025000 k( 115) = ( 0.4459459 0.4459459 -0.0000000), wk = 0.0025000 k( 116) = ( 0.4391892 0.4391892 -0.0000000), wk = 0.0025000 k( 117) = ( 0.4324324 0.4324324 -0.0000000), wk = 0.0025000 k( 118) = ( 0.4256757 0.4256757 -0.0000000), wk = 0.0025000 k( 119) = ( 0.4189189 0.4189189 -0.0000000), wk = 0.0025000 k( 120) = ( 0.4121622 0.4121622 -0.0000000), wk = 0.0025000 k( 121) = ( 0.4054054 0.4054054 -0.0000000), wk = 0.0025000 k( 122) = ( 0.3986486 0.3986486 -0.0000000), wk = 0.0025000 k( 123) = ( 0.3918919 0.3918919 -0.0000000), wk = 0.0025000 k( 124) = ( 0.3851351 0.3851351 -0.0000000), wk = 0.0025000 k( 125) = ( 0.3783784 0.3783784 -0.0000000), wk = 0.0025000 k( 126) = ( 0.3716216 0.3716216 -0.0000000), wk = 0.0025000 k( 127) = ( 0.3648649 0.3648649 -0.0000000), wk = 0.0025000 k( 128) = ( 0.3581081 0.3581081 -0.0000000), wk = 0.0025000 k( 129) = ( 0.3513514 0.3513513 -0.0000000), wk = 0.0025000 k( 130) = ( 0.3445946 0.3445946 -0.0000000), wk = 0.0025000 k( 131) = ( 0.3378378 0.3378378 -0.0000000), wk = 0.0025000 k( 132) = ( 0.3310811 0.3310811 -0.0000000), wk = 0.0025000 k( 133) = ( 0.3243243 0.3243243 -0.0000000), wk = 0.0025000 k( 134) = ( 0.3175676 0.3175676 -0.0000000), wk = 0.0025000 k( 135) = ( 0.3108108 0.3108108 -0.0000000), wk = 0.0025000 k( 136) = ( 0.3040541 0.3040540 -0.0000000), wk = 0.0025000 k( 137) = ( 0.2972973 0.2972973 -0.0000000), wk = 0.0025000 k( 138) = ( 0.2905405 0.2905405 -0.0000000), wk = 0.0025000 k( 139) = ( 0.2837838 0.2837838 -0.0000000), wk = 0.0025000 k( 140) = ( 0.2770270 0.2770270 -0.0000000), wk = 0.0025000 k( 141) = ( 0.2702703 0.2702703 -0.0000000), wk = 0.0025000 k( 142) = ( 0.2635135 0.2635135 -0.0000000), wk = 0.0025000 k( 143) = ( 0.2567568 0.2567568 -0.0000000), wk = 0.0025000 k( 144) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0025000 k( 145) = ( 0.2432432 0.2432432 -0.0000000), wk = 0.0025000 k( 146) = ( 0.2364865 0.2364865 -0.0000000), wk = 0.0025000 k( 147) = ( 0.2297297 0.2297297 -0.0000000), wk = 0.0025000 k( 148) = ( 0.2229730 0.2229730 -0.0000000), wk = 0.0025000 k( 149) = ( 0.2162162 0.2162162 -0.0000000), wk = 0.0025000 k( 150) = ( 0.2094595 0.2094595 -0.0000000), wk = 0.0025000 k( 151) = ( 0.2027027 0.2027027 -0.0000000), wk = 0.0025000 k( 152) = ( 0.1959460 0.1959459 -0.0000000), wk = 0.0025000 k( 153) = ( 0.1891892 0.1891892 -0.0000000), wk = 0.0025000 k( 154) = ( 0.1824324 0.1824324 -0.0000000), wk = 0.0025000 k( 155) = ( 0.1756757 0.1756757 -0.0000000), wk = 0.0025000 k( 156) = ( 0.1689189 0.1689189 -0.0000000), wk = 0.0025000 k( 157) = ( 0.1621622 0.1621622 -0.0000000), wk = 0.0025000 k( 158) = ( 0.1554054 0.1554054 -0.0000000), wk = 0.0025000 k( 159) = ( 0.1486486 0.1486486 -0.0000000), wk = 0.0025000 k( 160) = ( 0.1418919 0.1418919 -0.0000000), wk = 0.0025000 k( 161) = ( 0.1351351 0.1351351 -0.0000000), wk = 0.0025000 k( 162) = ( 0.1283784 0.1283784 -0.0000000), wk = 0.0025000 k( 163) = ( 0.1216216 0.1216216 -0.0000000), wk = 0.0025000 k( 164) = ( 0.1148649 0.1148649 -0.0000000), wk = 0.0025000 k( 165) = ( 0.1081081 0.1081081 -0.0000000), wk = 0.0025000 k( 166) = ( 0.1013514 0.1013513 -0.0000000), wk = 0.0025000 k( 167) = ( 0.0945946 0.0945946 -0.0000000), wk = 0.0025000 k( 168) = ( 0.0878378 0.0878378 -0.0000000), wk = 0.0025000 k( 169) = ( 0.0810811 0.0810811 -0.0000000), wk = 0.0025000 k( 170) = ( 0.0743243 0.0743243 -0.0000000), wk = 0.0025000 k( 171) = ( 0.0675676 0.0675676 -0.0000000), wk = 0.0025000 k( 172) = ( 0.0608108 0.0608108 -0.0000000), wk = 0.0025000 k( 173) = ( 0.0540540 0.0540540 -0.0000000), wk = 0.0025000 k( 174) = ( 0.0472973 0.0472973 -0.0000000), wk = 0.0025000 k( 175) = ( 0.0405405 0.0405405 -0.0000000), wk = 0.0025000 k( 176) = ( 0.0337838 0.0337838 -0.0000000), wk = 0.0025000 k( 177) = ( 0.0270270 0.0270270 -0.0000000), wk = 0.0025000 k( 178) = ( 0.0202703 0.0202703 -0.0000000), wk = 0.0025000 k( 179) = ( 0.0135135 0.0135135 -0.0000000), wk = 0.0025000 k( 180) = ( 0.0067568 0.0067568 -0.0000000), wk = 0.0025000 k( 181) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025000 k( 182) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025000 k( 183) = ( 0.0055556 0.0055556 0.0055556), wk = 0.0025000 k( 184) = ( 0.0111111 0.0111111 0.0111111), wk = 0.0025000 k( 185) = ( 0.0166667 0.0166667 0.0166667), wk = 0.0025000 k( 186) = ( 0.0222222 0.0222222 0.0222222), wk = 0.0025000 k( 187) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0025000 k( 188) = ( 0.0333333 0.0333333 0.0333333), wk = 0.0025000 k( 189) = ( 0.0388889 0.0388889 0.0388889), wk = 0.0025000 k( 190) = ( 0.0444444 0.0444444 0.0444444), wk = 0.0025000 k( 191) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0025000 k( 192) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0025000 k( 193) = ( 0.0611111 0.0611111 0.0611111), wk = 0.0025000 k( 194) = ( 0.0666667 0.0666667 0.0666667), wk = 0.0025000 k( 195) = ( 0.0722222 0.0722222 0.0722222), wk = 0.0025000 k( 196) = ( 0.0777778 0.0777778 0.0777778), wk = 0.0025000 k( 197) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0025000 k( 198) = ( 0.0888889 0.0888889 0.0888889), wk = 0.0025000 k( 199) = ( 0.0944444 0.0944444 0.0944444), wk = 0.0025000 k( 200) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0025000 k( 201) = ( 0.1055556 0.1055556 0.1055556), wk = 0.0025000 k( 202) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0025000 k( 203) = ( 0.1166667 0.1166667 0.1166667), wk = 0.0025000 k( 204) = ( 0.1222222 0.1222222 0.1222222), wk = 0.0025000 k( 205) = ( 0.1277778 0.1277778 0.1277778), wk = 0.0025000 k( 206) = ( 0.1333333 0.1333333 0.1333333), wk = 0.0025000 k( 207) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0025000 k( 208) = ( 0.1444444 0.1444444 0.1444444), wk = 0.0025000 k( 209) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0025000 k( 210) = ( 0.1555556 0.1555556 0.1555556), wk = 0.0025000 k( 211) = ( 0.1611111 0.1611111 0.1611111), wk = 0.0025000 k( 212) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0025000 k( 213) = ( 0.1722222 0.1722222 0.1722222), wk = 0.0025000 k( 214) = ( 0.1777778 0.1777778 0.1777778), wk = 0.0025000 k( 215) = ( 0.1833333 0.1833333 0.1833333), wk = 0.0025000 k( 216) = ( 0.1888889 0.1888889 0.1888889), wk = 0.0025000 k( 217) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0025000 k( 218) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0025000 k( 219) = ( 0.2055556 0.2055556 0.2055556), wk = 0.0025000 k( 220) = ( 0.2111111 0.2111111 0.2111111), wk = 0.0025000 k( 221) = ( 0.2166667 0.2166667 0.2166667), wk = 0.0025000 k( 222) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0025000 k( 223) = ( 0.2277778 0.2277778 0.2277778), wk = 0.0025000 k( 224) = ( 0.2333333 0.2333333 0.2333333), wk = 0.0025000 k( 225) = ( 0.2388889 0.2388889 0.2388889), wk = 0.0025000 k( 226) = ( 0.2444444 0.2444444 0.2444444), wk = 0.0025000 k( 227) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025000 k( 228) = ( 0.2555556 0.2555556 0.2555556), wk = 0.0025000 k( 229) = ( 0.2611111 0.2611111 0.2611111), wk = 0.0025000 k( 230) = ( 0.2666667 0.2666667 0.2666667), wk = 0.0025000 k( 231) = ( 0.2722222 0.2722222 0.2722222), wk = 0.0025000 k( 232) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0025000 k( 233) = ( 0.2833333 0.2833333 0.2833333), wk = 0.0025000 k( 234) = ( 0.2888889 0.2888889 0.2888889), wk = 0.0025000 k( 235) = ( 0.2944444 0.2944444 0.2944444), wk = 0.0025000 k( 236) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0025000 k( 237) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0025000 k( 238) = ( 0.3111111 0.3111111 0.3111111), wk = 0.0025000 k( 239) = ( 0.3166667 0.3166667 0.3166667), wk = 0.0025000 k( 240) = ( 0.3222222 0.3222222 0.3222222), wk = 0.0025000 k( 241) = ( 0.3277778 0.3277778 0.3277778), wk = 0.0025000 k( 242) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0025000 k( 243) = ( 0.3388889 0.3388889 0.3388889), wk = 0.0025000 k( 244) = ( 0.3444444 0.3444444 0.3444444), wk = 0.0025000 k( 245) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0025000 k( 246) = ( 0.3555556 0.3555556 0.3555556), wk = 0.0025000 k( 247) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0025000 k( 248) = ( 0.3666667 0.3666667 0.3666667), wk = 0.0025000 k( 249) = ( 0.3722222 0.3722222 0.3722222), wk = 0.0025000 k( 250) = ( 0.3777778 0.3777778 0.3777778), wk = 0.0025000 k( 251) = ( 0.3833333 0.3833333 0.3833333), wk = 0.0025000 k( 252) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0025000 k( 253) = ( 0.3944444 0.3944444 0.3944444), wk = 0.0025000 k( 254) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0025000 k( 255) = ( 0.4055556 0.4055556 0.4055556), wk = 0.0025000 k( 256) = ( 0.4111111 0.4111111 0.4111111), wk = 0.0025000 k( 257) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0025000 k( 258) = ( 0.4222222 0.4222222 0.4222222), wk = 0.0025000 k( 259) = ( 0.4277778 0.4277778 0.4277778), wk = 0.0025000 k( 260) = ( 0.4333333 0.4333333 0.4333333), wk = 0.0025000 k( 261) = ( 0.4388889 0.4388889 0.4388889), wk = 0.0025000 k( 262) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0025000 k( 263) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0025000 k( 264) = ( 0.4555556 0.4555556 0.4555556), wk = 0.0025000 k( 265) = ( 0.4611111 0.4611111 0.4611111), wk = 0.0025000 k( 266) = ( 0.4666667 0.4666667 0.4666667), wk = 0.0025000 k( 267) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0025000 k( 268) = ( 0.4777778 0.4777778 0.4777778), wk = 0.0025000 k( 269) = ( 0.4833333 0.4833333 0.4833333), wk = 0.0025000 k( 270) = ( 0.4888889 0.4888889 0.4888889), wk = 0.0025000 k( 271) = ( 0.4944444 0.4944444 0.4944444), wk = 0.0025000 k( 272) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025000 k( 273) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025000 k( 274) = ( 0.4932432 0.5000000 0.4932432), wk = 0.0025000 k( 275) = ( 0.4864865 0.5000000 0.4864865), wk = 0.0025000 k( 276) = ( 0.4797297 0.5000000 0.4797297), wk = 0.0025000 k( 277) = ( 0.4729730 0.5000000 0.4729730), wk = 0.0025000 k( 278) = ( 0.4662162 0.5000000 0.4662162), wk = 0.0025000 k( 279) = ( 0.4594595 0.5000000 0.4594595), wk = 0.0025000 k( 280) = ( 0.4527027 0.5000000 0.4527027), wk = 0.0025000 k( 281) = ( 0.4459459 0.5000000 0.4459459), wk = 0.0025000 k( 282) = ( 0.4391892 0.5000000 0.4391892), wk = 0.0025000 k( 283) = ( 0.4324324 0.5000000 0.4324324), wk = 0.0025000 k( 284) = ( 0.4256757 0.5000000 0.4256757), wk = 0.0025000 k( 285) = ( 0.4189189 0.5000000 0.4189189), wk = 0.0025000 k( 286) = ( 0.4121622 0.5000000 0.4121622), wk = 0.0025000 k( 287) = ( 0.4054054 0.5000000 0.4054054), wk = 0.0025000 k( 288) = ( 0.3986486 0.5000000 0.3986486), wk = 0.0025000 k( 289) = ( 0.3918919 0.5000000 0.3918919), wk = 0.0025000 k( 290) = ( 0.3851351 0.5000000 0.3851351), wk = 0.0025000 k( 291) = ( 0.3783784 0.5000000 0.3783784), wk = 0.0025000 k( 292) = ( 0.3716216 0.5000000 0.3716216), wk = 0.0025000 k( 293) = ( 0.3648649 0.5000000 0.3648649), wk = 0.0025000 k( 294) = ( 0.3581081 0.5000000 0.3581081), wk = 0.0025000 k( 295) = ( 0.3513514 0.5000000 0.3513513), wk = 0.0025000 k( 296) = ( 0.3445946 0.5000000 0.3445946), wk = 0.0025000 k( 297) = ( 0.3378378 0.5000000 0.3378378), wk = 0.0025000 k( 298) = ( 0.3310811 0.5000000 0.3310811), wk = 0.0025000 k( 299) = ( 0.3243243 0.5000000 0.3243243), wk = 0.0025000 k( 300) = ( 0.3175676 0.5000000 0.3175676), wk = 0.0025000 k( 301) = ( 0.3108108 0.5000000 0.3108108), wk = 0.0025000 k( 302) = ( 0.3040541 0.5000000 0.3040540), wk = 0.0025000 k( 303) = ( 0.2972973 0.5000000 0.2972973), wk = 0.0025000 k( 304) = ( 0.2905405 0.5000000 0.2905405), wk = 0.0025000 k( 305) = ( 0.2837838 0.5000000 0.2837838), wk = 0.0025000 k( 306) = ( 0.2770270 0.5000000 0.2770270), wk = 0.0025000 k( 307) = ( 0.2702703 0.5000000 0.2702703), wk = 0.0025000 k( 308) = ( 0.2635135 0.5000000 0.2635135), wk = 0.0025000 k( 309) = ( 0.2567568 0.5000000 0.2567568), wk = 0.0025000 k( 310) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0025000 k( 311) = ( 0.2432432 0.5000000 0.2432432), wk = 0.0025000 k( 312) = ( 0.2364865 0.5000000 0.2364865), wk = 0.0025000 k( 313) = ( 0.2297297 0.5000000 0.2297297), wk = 0.0025000 k( 314) = ( 0.2229730 0.5000000 0.2229730), wk = 0.0025000 k( 315) = ( 0.2162162 0.5000000 0.2162162), wk = 0.0025000 k( 316) = ( 0.2094595 0.5000000 0.2094595), wk = 0.0025000 k( 317) = ( 0.2027027 0.5000000 0.2027027), wk = 0.0025000 k( 318) = ( 0.1959460 0.5000000 0.1959459), wk = 0.0025000 k( 319) = ( 0.1891892 0.5000000 0.1891892), wk = 0.0025000 k( 320) = ( 0.1824324 0.5000000 0.1824324), wk = 0.0025000 k( 321) = ( 0.1756757 0.5000000 0.1756757), wk = 0.0025000 k( 322) = ( 0.1689189 0.5000000 0.1689189), wk = 0.0025000 k( 323) = ( 0.1621622 0.5000000 0.1621622), wk = 0.0025000 k( 324) = ( 0.1554054 0.5000000 0.1554054), wk = 0.0025000 k( 325) = ( 0.1486486 0.5000000 0.1486486), wk = 0.0025000 k( 326) = ( 0.1418919 0.5000000 0.1418919), wk = 0.0025000 k( 327) = ( 0.1351351 0.5000000 0.1351351), wk = 0.0025000 k( 328) = ( 0.1283784 0.5000000 0.1283784), wk = 0.0025000 k( 329) = ( 0.1216216 0.5000000 0.1216216), wk = 0.0025000 k( 330) = ( 0.1148649 0.5000000 0.1148649), wk = 0.0025000 k( 331) = ( 0.1081081 0.5000000 0.1081081), wk = 0.0025000 k( 332) = ( 0.1013514 0.5000000 0.1013513), wk = 0.0025000 k( 333) = ( 0.0945946 0.5000000 0.0945946), wk = 0.0025000 k( 334) = ( 0.0878378 0.5000000 0.0878378), wk = 0.0025000 k( 335) = ( 0.0810811 0.5000000 0.0810811), wk = 0.0025000 k( 336) = ( 0.0743243 0.5000000 0.0743243), wk = 0.0025000 k( 337) = ( 0.0675676 0.5000000 0.0675676), wk = 0.0025000 k( 338) = ( 0.0608108 0.5000000 0.0608108), wk = 0.0025000 k( 339) = ( 0.0540540 0.5000000 0.0540540), wk = 0.0025000 k( 340) = ( 0.0472973 0.5000000 0.0472973), wk = 0.0025000 k( 341) = ( 0.0405405 0.5000000 0.0405405), wk = 0.0025000 k( 342) = ( 0.0337838 0.5000000 0.0337838), wk = 0.0025000 k( 343) = ( 0.0270270 0.5000000 0.0270270), wk = 0.0025000 k( 344) = ( 0.0202703 0.5000000 0.0202703), wk = 0.0025000 k( 345) = ( 0.0135135 0.5000000 0.0135135), wk = 0.0025000 k( 346) = ( 0.0067568 0.5000000 0.0067568), wk = 0.0025000 k( 347) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025000 k( 348) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025000 k( 349) = ( 0.5000000 0.5000000 0.0096154), wk = 0.0025000 k( 350) = ( 0.5000000 0.5000000 0.0192308), wk = 0.0025000 k( 351) = ( 0.5000000 0.5000000 0.0288461), wk = 0.0025000 k( 352) = ( 0.5000000 0.5000000 0.0384615), wk = 0.0025000 k( 353) = ( 0.5000000 0.5000000 0.0480769), wk = 0.0025000 k( 354) = ( 0.5000000 0.5000000 0.0576923), wk = 0.0025000 k( 355) = ( 0.5000000 0.5000000 0.0673077), wk = 0.0025000 k( 356) = ( 0.5000000 0.5000000 0.0769231), wk = 0.0025000 k( 357) = ( 0.5000000 0.5000000 0.0865385), wk = 0.0025000 k( 358) = ( 0.5000000 0.5000000 0.0961538), wk = 0.0025000 k( 359) = ( 0.5000000 0.5000000 0.1057692), wk = 0.0025000 k( 360) = ( 0.5000000 0.5000000 0.1153846), wk = 0.0025000 k( 361) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0025000 k( 362) = ( 0.5000000 0.5000000 0.1346154), wk = 0.0025000 k( 363) = ( 0.5000000 0.5000000 0.1442308), wk = 0.0025000 k( 364) = ( 0.5000000 0.5000000 0.1538461), wk = 0.0025000 k( 365) = ( 0.5000000 0.5000000 0.1634615), wk = 0.0025000 k( 366) = ( 0.5000000 0.5000000 0.1730769), wk = 0.0025000 k( 367) = ( 0.5000000 0.5000000 0.1826923), wk = 0.0025000 k( 368) = ( 0.5000000 0.5000000 0.1923077), wk = 0.0025000 k( 369) = ( 0.5000000 0.5000000 0.2019231), wk = 0.0025000 k( 370) = ( 0.5000000 0.5000000 0.2115385), wk = 0.0025000 k( 371) = ( 0.5000000 0.5000000 0.2211538), wk = 0.0025000 k( 372) = ( 0.5000000 0.5000000 0.2307692), wk = 0.0025000 k( 373) = ( 0.5000000 0.5000000 0.2403846), wk = 0.0025000 k( 374) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0025000 k( 375) = ( 0.5000000 0.5000000 0.2596154), wk = 0.0025000 k( 376) = ( 0.5000000 0.5000000 0.2692308), wk = 0.0025000 k( 377) = ( 0.5000000 0.5000000 0.2788461), wk = 0.0025000 k( 378) = ( 0.5000000 0.5000000 0.2884615), wk = 0.0025000 k( 379) = ( 0.5000000 0.5000000 0.2980769), wk = 0.0025000 k( 380) = ( 0.5000000 0.5000000 0.3076923), wk = 0.0025000 k( 381) = ( 0.5000000 0.5000000 0.3173077), wk = 0.0025000 k( 382) = ( 0.5000000 0.5000000 0.3269231), wk = 0.0025000 k( 383) = ( 0.5000000 0.5000000 0.3365385), wk = 0.0025000 k( 384) = ( 0.5000000 0.5000000 0.3461538), wk = 0.0025000 k( 385) = ( 0.5000000 0.5000000 0.3557692), wk = 0.0025000 k( 386) = ( 0.5000000 0.5000000 0.3653846), wk = 0.0025000 k( 387) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0025000 k( 388) = ( 0.5000000 0.5000000 0.3846154), wk = 0.0025000 k( 389) = ( 0.5000000 0.5000000 0.3942308), wk = 0.0025000 k( 390) = ( 0.5000000 0.5000000 0.4038461), wk = 0.0025000 k( 391) = ( 0.5000000 0.5000000 0.4134615), wk = 0.0025000 k( 392) = ( 0.5000000 0.5000000 0.4230769), wk = 0.0025000 k( 393) = ( 0.5000000 0.5000000 0.4326923), wk = 0.0025000 k( 394) = ( 0.5000000 0.5000000 0.4423077), wk = 0.0025000 k( 395) = ( 0.5000000 0.5000000 0.4519231), wk = 0.0025000 k( 396) = ( 0.5000000 0.5000000 0.4615385), wk = 0.0025000 k( 397) = ( 0.5000000 0.5000000 0.4711538), wk = 0.0025000 k( 398) = ( 0.5000000 0.5000000 0.4807692), wk = 0.0025000 k( 399) = ( 0.5000000 0.5000000 0.4903846), wk = 0.0025000 k( 400) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025000 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025000 k( 2) = ( 0.0000000 0.0096154 0.0000000), wk = 0.0025000 k( 3) = ( 0.0000000 0.0192308 0.0000000), wk = 0.0025000 k( 4) = ( 0.0000000 0.0288462 0.0000000), wk = 0.0025000 k( 5) = ( 0.0000000 0.0384615 0.0000000), wk = 0.0025000 k( 6) = ( 0.0000000 0.0480769 0.0000000), wk = 0.0025000 k( 7) = ( 0.0000000 0.0576923 0.0000000), wk = 0.0025000 k( 8) = ( 0.0000000 0.0673077 0.0000000), wk = 0.0025000 k( 9) = ( 0.0000000 0.0769231 0.0000000), wk = 0.0025000 k( 10) = ( 0.0000000 0.0865385 0.0000000), wk = 0.0025000 k( 11) = ( 0.0000000 0.0961538 0.0000000), wk = 0.0025000 k( 12) = ( 0.0000000 0.1057692 0.0000000), wk = 0.0025000 k( 13) = ( 0.0000000 0.1153846 0.0000000), wk = 0.0025000 k( 14) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0025000 k( 15) = ( 0.0000000 0.1346154 0.0000000), wk = 0.0025000 k( 16) = ( 0.0000000 0.1442308 0.0000000), wk = 0.0025000 k( 17) = ( 0.0000000 0.1538461 0.0000000), wk = 0.0025000 k( 18) = ( 0.0000000 0.1634615 0.0000000), wk = 0.0025000 k( 19) = ( 0.0000000 0.1730769 0.0000000), wk = 0.0025000 k( 20) = ( 0.0000000 0.1826923 0.0000000), wk = 0.0025000 k( 21) = ( 0.0000000 0.1923077 0.0000000), wk = 0.0025000 k( 22) = ( 0.0000000 0.2019231 0.0000000), wk = 0.0025000 k( 23) = ( 0.0000000 0.2115385 0.0000000), wk = 0.0025000 k( 24) = ( 0.0000000 0.2211539 0.0000000), wk = 0.0025000 k( 25) = ( 0.0000000 0.2307692 0.0000000), wk = 0.0025000 k( 26) = ( 0.0000000 0.2403846 0.0000000), wk = 0.0025000 k( 27) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0025000 k( 28) = ( 0.0000000 0.2596154 0.0000000), wk = 0.0025000 k( 29) = ( 0.0000000 0.2692308 0.0000000), wk = 0.0025000 k( 30) = ( 0.0000000 0.2788462 0.0000000), wk = 0.0025000 k( 31) = ( 0.0000000 0.2884615 0.0000000), wk = 0.0025000 k( 32) = ( 0.0000000 0.2980769 0.0000000), wk = 0.0025000 k( 33) = ( 0.0000000 0.3076923 0.0000000), wk = 0.0025000 k( 34) = ( 0.0000000 0.3173077 0.0000000), wk = 0.0025000 k( 35) = ( 0.0000000 0.3269231 0.0000000), wk = 0.0025000 k( 36) = ( 0.0000000 0.3365385 0.0000000), wk = 0.0025000 k( 37) = ( 0.0000000 0.3461538 0.0000000), wk = 0.0025000 k( 38) = ( 0.0000000 0.3557692 0.0000000), wk = 0.0025000 k( 39) = ( 0.0000000 0.3653846 0.0000000), wk = 0.0025000 k( 40) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0025000 k( 41) = ( 0.0000000 0.3846154 0.0000000), wk = 0.0025000 k( 42) = ( 0.0000000 0.3942308 0.0000000), wk = 0.0025000 k( 43) = ( 0.0000000 0.4038462 0.0000000), wk = 0.0025000 k( 44) = ( 0.0000000 0.4134615 0.0000000), wk = 0.0025000 k( 45) = ( 0.0000000 0.4230769 0.0000000), wk = 0.0025000 k( 46) = ( 0.0000000 0.4326923 0.0000000), wk = 0.0025000 k( 47) = ( 0.0000000 0.4423077 0.0000000), wk = 0.0025000 k( 48) = ( 0.0000000 0.4519231 0.0000000), wk = 0.0025000 k( 49) = ( 0.0000000 0.4615385 0.0000000), wk = 0.0025000 k( 50) = ( 0.0000000 0.4711538 0.0000000), wk = 0.0025000 k( 51) = ( 0.0000000 0.4807692 0.0000000), wk = 0.0025000 k( 52) = ( 0.0000000 0.4903846 0.0000000), wk = 0.0025000 k( 53) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025000 k( 54) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025000 k( 55) = ( 0.0096154 0.5000000 0.0000000), wk = 0.0025000 k( 56) = ( 0.0192308 0.5000000 0.0000000), wk = 0.0025000 k( 57) = ( 0.0288462 0.5000000 0.0000000), wk = 0.0025000 k( 58) = ( 0.0384615 0.5000000 0.0000000), wk = 0.0025000 k( 59) = ( 0.0480769 0.5000000 0.0000000), wk = 0.0025000 k( 60) = ( 0.0576923 0.5000000 0.0000000), wk = 0.0025000 k( 61) = ( 0.0673077 0.5000000 0.0000000), wk = 0.0025000 k( 62) = ( 0.0769231 0.5000000 0.0000000), wk = 0.0025000 k( 63) = ( 0.0865385 0.5000000 0.0000000), wk = 0.0025000 k( 64) = ( 0.0961538 0.5000000 0.0000000), wk = 0.0025000 k( 65) = ( 0.1057692 0.5000000 0.0000000), wk = 0.0025000 k( 66) = ( 0.1153846 0.5000000 0.0000000), wk = 0.0025000 k( 67) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0025000 k( 68) = ( 0.1346154 0.5000000 0.0000000), wk = 0.0025000 k( 69) = ( 0.1442308 0.5000000 0.0000000), wk = 0.0025000 k( 70) = ( 0.1538461 0.5000000 0.0000000), wk = 0.0025000 k( 71) = ( 0.1634615 0.5000000 0.0000000), wk = 0.0025000 k( 72) = ( 0.1730769 0.5000000 0.0000000), wk = 0.0025000 k( 73) = ( 0.1826923 0.5000000 0.0000000), wk = 0.0025000 k( 74) = ( 0.1923077 0.5000000 0.0000000), wk = 0.0025000 k( 75) = ( 0.2019231 0.5000000 0.0000000), wk = 0.0025000 k( 76) = ( 0.2115385 0.5000000 0.0000000), wk = 0.0025000 k( 77) = ( 0.2211539 0.5000000 0.0000000), wk = 0.0025000 k( 78) = ( 0.2307692 0.5000000 0.0000000), wk = 0.0025000 k( 79) = ( 0.2403846 0.5000000 0.0000000), wk = 0.0025000 k( 80) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0025000 k( 81) = ( 0.2596154 0.5000000 0.0000000), wk = 0.0025000 k( 82) = ( 0.2692308 0.5000000 0.0000000), wk = 0.0025000 k( 83) = ( 0.2788462 0.5000000 0.0000000), wk = 0.0025000 k( 84) = ( 0.2884615 0.5000000 0.0000000), wk = 0.0025000 k( 85) = ( 0.2980769 0.5000000 -0.0000000), wk = 0.0025000 k( 86) = ( 0.3076923 0.5000000 0.0000000), wk = 0.0025000 k( 87) = ( 0.3173077 0.5000000 0.0000000), wk = 0.0025000 k( 88) = ( 0.3269231 0.5000000 0.0000000), wk = 0.0025000 k( 89) = ( 0.3365385 0.5000000 0.0000000), wk = 0.0025000 k( 90) = ( 0.3461538 0.5000000 0.0000000), wk = 0.0025000 k( 91) = ( 0.3557692 0.5000000 0.0000000), wk = 0.0025000 k( 92) = ( 0.3653846 0.5000000 -0.0000000), wk = 0.0025000 k( 93) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0025000 k( 94) = ( 0.3846154 0.5000000 0.0000000), wk = 0.0025000 k( 95) = ( 0.3942308 0.5000000 0.0000000), wk = 0.0025000 k( 96) = ( 0.4038462 0.5000000 0.0000000), wk = 0.0025000 k( 97) = ( 0.4134615 0.5000000 0.0000000), wk = 0.0025000 k( 98) = ( 0.4230769 0.5000000 0.0000000), wk = 0.0025000 k( 99) = ( 0.4326923 0.5000000 0.0000000), wk = 0.0025000 k( 100) = ( 0.4423077 0.5000000 0.0000000), wk = 0.0025000 k( 101) = ( 0.4519231 0.5000000 0.0000000), wk = 0.0025000 k( 102) = ( 0.4615385 0.5000000 0.0000000), wk = 0.0025000 k( 103) = ( 0.4711538 0.5000000 0.0000000), wk = 0.0025000 k( 104) = ( 0.4807692 0.5000000 0.0000000), wk = 0.0025000 k( 105) = ( 0.4903846 0.5000000 0.0000000), wk = 0.0025000 k( 106) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025000 k( 107) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025000 k( 108) = ( 0.4932432 0.4932432 0.0000000), wk = 0.0025000 k( 109) = ( 0.4864865 0.4864865 0.0000000), wk = 0.0025000 k( 110) = ( 0.4797297 0.4797297 0.0000000), wk = 0.0025000 k( 111) = ( 0.4729730 0.4729730 0.0000000), wk = 0.0025000 k( 112) = ( 0.4662162 0.4662162 0.0000000), wk = 0.0025000 k( 113) = ( 0.4594595 0.4594595 0.0000000), wk = 0.0025000 k( 114) = ( 0.4527027 0.4527027 0.0000000), wk = 0.0025000 k( 115) = ( 0.4459459 0.4459459 0.0000000), wk = 0.0025000 k( 116) = ( 0.4391892 0.4391892 0.0000000), wk = 0.0025000 k( 117) = ( 0.4324324 0.4324324 0.0000000), wk = 0.0025000 k( 118) = ( 0.4256757 0.4256757 0.0000000), wk = 0.0025000 k( 119) = ( 0.4189189 0.4189189 0.0000000), wk = 0.0025000 k( 120) = ( 0.4121622 0.4121622 0.0000000), wk = 0.0025000 k( 121) = ( 0.4054054 0.4054054 0.0000000), wk = 0.0025000 k( 122) = ( 0.3986486 0.3986486 0.0000000), wk = 0.0025000 k( 123) = ( 0.3918919 0.3918919 0.0000000), wk = 0.0025000 k( 124) = ( 0.3851351 0.3851351 0.0000000), wk = 0.0025000 k( 125) = ( 0.3783784 0.3783784 0.0000000), wk = 0.0025000 k( 126) = ( 0.3716216 0.3716216 0.0000000), wk = 0.0025000 k( 127) = ( 0.3648649 0.3648649 0.0000000), wk = 0.0025000 k( 128) = ( 0.3581081 0.3581081 0.0000000), wk = 0.0025000 k( 129) = ( 0.3513514 0.3513514 0.0000000), wk = 0.0025000 k( 130) = ( 0.3445946 0.3445946 0.0000000), wk = 0.0025000 k( 131) = ( 0.3378378 0.3378378 0.0000000), wk = 0.0025000 k( 132) = ( 0.3310811 0.3310811 0.0000000), wk = 0.0025000 k( 133) = ( 0.3243243 0.3243243 0.0000000), wk = 0.0025000 k( 134) = ( 0.3175676 0.3175676 0.0000000), wk = 0.0025000 k( 135) = ( 0.3108108 0.3108108 0.0000000), wk = 0.0025000 k( 136) = ( 0.3040541 0.3040541 0.0000000), wk = 0.0025000 k( 137) = ( 0.2972973 0.2972973 0.0000000), wk = 0.0025000 k( 138) = ( 0.2905405 0.2905405 0.0000000), wk = 0.0025000 k( 139) = ( 0.2837838 0.2837838 0.0000000), wk = 0.0025000 k( 140) = ( 0.2770270 0.2770270 0.0000000), wk = 0.0025000 k( 141) = ( 0.2702703 0.2702703 0.0000000), wk = 0.0025000 k( 142) = ( 0.2635135 0.2635135 0.0000000), wk = 0.0025000 k( 143) = ( 0.2567568 0.2567568 0.0000000), wk = 0.0025000 k( 144) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0025000 k( 145) = ( 0.2432432 0.2432432 0.0000000), wk = 0.0025000 k( 146) = ( 0.2364865 0.2364865 0.0000000), wk = 0.0025000 k( 147) = ( 0.2297297 0.2297297 0.0000000), wk = 0.0025000 k( 148) = ( 0.2229730 0.2229730 0.0000000), wk = 0.0025000 k( 149) = ( 0.2162162 0.2162162 0.0000000), wk = 0.0025000 k( 150) = ( 0.2094595 0.2094595 0.0000000), wk = 0.0025000 k( 151) = ( 0.2027027 0.2027027 0.0000000), wk = 0.0025000 k( 152) = ( 0.1959460 0.1959460 0.0000000), wk = 0.0025000 k( 153) = ( 0.1891892 0.1891892 0.0000000), wk = 0.0025000 k( 154) = ( 0.1824324 0.1824324 0.0000000), wk = 0.0025000 k( 155) = ( 0.1756757 0.1756757 0.0000000), wk = 0.0025000 k( 156) = ( 0.1689189 0.1689189 0.0000000), wk = 0.0025000 k( 157) = ( 0.1621622 0.1621622 0.0000000), wk = 0.0025000 k( 158) = ( 0.1554054 0.1554054 0.0000000), wk = 0.0025000 k( 159) = ( 0.1486486 0.1486486 0.0000000), wk = 0.0025000 k( 160) = ( 0.1418919 0.1418919 0.0000000), wk = 0.0025000 k( 161) = ( 0.1351351 0.1351351 0.0000000), wk = 0.0025000 k( 162) = ( 0.1283784 0.1283784 0.0000000), wk = 0.0025000 k( 163) = ( 0.1216216 0.1216216 0.0000000), wk = 0.0025000 k( 164) = ( 0.1148649 0.1148649 0.0000000), wk = 0.0025000 k( 165) = ( 0.1081081 0.1081081 0.0000000), wk = 0.0025000 k( 166) = ( 0.1013514 0.1013514 0.0000000), wk = 0.0025000 k( 167) = ( 0.0945946 0.0945946 0.0000000), wk = 0.0025000 k( 168) = ( 0.0878378 0.0878378 0.0000000), wk = 0.0025000 k( 169) = ( 0.0810811 0.0810811 0.0000000), wk = 0.0025000 k( 170) = ( 0.0743243 0.0743243 0.0000000), wk = 0.0025000 k( 171) = ( 0.0675676 0.0675676 0.0000000), wk = 0.0025000 k( 172) = ( 0.0608108 0.0608108 0.0000000), wk = 0.0025000 k( 173) = ( 0.0540540 0.0540540 0.0000000), wk = 0.0025000 k( 174) = ( 0.0472973 0.0472973 0.0000000), wk = 0.0025000 k( 175) = ( 0.0405405 0.0405405 0.0000000), wk = 0.0025000 k( 176) = ( 0.0337838 0.0337838 0.0000000), wk = 0.0025000 k( 177) = ( 0.0270270 0.0270270 0.0000000), wk = 0.0025000 k( 178) = ( 0.0202703 0.0202703 0.0000000), wk = 0.0025000 k( 179) = ( 0.0135135 0.0135135 0.0000000), wk = 0.0025000 k( 180) = ( 0.0067568 0.0067568 0.0000000), wk = 0.0025000 k( 181) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025000 k( 182) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025000 k( 183) = ( 0.0055556 0.0055556 0.0055556), wk = 0.0025000 k( 184) = ( 0.0111111 0.0111111 0.0111111), wk = 0.0025000 k( 185) = ( 0.0166667 0.0166667 0.0166667), wk = 0.0025000 k( 186) = ( 0.0222222 0.0222222 0.0222222), wk = 0.0025000 k( 187) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0025000 k( 188) = ( 0.0333333 0.0333333 0.0333333), wk = 0.0025000 k( 189) = ( 0.0388889 0.0388889 0.0388889), wk = 0.0025000 k( 190) = ( 0.0444444 0.0444444 0.0444444), wk = 0.0025000 k( 191) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0025000 k( 192) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0025000 k( 193) = ( 0.0611111 0.0611111 0.0611111), wk = 0.0025000 k( 194) = ( 0.0666667 0.0666667 0.0666667), wk = 0.0025000 k( 195) = ( 0.0722222 0.0722222 0.0722222), wk = 0.0025000 k( 196) = ( 0.0777778 0.0777778 0.0777778), wk = 0.0025000 k( 197) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0025000 k( 198) = ( 0.0888889 0.0888889 0.0888889), wk = 0.0025000 k( 199) = ( 0.0944444 0.0944444 0.0944444), wk = 0.0025000 k( 200) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0025000 k( 201) = ( 0.1055556 0.1055556 0.1055556), wk = 0.0025000 k( 202) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0025000 k( 203) = ( 0.1166667 0.1166667 0.1166667), wk = 0.0025000 k( 204) = ( 0.1222222 0.1222222 0.1222222), wk = 0.0025000 k( 205) = ( 0.1277778 0.1277778 0.1277778), wk = 0.0025000 k( 206) = ( 0.1333333 0.1333333 0.1333333), wk = 0.0025000 k( 207) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0025000 k( 208) = ( 0.1444444 0.1444444 0.1444444), wk = 0.0025000 k( 209) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0025000 k( 210) = ( 0.1555556 0.1555556 0.1555556), wk = 0.0025000 k( 211) = ( 0.1611111 0.1611111 0.1611111), wk = 0.0025000 k( 212) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0025000 k( 213) = ( 0.1722222 0.1722222 0.1722222), wk = 0.0025000 k( 214) = ( 0.1777778 0.1777778 0.1777778), wk = 0.0025000 k( 215) = ( 0.1833333 0.1833333 0.1833333), wk = 0.0025000 k( 216) = ( 0.1888889 0.1888889 0.1888889), wk = 0.0025000 k( 217) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0025000 k( 218) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0025000 k( 219) = ( 0.2055556 0.2055556 0.2055556), wk = 0.0025000 k( 220) = ( 0.2111111 0.2111111 0.2111111), wk = 0.0025000 k( 221) = ( 0.2166667 0.2166667 0.2166667), wk = 0.0025000 k( 222) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0025000 k( 223) = ( 0.2277778 0.2277778 0.2277778), wk = 0.0025000 k( 224) = ( 0.2333333 0.2333333 0.2333333), wk = 0.0025000 k( 225) = ( 0.2388889 0.2388889 0.2388889), wk = 0.0025000 k( 226) = ( 0.2444444 0.2444444 0.2444444), wk = 0.0025000 k( 227) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025000 k( 228) = ( 0.2555556 0.2555556 0.2555556), wk = 0.0025000 k( 229) = ( 0.2611111 0.2611111 0.2611111), wk = 0.0025000 k( 230) = ( 0.2666667 0.2666667 0.2666667), wk = 0.0025000 k( 231) = ( 0.2722222 0.2722222 0.2722222), wk = 0.0025000 k( 232) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0025000 k( 233) = ( 0.2833333 0.2833333 0.2833333), wk = 0.0025000 k( 234) = ( 0.2888889 0.2888889 0.2888889), wk = 0.0025000 k( 235) = ( 0.2944444 0.2944444 0.2944444), wk = 0.0025000 k( 236) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0025000 k( 237) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0025000 k( 238) = ( 0.3111111 0.3111111 0.3111111), wk = 0.0025000 k( 239) = ( 0.3166667 0.3166667 0.3166667), wk = 0.0025000 k( 240) = ( 0.3222222 0.3222222 0.3222222), wk = 0.0025000 k( 241) = ( 0.3277778 0.3277778 0.3277778), wk = 0.0025000 k( 242) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0025000 k( 243) = ( 0.3388889 0.3388889 0.3388889), wk = 0.0025000 k( 244) = ( 0.3444444 0.3444444 0.3444444), wk = 0.0025000 k( 245) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0025000 k( 246) = ( 0.3555556 0.3555556 0.3555556), wk = 0.0025000 k( 247) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0025000 k( 248) = ( 0.3666667 0.3666667 0.3666667), wk = 0.0025000 k( 249) = ( 0.3722222 0.3722222 0.3722222), wk = 0.0025000 k( 250) = ( 0.3777778 0.3777778 0.3777778), wk = 0.0025000 k( 251) = ( 0.3833333 0.3833333 0.3833333), wk = 0.0025000 k( 252) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0025000 k( 253) = ( 0.3944444 0.3944444 0.3944444), wk = 0.0025000 k( 254) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0025000 k( 255) = ( 0.4055556 0.4055556 0.4055556), wk = 0.0025000 k( 256) = ( 0.4111111 0.4111111 0.4111111), wk = 0.0025000 k( 257) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0025000 k( 258) = ( 0.4222222 0.4222222 0.4222222), wk = 0.0025000 k( 259) = ( 0.4277778 0.4277778 0.4277778), wk = 0.0025000 k( 260) = ( 0.4333333 0.4333333 0.4333333), wk = 0.0025000 k( 261) = ( 0.4388889 0.4388889 0.4388889), wk = 0.0025000 k( 262) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0025000 k( 263) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0025000 k( 264) = ( 0.4555556 0.4555556 0.4555556), wk = 0.0025000 k( 265) = ( 0.4611111 0.4611111 0.4611111), wk = 0.0025000 k( 266) = ( 0.4666667 0.4666667 0.4666667), wk = 0.0025000 k( 267) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0025000 k( 268) = ( 0.4777778 0.4777778 0.4777778), wk = 0.0025000 k( 269) = ( 0.4833333 0.4833333 0.4833333), wk = 0.0025000 k( 270) = ( 0.4888889 0.4888889 0.4888889), wk = 0.0025000 k( 271) = ( 0.4944444 0.4944444 0.4944444), wk = 0.0025000 k( 272) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025000 k( 273) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025000 k( 274) = ( 0.4932432 0.5000000 0.4932432), wk = 0.0025000 k( 275) = ( 0.4864865 0.5000000 0.4864865), wk = 0.0025000 k( 276) = ( 0.4797297 0.5000000 0.4797297), wk = 0.0025000 k( 277) = ( 0.4729730 0.5000000 0.4729730), wk = 0.0025000 k( 278) = ( 0.4662162 0.5000000 0.4662162), wk = 0.0025000 k( 279) = ( 0.4594595 0.5000000 0.4594595), wk = 0.0025000 k( 280) = ( 0.4527027 0.5000000 0.4527027), wk = 0.0025000 k( 281) = ( 0.4459459 0.5000000 0.4459459), wk = 0.0025000 k( 282) = ( 0.4391892 0.5000000 0.4391892), wk = 0.0025000 k( 283) = ( 0.4324324 0.5000000 0.4324324), wk = 0.0025000 k( 284) = ( 0.4256757 0.5000000 0.4256757), wk = 0.0025000 k( 285) = ( 0.4189189 0.5000000 0.4189189), wk = 0.0025000 k( 286) = ( 0.4121622 0.5000000 0.4121622), wk = 0.0025000 k( 287) = ( 0.4054054 0.5000000 0.4054054), wk = 0.0025000 k( 288) = ( 0.3986486 0.5000000 0.3986486), wk = 0.0025000 k( 289) = ( 0.3918919 0.5000000 0.3918919), wk = 0.0025000 k( 290) = ( 0.3851351 0.5000000 0.3851351), wk = 0.0025000 k( 291) = ( 0.3783784 0.5000000 0.3783784), wk = 0.0025000 k( 292) = ( 0.3716216 0.5000000 0.3716216), wk = 0.0025000 k( 293) = ( 0.3648649 0.5000000 0.3648649), wk = 0.0025000 k( 294) = ( 0.3581081 0.5000000 0.3581081), wk = 0.0025000 k( 295) = ( 0.3513514 0.5000000 0.3513514), wk = 0.0025000 k( 296) = ( 0.3445946 0.5000000 0.3445946), wk = 0.0025000 k( 297) = ( 0.3378378 0.5000000 0.3378378), wk = 0.0025000 k( 298) = ( 0.3310811 0.5000000 0.3310811), wk = 0.0025000 k( 299) = ( 0.3243243 0.5000000 0.3243243), wk = 0.0025000 k( 300) = ( 0.3175676 0.5000000 0.3175676), wk = 0.0025000 k( 301) = ( 0.3108108 0.5000000 0.3108108), wk = 0.0025000 k( 302) = ( 0.3040541 0.5000000 0.3040541), wk = 0.0025000 k( 303) = ( 0.2972973 0.5000000 0.2972973), wk = 0.0025000 k( 304) = ( 0.2905405 0.5000000 0.2905405), wk = 0.0025000 k( 305) = ( 0.2837838 0.5000000 0.2837838), wk = 0.0025000 k( 306) = ( 0.2770270 0.5000000 0.2770270), wk = 0.0025000 k( 307) = ( 0.2702703 0.5000000 0.2702703), wk = 0.0025000 k( 308) = ( 0.2635135 0.5000000 0.2635135), wk = 0.0025000 k( 309) = ( 0.2567568 0.5000000 0.2567568), wk = 0.0025000 k( 310) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0025000 k( 311) = ( 0.2432432 0.5000000 0.2432432), wk = 0.0025000 k( 312) = ( 0.2364865 0.5000000 0.2364865), wk = 0.0025000 k( 313) = ( 0.2297297 0.5000000 0.2297297), wk = 0.0025000 k( 314) = ( 0.2229730 0.5000000 0.2229730), wk = 0.0025000 k( 315) = ( 0.2162162 0.5000000 0.2162162), wk = 0.0025000 k( 316) = ( 0.2094595 0.5000000 0.2094595), wk = 0.0025000 k( 317) = ( 0.2027027 0.5000000 0.2027027), wk = 0.0025000 k( 318) = ( 0.1959460 0.5000000 0.1959460), wk = 0.0025000 k( 319) = ( 0.1891892 0.5000000 0.1891892), wk = 0.0025000 k( 320) = ( 0.1824324 0.5000000 0.1824324), wk = 0.0025000 k( 321) = ( 0.1756757 0.5000000 0.1756757), wk = 0.0025000 k( 322) = ( 0.1689189 0.5000000 0.1689189), wk = 0.0025000 k( 323) = ( 0.1621622 0.5000000 0.1621622), wk = 0.0025000 k( 324) = ( 0.1554054 0.5000000 0.1554054), wk = 0.0025000 k( 325) = ( 0.1486486 0.5000000 0.1486486), wk = 0.0025000 k( 326) = ( 0.1418919 0.5000000 0.1418919), wk = 0.0025000 k( 327) = ( 0.1351351 0.5000000 0.1351351), wk = 0.0025000 k( 328) = ( 0.1283784 0.5000000 0.1283784), wk = 0.0025000 k( 329) = ( 0.1216216 0.5000000 0.1216216), wk = 0.0025000 k( 330) = ( 0.1148649 0.5000000 0.1148649), wk = 0.0025000 k( 331) = ( 0.1081081 0.5000000 0.1081081), wk = 0.0025000 k( 332) = ( 0.1013514 0.5000000 0.1013514), wk = 0.0025000 k( 333) = ( 0.0945946 0.5000000 0.0945946), wk = 0.0025000 k( 334) = ( 0.0878378 0.5000000 0.0878378), wk = 0.0025000 k( 335) = ( 0.0810811 0.5000000 0.0810811), wk = 0.0025000 k( 336) = ( 0.0743243 0.5000000 0.0743243), wk = 0.0025000 k( 337) = ( 0.0675676 0.5000000 0.0675676), wk = 0.0025000 k( 338) = ( 0.0608108 0.5000000 0.0608108), wk = 0.0025000 k( 339) = ( 0.0540540 0.5000000 0.0540540), wk = 0.0025000 k( 340) = ( 0.0472973 0.5000000 0.0472973), wk = 0.0025000 k( 341) = ( 0.0405405 0.5000000 0.0405405), wk = 0.0025000 k( 342) = ( 0.0337838 0.5000000 0.0337838), wk = 0.0025000 k( 343) = ( 0.0270270 0.5000000 0.0270270), wk = 0.0025000 k( 344) = ( 0.0202703 0.5000000 0.0202703), wk = 0.0025000 k( 345) = ( 0.0135135 0.5000000 0.0135135), wk = 0.0025000 k( 346) = ( 0.0067568 0.5000000 0.0067568), wk = 0.0025000 k( 347) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025000 k( 348) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025000 k( 349) = ( 0.5000000 0.5000000 0.0096154), wk = 0.0025000 k( 350) = ( 0.5000000 0.5000000 0.0192308), wk = 0.0025000 k( 351) = ( 0.5000000 0.5000000 0.0288462), wk = 0.0025000 k( 352) = ( 0.5000000 0.5000000 0.0384615), wk = 0.0025000 k( 353) = ( 0.5000000 0.5000000 0.0480769), wk = 0.0025000 k( 354) = ( 0.5000000 0.5000000 0.0576923), wk = 0.0025000 k( 355) = ( 0.5000000 0.5000000 0.0673077), wk = 0.0025000 k( 356) = ( 0.5000000 0.5000000 0.0769231), wk = 0.0025000 k( 357) = ( 0.5000000 0.5000000 0.0865385), wk = 0.0025000 k( 358) = ( 0.5000000 0.5000000 0.0961538), wk = 0.0025000 k( 359) = ( 0.5000000 0.5000000 0.1057692), wk = 0.0025000 k( 360) = ( 0.5000000 0.5000000 0.1153846), wk = 0.0025000 k( 361) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0025000 k( 362) = ( 0.5000000 0.5000000 0.1346154), wk = 0.0025000 k( 363) = ( 0.5000000 0.5000000 0.1442308), wk = 0.0025000 k( 364) = ( 0.5000000 0.5000000 0.1538461), wk = 0.0025000 k( 365) = ( 0.5000000 0.5000000 0.1634615), wk = 0.0025000 k( 366) = ( 0.5000000 0.5000000 0.1730769), wk = 0.0025000 k( 367) = ( 0.5000000 0.5000000 0.1826923), wk = 0.0025000 k( 368) = ( 0.5000000 0.5000000 0.1923077), wk = 0.0025000 k( 369) = ( 0.5000000 0.5000000 0.2019231), wk = 0.0025000 k( 370) = ( 0.5000000 0.5000000 0.2115385), wk = 0.0025000 k( 371) = ( 0.5000000 0.5000000 0.2211539), wk = 0.0025000 k( 372) = ( 0.5000000 0.5000000 0.2307692), wk = 0.0025000 k( 373) = ( 0.5000000 0.5000000 0.2403846), wk = 0.0025000 k( 374) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0025000 k( 375) = ( 0.5000000 0.5000000 0.2596154), wk = 0.0025000 k( 376) = ( 0.5000000 0.5000000 0.2692308), wk = 0.0025000 k( 377) = ( 0.5000000 0.5000000 0.2788462), wk = 0.0025000 k( 378) = ( 0.5000000 0.5000000 0.2884615), wk = 0.0025000 k( 379) = ( 0.5000000 0.5000000 0.2980769), wk = 0.0025000 k( 380) = ( 0.5000000 0.5000000 0.3076923), wk = 0.0025000 k( 381) = ( 0.5000000 0.5000000 0.3173077), wk = 0.0025000 k( 382) = ( 0.5000000 0.5000000 0.3269231), wk = 0.0025000 k( 383) = ( 0.5000000 0.5000000 0.3365385), wk = 0.0025000 k( 384) = ( 0.5000000 0.5000000 0.3461538), wk = 0.0025000 k( 385) = ( 0.5000000 0.5000000 0.3557692), wk = 0.0025000 k( 386) = ( 0.5000000 0.5000000 0.3653846), wk = 0.0025000 k( 387) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0025000 k( 388) = ( 0.5000000 0.5000000 0.3846154), wk = 0.0025000 k( 389) = ( 0.5000000 0.5000000 0.3942308), wk = 0.0025000 k( 390) = ( 0.5000000 0.5000000 0.4038462), wk = 0.0025000 k( 391) = ( 0.5000000 0.5000000 0.4134615), wk = 0.0025000 k( 392) = ( 0.5000000 0.5000000 0.4230769), wk = 0.0025000 k( 393) = ( 0.5000000 0.5000000 0.4326923), wk = 0.0025000 k( 394) = ( 0.5000000 0.5000000 0.4423077), wk = 0.0025000 k( 395) = ( 0.5000000 0.5000000 0.4519231), wk = 0.0025000 k( 396) = ( 0.5000000 0.5000000 0.4615385), wk = 0.0025000 k( 397) = ( 0.5000000 0.5000000 0.4711538), wk = 0.0025000 k( 398) = ( 0.5000000 0.5000000 0.4807692), wk = 0.0025000 k( 399) = ( 0.5000000 0.5000000 0.4903846), wk = 0.0025000 k( 400) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025000 Dense grid: 51867 G-vectors FFT dimensions: ( 48, 48, 48) Smooth grid: 11459 G-vectors FFT dimensions: ( 27, 27, 27) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.05 Mb ( 96, 36) NL pseudopotentials 0.05 Mb ( 48, 68) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.01 Mb ( 1443) G-vector shells 0.00 Mb ( 337) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.21 Mb ( 96, 144) Each subspace H/S matrix 0.02 Mb ( 36, 36) Each matrix 0.07 Mb ( 68, 2, 36) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./VTc.save/charge-density.dat Starting wfc are 46 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.2 secs Computing kpt #: 2 total cpu time spent up to now is 2.3 secs Computing kpt #: 3 total cpu time spent up to now is 2.5 secs Computing kpt #: 4 total cpu time spent up to now is 2.6 secs Computing kpt #: 5 total cpu time spent up to now is 2.8 secs Computing kpt #: 6 total cpu time spent up to now is 2.9 secs Computing kpt #: 7 total cpu time spent up to now is 3.0 secs Computing kpt #: 8 total cpu time spent up to now is 3.2 secs Computing kpt #: 9 total cpu time spent up to now is 3.3 secs Computing kpt #: 10 total cpu time spent up to now is 3.5 secs Computing kpt #: 11 total cpu time spent up to now is 3.6 secs Computing kpt #: 12 total cpu time spent up to now is 3.7 secs Computing kpt #: 13 total cpu time spent up to now is 3.9 secs Computing kpt #: 14 total cpu time spent up to now is 4.0 secs Computing kpt #: 15 total cpu time spent up to now is 4.2 secs Computing kpt #: 16 total cpu time spent up to now is 4.3 secs Computing kpt #: 17 total cpu time spent up to now is 4.4 secs Computing kpt #: 18 total cpu time spent up to now is 4.6 secs Computing kpt #: 19 total cpu time spent up to now is 4.7 secs Computing kpt #: 20 total cpu time spent up to now is 5.1 secs Computing kpt #: 21 total cpu time spent up to now is 5.2 secs Computing kpt #: 22 total cpu time spent up to now is 5.3 secs Computing kpt #: 23 total cpu time spent up to now is 5.5 secs Computing kpt #: 24 total cpu time spent up to now is 5.6 secs Computing kpt #: 25 total cpu time spent up to now is 5.7 secs Computing kpt #: 26 total cpu time spent up to now is 5.9 secs Computing kpt #: 27 total cpu time spent up to now is 6.0 secs Computing kpt #: 28 total cpu time spent up to now is 6.1 secs Computing kpt #: 29 total cpu time spent up to now is 6.2 secs Computing kpt #: 30 total cpu time spent up to now is 6.3 secs Computing kpt #: 31 total cpu time spent up to now is 6.5 secs Computing kpt #: 32 total cpu time spent up to now is 6.6 secs Computing kpt #: 33 total cpu time spent up to now is 6.7 secs Computing kpt #: 34 total cpu time spent up to now is 6.9 secs Computing kpt #: 35 total cpu time spent up to now is 7.1 secs Computing kpt #: 36 total cpu time spent up to now is 7.2 secs Computing kpt #: 37 total cpu time spent up to now is 7.3 secs Computing kpt #: 38 total cpu time spent up to now is 7.5 secs Computing kpt #: 39 total cpu time spent up to now is 7.6 secs Computing kpt #: 40 total cpu time spent up to now is 7.7 secs Computing kpt #: 41 total cpu time spent up to now is 7.8 secs Computing kpt #: 42 total cpu time spent up to now is 8.0 secs Computing kpt #: 43 total cpu time spent up to now is 8.1 secs Computing kpt #: 44 total cpu time spent up to now is 8.2 secs Computing kpt #: 45 total cpu time spent up to now is 8.3 secs Computing kpt #: 46 total cpu time spent up to now is 8.5 secs Computing kpt #: 47 total cpu time spent up to now is 8.6 secs Computing kpt #: 48 total cpu time spent up to now is 8.7 secs Computing kpt #: 49 total cpu time spent up to now is 8.8 secs Computing kpt #: 50 total cpu time spent up to now is 8.9 secs Computing kpt #: 51 total cpu time spent up to now is 9.1 secs Computing kpt #: 52 total cpu time spent up to now is 9.2 secs Computing kpt #: 53 total cpu time spent up to now is 9.3 secs Computing kpt #: 54 total cpu time spent up to now is 9.4 secs Computing kpt #: 55 total cpu time spent up to now is 9.6 secs Computing kpt #: 56 total cpu time spent up to now is 9.7 secs Computing kpt #: 57 total cpu time spent up to now is 9.8 secs Computing kpt #: 58 total cpu time spent up to now is 9.9 secs Computing kpt #: 59 total cpu time spent up to now is 10.0 secs Computing kpt #: 60 total cpu time spent up to now is 10.2 secs Computing kpt #: 61 total cpu time spent up to now is 10.3 secs Computing kpt #: 62 total cpu time spent up to now is 10.4 secs Computing kpt #: 63 total cpu time spent up to now is 10.6 secs Computing kpt #: 64 total cpu time spent up to now is 10.7 secs Computing kpt #: 65 total cpu time spent up to now is 10.8 secs Computing kpt #: 66 total cpu time spent up to now is 10.9 secs Computing kpt #: 67 total cpu time spent up to now is 11.1 secs Computing kpt #: 68 total cpu time spent up to now is 11.2 secs Computing kpt #: 69 total cpu time spent up to now is 11.4 secs Computing kpt #: 70 total cpu time spent up to now is 11.5 secs Computing kpt #: 71 total cpu time spent up to now is 11.6 secs Computing kpt #: 72 total cpu time spent up to now is 11.8 secs Computing kpt #: 73 total cpu time spent up to now is 11.9 secs Computing kpt #: 74 total cpu time spent up to now is 12.1 secs Computing kpt #: 75 total cpu time spent up to now is 12.2 secs Computing kpt #: 76 total cpu time spent up to now is 12.4 secs Computing kpt #: 77 total cpu time spent up to now is 12.5 secs Computing kpt #: 78 total cpu time spent up to now is 12.7 secs Computing kpt #: 79 total cpu time spent up to now is 12.8 secs Computing kpt #: 80 total cpu time spent up to now is 13.0 secs Computing kpt #: 81 total cpu time spent up to now is 13.1 secs Computing kpt #: 82 total cpu time spent up to now is 13.3 secs Computing kpt #: 83 total cpu time spent up to now is 13.5 secs Computing kpt #: 84 total cpu time spent up to now is 13.6 secs Computing kpt #: 85 total cpu time spent up to now is 13.8 secs Computing kpt #: 86 total cpu time spent up to now is 14.0 secs Computing kpt #: 87 total cpu time spent up to now is 14.2 secs Computing kpt #: 88 total cpu time spent up to now is 14.3 secs Computing kpt #: 89 total cpu time spent up to now is 14.5 secs Computing kpt #: 90 total cpu time spent up to now is 14.7 secs Computing kpt #: 91 total cpu time spent up to now is 14.9 secs Computing kpt #: 92 total cpu time spent up to now is 15.0 secs Computing kpt #: 93 total cpu time spent up to now is 15.2 secs Computing kpt #: 94 total cpu time spent up to now is 15.4 secs Computing kpt #: 95 total cpu time spent up to now is 15.5 secs Computing kpt #: 96 total cpu time spent up to now is 15.7 secs Computing kpt #: 97 total cpu time spent up to now is 15.8 secs Computing kpt #: 98 total cpu time spent up to now is 16.0 secs Computing kpt #: 99 total cpu time spent up to now is 16.1 secs Computing kpt #: 100 total cpu time spent up to now is 16.3 secs Computing kpt #: 101 total cpu time spent up to now is 16.4 secs Computing kpt #: 102 total cpu time spent up to now is 16.6 secs Computing kpt #: 103 total cpu time spent up to now is 16.7 secs Computing kpt #: 104 total cpu time spent up to now is 16.8 secs Computing kpt #: 105 total cpu time spent up to now is 17.0 secs Computing kpt #: 106 total cpu time spent up to now is 17.1 secs Computing kpt #: 107 total cpu time spent up to now is 17.2 secs Computing kpt #: 108 total cpu time spent up to now is 17.3 secs Computing kpt #: 109 total cpu time spent up to now is 17.5 secs Computing kpt #: 110 total cpu time spent up to now is 17.6 secs Computing kpt #: 111 total cpu time spent up to now is 17.8 secs Computing kpt #: 112 total cpu time spent up to now is 17.9 secs Computing kpt #: 113 total cpu time spent up to now is 18.1 secs Computing kpt #: 114 total cpu time spent up to now is 18.2 secs Computing kpt #: 115 total cpu time spent up to now is 18.4 secs Computing kpt #: 116 total cpu time spent up to now is 18.5 secs Computing kpt #: 117 total cpu time spent up to now is 18.7 secs Computing kpt #: 118 total cpu time spent up to now is 18.9 secs Computing kpt #: 119 total cpu time spent up to now is 19.0 secs Computing kpt #: 120 total cpu time spent up to now is 19.2 secs Computing kpt #: 121 total cpu time spent up to now is 19.3 secs Computing kpt #: 122 total cpu time spent up to now is 19.4 secs Computing kpt #: 123 total cpu time spent up to now is 19.6 secs Computing kpt #: 124 total cpu time spent up to now is 19.7 secs Computing kpt #: 125 total cpu time spent up to now is 19.9 secs Computing kpt #: 126 total cpu time spent up to now is 20.0 secs Computing kpt #: 127 total cpu time spent up to now is 20.1 secs Computing kpt #: 128 total cpu time spent up to now is 20.2 secs Computing kpt #: 129 total cpu time spent up to now is 20.4 secs Computing kpt #: 130 total cpu time spent up to now is 20.5 secs Computing kpt #: 131 total cpu time spent up to now is 20.6 secs Computing kpt #: 132 total cpu time spent up to now is 20.7 secs Computing kpt #: 133 total cpu time spent up to now is 20.8 secs Computing kpt #: 134 total cpu time spent up to now is 21.0 secs Computing kpt #: 135 total cpu time spent up to now is 21.1 secs Computing kpt #: 136 total cpu time spent up to now is 21.2 secs Computing kpt #: 137 total cpu time spent up to now is 21.3 secs Computing kpt #: 138 total cpu time spent up to now is 21.5 secs Computing kpt #: 139 total cpu time spent up to now is 21.6 secs Computing kpt #: 140 total cpu time spent up to now is 21.7 secs Computing kpt #: 141 total cpu time spent up to now is 21.8 secs Computing kpt #: 142 total cpu time spent up to now is 22.0 secs Computing kpt #: 143 total cpu time spent up to now is 22.1 secs Computing kpt #: 144 total cpu time spent up to now is 22.2 secs Computing kpt #: 145 total cpu time spent up to now is 22.3 secs Computing kpt #: 146 total cpu time spent up to now is 22.4 secs Computing kpt #: 147 total cpu time spent up to now is 22.6 secs Computing kpt #: 148 total cpu time spent up to now is 22.7 secs Computing kpt #: 149 total cpu time spent up to now is 22.8 secs Computing kpt #: 150 total cpu time spent up to now is 22.9 secs Computing kpt #: 151 total cpu time spent up to now is 23.1 secs Computing kpt #: 152 total cpu time spent up to now is 23.2 secs Computing kpt #: 153 total cpu time spent up to now is 23.3 secs Computing kpt #: 154 total cpu time spent up to now is 23.4 secs Computing kpt #: 155 total cpu time spent up to now is 23.5 secs Computing kpt #: 156 total cpu time spent up to now is 23.6 secs Computing kpt #: 157 total cpu time spent up to now is 23.8 secs Computing kpt #: 158 total cpu time spent up to now is 23.9 secs Computing kpt #: 159 total cpu time spent up to now is 24.0 secs Computing kpt #: 160 total cpu time spent up to now is 24.1 secs Computing kpt #: 161 total cpu time spent up to now is 24.2 secs Computing kpt #: 162 total cpu time spent up to now is 24.4 secs Computing kpt #: 163 total cpu time spent up to now is 24.5 secs Computing kpt #: 164 total cpu time spent up to now is 24.6 secs Computing kpt #: 165 total cpu time spent up to now is 24.7 secs Computing kpt #: 166 total cpu time spent up to now is 24.8 secs Computing kpt #: 167 total cpu time spent up to now is 25.0 secs Computing kpt #: 168 total cpu time spent up to now is 25.1 secs Computing kpt #: 169 total cpu time spent up to now is 25.2 secs Computing kpt #: 170 total cpu time spent up to now is 25.4 secs Computing kpt #: 171 total cpu time spent up to now is 25.5 secs Computing kpt #: 172 total cpu time spent up to now is 25.6 secs Computing kpt #: 173 total cpu time spent up to now is 25.8 secs Computing kpt #: 174 total cpu time spent up to now is 25.9 secs Computing kpt #: 175 total cpu time spent up to now is 26.1 secs Computing kpt #: 176 total cpu time spent up to now is 26.2 secs Computing kpt #: 177 total cpu time spent up to now is 26.3 secs Computing kpt #: 178 total cpu time spent up to now is 26.5 secs Computing kpt #: 179 total cpu time spent up to now is 26.6 secs Computing kpt #: 180 total cpu time spent up to now is 26.8 secs Computing kpt #: 181 total cpu time spent up to now is 26.9 secs Computing kpt #: 182 total cpu time spent up to now is 27.1 secs Computing kpt #: 183 total cpu time spent up to now is 27.2 secs Computing kpt #: 184 total cpu time spent up to now is 27.3 secs Computing kpt #: 185 total cpu time spent up to now is 27.5 secs Computing kpt #: 186 total cpu time spent up to now is 27.6 secs Computing kpt #: 187 total cpu time spent up to now is 27.7 secs Computing kpt #: 188 total cpu time spent up to now is 27.9 secs Computing kpt #: 189 total cpu time spent up to now is 28.0 secs Computing kpt #: 190 total cpu time spent up to now is 28.2 secs Computing kpt #: 191 total cpu time spent up to now is 28.3 secs Computing kpt #: 192 total cpu time spent up to now is 28.5 secs Computing kpt #: 193 total cpu time spent up to now is 28.6 secs Computing kpt #: 194 total cpu time spent up to now is 28.8 secs Computing kpt #: 195 total cpu time spent up to now is 28.9 secs Computing kpt #: 196 total cpu time spent up to now is 29.0 secs Computing kpt #: 197 total cpu time spent up to now is 29.2 secs Computing kpt #: 198 total cpu time spent up to now is 29.4 secs Computing kpt #: 199 total cpu time spent up to now is 29.5 secs Computing kpt #: 200 total cpu time spent up to now is 29.7 secs Computing kpt #: 201 total cpu time spent up to now is 29.8 secs Computing kpt #: 202 total cpu time spent up to now is 30.0 secs Computing kpt #: 203 total cpu time spent up to now is 30.2 secs Computing kpt #: 204 total cpu time spent up to now is 30.3 secs Computing kpt #: 205 total cpu time spent up to now is 30.5 secs Computing kpt #: 206 total cpu time spent up to now is 30.6 secs Computing kpt #: 207 total cpu time spent up to now is 30.8 secs Computing kpt #: 208 total cpu time spent up to now is 31.0 secs Computing kpt #: 209 total cpu time spent up to now is 31.1 secs Computing kpt #: 210 total cpu time spent up to now is 31.3 secs Computing kpt #: 211 total cpu time spent up to now is 31.4 secs Computing kpt #: 212 total cpu time spent up to now is 31.6 secs Computing kpt #: 213 total cpu time spent up to now is 31.8 secs Computing kpt #: 214 total cpu time spent up to now is 31.9 secs Computing kpt #: 215 total cpu time spent up to now is 32.1 secs Computing kpt #: 216 total cpu time spent up to now is 32.3 secs Computing kpt #: 217 total cpu time spent up to now is 32.4 secs Computing kpt #: 218 total cpu time spent up to now is 32.6 secs Computing kpt #: 219 total cpu time spent up to now is 32.8 secs Computing kpt #: 220 total cpu time spent up to now is 32.9 secs Computing kpt #: 221 total cpu time spent up to now is 33.1 secs Computing kpt #: 222 total cpu time spent up to now is 33.3 secs Computing kpt #: 223 total cpu time spent up to now is 33.4 secs Computing kpt #: 224 total cpu time spent up to now is 33.6 secs Computing kpt #: 225 total cpu time spent up to now is 33.7 secs Computing kpt #: 226 total cpu time spent up to now is 33.9 secs Computing kpt #: 227 total cpu time spent up to now is 34.0 secs Computing kpt #: 228 total cpu time spent up to now is 34.1 secs Computing kpt #: 229 total cpu time spent up to now is 34.3 secs Computing kpt #: 230 total cpu time spent up to now is 34.4 secs Computing kpt #: 231 total cpu time spent up to now is 34.5 secs Computing kpt #: 232 total cpu time spent up to now is 34.6 secs Computing kpt #: 233 total cpu time spent up to now is 34.7 secs Computing kpt #: 234 total cpu time spent up to now is 34.9 secs Computing kpt #: 235 total cpu time spent up to now is 35.0 secs Computing kpt #: 236 total cpu time spent up to now is 35.1 secs Computing kpt #: 237 total cpu time spent up to now is 35.2 secs Computing kpt #: 238 total cpu time spent up to now is 35.3 secs Computing kpt #: 239 total cpu time spent up to now is 35.4 secs Computing kpt #: 240 total cpu time spent up to now is 35.6 secs Computing kpt #: 241 total cpu time spent up to now is 35.7 secs Computing kpt #: 242 total cpu time spent up to now is 35.8 secs Computing kpt #: 243 total cpu time spent up to now is 35.9 secs Computing kpt #: 244 total cpu time spent up to now is 36.0 secs Computing kpt #: 245 total cpu time spent up to now is 36.1 secs Computing kpt #: 246 total cpu time spent up to now is 36.2 secs Computing kpt #: 247 total cpu time spent up to now is 36.4 secs Computing kpt #: 248 total cpu time spent up to now is 36.5 secs Computing kpt #: 249 total cpu time spent up to now is 36.6 secs Computing kpt #: 250 total cpu time spent up to now is 36.7 secs Computing kpt #: 251 total cpu time spent up to now is 36.8 secs Computing kpt #: 252 total cpu time spent up to now is 36.9 secs Computing kpt #: 253 total cpu time spent up to now is 37.0 secs Computing kpt #: 254 total cpu time spent up to now is 37.1 secs Computing kpt #: 255 total cpu time spent up to now is 37.2 secs Computing kpt #: 256 total cpu time spent up to now is 37.3 secs Computing kpt #: 257 total cpu time spent up to now is 37.5 secs Computing kpt #: 258 total cpu time spent up to now is 37.6 secs Computing kpt #: 259 total cpu time spent up to now is 37.7 secs Computing kpt #: 260 total cpu time spent up to now is 37.8 secs Computing kpt #: 261 total cpu time spent up to now is 37.9 secs Computing kpt #: 262 total cpu time spent up to now is 38.0 secs Computing kpt #: 263 total cpu time spent up to now is 38.1 secs Computing kpt #: 264 total cpu time spent up to now is 38.2 secs Computing kpt #: 265 total cpu time spent up to now is 38.3 secs Computing kpt #: 266 total cpu time spent up to now is 38.4 secs Computing kpt #: 267 total cpu time spent up to now is 38.5 secs Computing kpt #: 268 total cpu time spent up to now is 38.7 secs Computing kpt #: 269 total cpu time spent up to now is 38.8 secs Computing kpt #: 270 total cpu time spent up to now is 38.9 secs Computing kpt #: 271 total cpu time spent up to now is 39.0 secs Computing kpt #: 272 total cpu time spent up to now is 39.1 secs Computing kpt #: 273 total cpu time spent up to now is 39.2 secs Computing kpt #: 274 total cpu time spent up to now is 39.3 secs Computing kpt #: 275 total cpu time spent up to now is 39.4 secs Computing kpt #: 276 total cpu time spent up to now is 39.5 secs Computing kpt #: 277 total cpu time spent up to now is 39.6 secs Computing kpt #: 278 total cpu time spent up to now is 39.7 secs Computing kpt #: 279 total cpu time spent up to now is 39.8 secs Computing kpt #: 280 total cpu time spent up to now is 39.9 secs Computing kpt #: 281 total cpu time spent up to now is 40.1 secs Computing kpt #: 282 total cpu time spent up to now is 40.2 secs Computing kpt #: 283 total cpu time spent up to now is 40.3 secs Computing kpt #: 284 total cpu time spent up to now is 40.4 secs Computing kpt #: 285 total cpu time spent up to now is 40.5 secs Computing kpt #: 286 total cpu time spent up to now is 40.6 secs Computing kpt #: 287 total cpu time spent up to now is 40.7 secs Computing kpt #: 288 total cpu time spent up to now is 40.8 secs Computing kpt #: 289 total cpu time spent up to now is 40.9 secs Computing kpt #: 290 total cpu time spent up to now is 41.0 secs Computing kpt #: 291 total cpu time spent up to now is 41.2 secs Computing kpt #: 292 total cpu time spent up to now is 41.3 secs Computing kpt #: 293 total cpu time spent up to now is 41.4 secs Computing kpt #: 294 total cpu time spent up to now is 41.5 secs Computing kpt #: 295 total cpu time spent up to now is 41.6 secs Computing kpt #: 296 total cpu time spent up to now is 41.7 secs Computing kpt #: 297 total cpu time spent up to now is 41.8 secs Computing kpt #: 298 total cpu time spent up to now is 42.0 secs Computing kpt #: 299 total cpu time spent up to now is 42.1 secs Computing kpt #: 300 total cpu time spent up to now is 42.2 secs Computing kpt #: 301 total cpu time spent up to now is 42.3 secs Computing kpt #: 302 total cpu time spent up to now is 42.4 secs Computing kpt #: 303 total cpu time spent up to now is 42.6 secs Computing kpt #: 304 total cpu time spent up to now is 42.7 secs Computing kpt #: 305 total cpu time spent up to now is 42.8 secs Computing kpt #: 306 total cpu time spent up to now is 42.9 secs Computing kpt #: 307 total cpu time spent up to now is 43.0 secs Computing kpt #: 308 total cpu time spent up to now is 43.2 secs Computing kpt #: 309 total cpu time spent up to now is 43.3 secs Computing kpt #: 310 total cpu time spent up to now is 43.4 secs Computing kpt #: 311 total cpu time spent up to now is 43.5 secs Computing kpt #: 312 total cpu time spent up to now is 43.7 secs Computing kpt #: 313 total cpu time spent up to now is 43.8 secs Computing kpt #: 314 total cpu time spent up to now is 43.9 secs Computing kpt #: 315 total cpu time spent up to now is 44.0 secs Computing kpt #: 316 total cpu time spent up to now is 44.2 secs Computing kpt #: 317 total cpu time spent up to now is 44.3 secs Computing kpt #: 318 total cpu time spent up to now is 44.4 secs Computing kpt #: 319 total cpu time spent up to now is 44.6 secs Computing kpt #: 320 total cpu time spent up to now is 44.7 secs Computing kpt #: 321 total cpu time spent up to now is 44.8 secs Computing kpt #: 322 total cpu time spent up to now is 44.9 secs Computing kpt #: 323 total cpu time spent up to now is 45.2 secs Computing kpt #: 324 total cpu time spent up to now is 45.4 secs Computing kpt #: 325 total cpu time spent up to now is 45.5 secs Computing kpt #: 326 total cpu time spent up to now is 45.7 secs Computing kpt #: 327 total cpu time spent up to now is 45.8 secs Computing kpt #: 328 total cpu time spent up to now is 45.9 secs Computing kpt #: 329 total cpu time spent up to now is 46.1 secs Computing kpt #: 330 total cpu time spent up to now is 46.2 secs Computing kpt #: 331 total cpu time spent up to now is 46.4 secs Computing kpt #: 332 total cpu time spent up to now is 46.5 secs Computing kpt #: 333 total cpu time spent up to now is 46.7 secs Computing kpt #: 334 total cpu time spent up to now is 46.8 secs Computing kpt #: 335 total cpu time spent up to now is 46.9 secs Computing kpt #: 336 total cpu time spent up to now is 47.1 secs Computing kpt #: 337 total cpu time spent up to now is 47.2 secs Computing kpt #: 338 total cpu time spent up to now is 47.4 secs Computing kpt #: 339 total cpu time spent up to now is 47.5 secs Computing kpt #: 340 total cpu time spent up to now is 47.6 secs Computing kpt #: 341 total cpu time spent up to now is 47.8 secs Computing kpt #: 342 total cpu time spent up to now is 47.9 secs Computing kpt #: 343 total cpu time spent up to now is 48.0 secs Computing kpt #: 344 total cpu time spent up to now is 48.1 secs Computing kpt #: 345 total cpu time spent up to now is 48.3 secs Computing kpt #: 346 total cpu time spent up to now is 48.4 secs Computing kpt #: 347 total cpu time spent up to now is 48.5 secs Computing kpt #: 348 total cpu time spent up to now is 48.6 secs Computing kpt #: 349 total cpu time spent up to now is 48.8 secs Computing kpt #: 350 total cpu time spent up to now is 48.9 secs Computing kpt #: 351 total cpu time spent up to now is 49.1 secs Computing kpt #: 352 total cpu time spent up to now is 49.2 secs Computing kpt #: 353 total cpu time spent up to now is 49.4 secs Computing kpt #: 354 total cpu time spent up to now is 49.5 secs Computing kpt #: 355 total cpu time spent up to now is 49.6 secs Computing kpt #: 356 total cpu time spent up to now is 49.8 secs Computing kpt #: 357 total cpu time spent up to now is 49.9 secs Computing kpt #: 358 total cpu time spent up to now is 50.0 secs Computing kpt #: 359 total cpu time spent up to now is 50.2 secs Computing kpt #: 360 total cpu time spent up to now is 50.3 secs Computing kpt #: 361 total cpu time spent up to now is 50.4 secs Computing kpt #: 362 total cpu time spent up to now is 50.5 secs Computing kpt #: 363 total cpu time spent up to now is 50.7 secs Computing kpt #: 364 total cpu time spent up to now is 50.8 secs Computing kpt #: 365 total cpu time spent up to now is 50.9 secs Computing kpt #: 366 total cpu time spent up to now is 51.0 secs Computing kpt #: 367 total cpu time spent up to now is 51.2 secs Computing kpt #: 368 total cpu time spent up to now is 51.3 secs Computing kpt #: 369 total cpu time spent up to now is 51.4 secs Computing kpt #: 370 total cpu time spent up to now is 51.5 secs Computing kpt #: 371 total cpu time spent up to now is 51.6 secs Computing kpt #: 372 total cpu time spent up to now is 51.7 secs Computing kpt #: 373 total cpu time spent up to now is 51.9 secs Computing kpt #: 374 total cpu time spent up to now is 52.0 secs Computing kpt #: 375 total cpu time spent up to now is 52.1 secs Computing kpt #: 376 total cpu time spent up to now is 52.2 secs Computing kpt #: 377 total cpu time spent up to now is 52.3 secs Computing kpt #: 378 total cpu time spent up to now is 52.4 secs Computing kpt #: 379 total cpu time spent up to now is 52.5 secs Computing kpt #: 380 total cpu time spent up to now is 52.6 secs Computing kpt #: 381 total cpu time spent up to now is 52.7 secs Computing kpt #: 382 total cpu time spent up to now is 52.8 secs Computing kpt #: 383 total cpu time spent up to now is 52.9 secs Computing kpt #: 384 total cpu time spent up to now is 53.1 secs Computing kpt #: 385 total cpu time spent up to now is 53.2 secs Computing kpt #: 386 total cpu time spent up to now is 53.3 secs Computing kpt #: 387 total cpu time spent up to now is 53.4 secs Computing kpt #: 388 total cpu time spent up to now is 53.5 secs Computing kpt #: 389 total cpu time spent up to now is 53.6 secs Computing kpt #: 390 total cpu time spent up to now is 53.7 secs Computing kpt #: 391 total cpu time spent up to now is 53.8 secs Computing kpt #: 392 total cpu time spent up to now is 53.9 secs Computing kpt #: 393 total cpu time spent up to now is 54.0 secs Computing kpt #: 394 total cpu time spent up to now is 54.1 secs Computing kpt #: 395 total cpu time spent up to now is 54.3 secs Computing kpt #: 396 total cpu time spent up to now is 54.4 secs Computing kpt #: 397 total cpu time spent up to now is 54.5 secs Computing kpt #: 398 total cpu time spent up to now is 54.6 secs Computing kpt #: 399 total cpu time spent up to now is 54.7 secs Computing kpt #: 400 total cpu time spent up to now is 54.8 secs ethr = 3.57E-08, avg # of iterations = 12.4 total cpu time spent up to now is 54.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1365 PWs) bands (ev): -46.6010 -46.6010 -44.3512 -44.3512 -20.6154 -20.6154 -18.6132 -18.6132 -18.1290 -18.1290 -18.1290 -18.1290 -17.3237 -17.3237 -17.3237 -17.3237 12.7826 12.7826 15.2184 15.2184 15.2184 15.2184 18.9726 18.9726 18.9726 18.9726 19.0882 19.0882 21.5268 21.5268 21.5268 21.5268 23.1346 23.1346 23.1346 23.1346 k = 0.0000 0.0096-0.0000 ( 1365 PWs) bands (ev): -46.6010 -46.6010 -44.3512 -44.3512 -20.6154 -20.6154 -18.6133 -18.6133 -18.1289 -18.1289 -18.1288 -18.1288 -17.3240 -17.3240 -17.3238 -17.3238 12.7846 12.7846 15.2194 15.2194 15.2200 15.2200 18.9723 18.9723 18.9730 18.9730 19.0884 19.0884 21.5250 21.5250 21.5275 21.5275 23.1306 23.1306 23.1325 23.1325 k = 0.0000 0.0192-0.0000 ( 1374 PWs) bands (ev): -46.6009 -46.6009 -44.3512 -44.3512 -20.6155 -20.6155 -18.6137 -18.6137 -18.1291 -18.1291 -18.1283 -18.1283 -17.3249 -17.3249 -17.3243 -17.3243 12.7906 12.7906 15.2225 15.2225 15.2244 15.2244 18.9717 18.9717 18.9743 18.9743 19.0888 19.0888 21.5194 21.5194 21.5295 21.5295 23.1184 23.1184 23.1261 23.1261 k = 0.0000 0.0288-0.0000 ( 1382 PWs) bands (ev): -46.6008 -46.6008 -44.3512 -44.3512 -20.6156 -20.6156 -18.6142 -18.6142 -18.1289 -18.1289 -18.1276 -18.1276 -17.3265 -17.3265 -17.3251 -17.3251 12.8007 12.8007 15.2274 15.2274 15.2321 15.2321 18.9706 18.9706 18.9764 18.9764 19.0895 19.0895 21.5101 21.5101 21.5329 21.5329 23.0986 23.0986 23.1150 23.1150 k = 0.0000 0.0385-0.0000 ( 1382 PWs) bands (ev): -46.6005 -46.6005 -44.3512 -44.3512 -20.6157 -20.6157 -18.6149 -18.6149 -18.1286 -18.1286 -18.1264 -18.1264 -17.3288 -17.3288 -17.3262 -17.3262 12.8147 12.8147 15.2346 15.2346 15.2428 15.2428 18.9691 18.9691 18.9792 18.9792 19.0908 19.0908 21.4972 21.4972 21.5376 21.5376 23.0713 23.0713 23.0985 23.0985 k = 0.0000 0.0481-0.0000 ( 1390 PWs) bands (ev): -46.6003 -46.6003 -44.3512 -44.3512 -20.6158 -20.6158 -18.6158 -18.6158 -18.1282 -18.1282 -18.1250 -18.1250 -17.3316 -17.3316 -17.3276 -17.3276 12.8327 12.8327 15.2436 15.2436 15.2565 15.2565 18.9673 18.9673 18.9825 18.9825 19.0927 19.0927 21.4805 21.4805 21.5436 21.5436 23.0368 23.0368 23.0755 23.0755 k = 0.0000 0.0577-0.0000 ( 1390 PWs) bands (ev): -46.5999 -46.5999 -44.3513 -44.3513 -20.6159 -20.6159 -18.6169 -18.6169 -18.1276 -18.1276 -18.1231 -18.1231 -17.3351 -17.3351 -17.3293 -17.3293 12.8547 12.8547 15.2548 15.2548 15.2733 15.2733 18.9650 18.9650 18.9861 18.9861 19.0956 19.0956 21.4603 21.4603 21.5510 21.5510 22.9955 22.9955 23.0452 23.0452 k = 0.0000 0.0673-0.0000 ( 1390 PWs) bands (ev): -46.5995 -46.5995 -44.3513 -44.3513 -20.6160 -20.6160 -18.6181 -18.6181 -18.1270 -18.1270 -18.1208 -18.1208 -17.3391 -17.3391 -17.3314 -17.3314 12.8806 12.8806 15.2680 15.2680 15.2930 15.2930 18.9624 18.9624 18.9897 18.9897 19.0996 19.0996 21.4365 21.4365 21.5596 21.5596 22.9479 22.9479 23.0069 23.0069 k = 0.0000 0.0769-0.0000 ( 1390 PWs) bands (ev): -46.5991 -46.5991 -44.3514 -44.3514 -20.6161 -20.6161 -18.6195 -18.6195 -18.1262 -18.1262 -18.1182 -18.1182 -17.3438 -17.3438 -17.3337 -17.3337 12.9104 12.9104 15.2832 15.2832 15.3156 15.3156 18.9595 18.9595 18.9931 18.9931 19.1052 19.1052 21.4092 21.4092 21.5696 21.5696 22.8944 22.8944 22.9610 22.9610 k = 0.0000 0.0865-0.0000 ( 1394 PWs) bands (ev): -46.5986 -46.5986 -44.3514 -44.3514 -20.6162 -20.6162 -18.6211 -18.6211 -18.1253 -18.1253 -18.1152 -18.1152 -17.3492 -17.3492 -17.3364 -17.3364 12.9440 12.9440 15.3004 15.3004 15.3411 15.3411 18.9562 18.9562 18.9958 18.9958 19.1126 19.1126 21.3785 21.3785 21.5805 21.5805 22.8355 22.8355 22.9079 22.9079 k = 0.0000 0.0962-0.0000 ( 1394 PWs) bands (ev): -46.5980 -46.5980 -44.3515 -44.3515 -20.6163 -20.6163 -18.6229 -18.6229 -18.1243 -18.1243 -18.1119 -18.1119 -17.3550 -17.3550 -17.3393 -17.3393 12.9813 12.9813 15.3196 15.3196 15.3693 15.3693 18.9528 18.9528 18.9978 18.9978 19.1220 19.1220 21.3443 21.3443 21.5929 21.5929 22.7718 22.7718 22.8487 22.8487 k = 0.0000 0.1058-0.0000 ( 1390 PWs) bands (ev): -46.5974 -46.5974 -44.3516 -44.3516 -20.6164 -20.6164 -18.6247 -18.6247 -18.1231 -18.1231 -18.1083 -18.1083 -17.3613 -17.3613 -17.3425 -17.3425 13.0224 13.0224 15.3407 15.3407 15.4002 15.4002 18.9492 18.9492 18.9991 18.9991 19.1337 19.1337 21.3069 21.3069 21.6066 21.6066 22.7038 22.7038 22.7842 22.7842 k = 0.0000 0.1154-0.0000 ( 1390 PWs) bands (ev): -46.5967 -46.5967 -44.3516 -44.3516 -20.6166 -20.6166 -18.6268 -18.6268 -18.1218 -18.1218 -18.1043 -18.1043 -17.3682 -17.3682 -17.3461 -17.3461 13.0671 13.0671 15.3639 15.3639 15.4336 15.4336 18.9453 18.9453 18.9994 18.9994 19.1475 19.1475 21.2661 21.2661 21.6214 21.6214 22.6320 22.6320 22.7152 22.7152 k = 0.0000 0.1250-0.0000 ( 1402 PWs) bands (ev): -46.5960 -46.5960 -44.3517 -44.3517 -20.6168 -20.6168 -18.6292 -18.6292 -18.1204 -18.1204 -18.1000 -18.1000 -17.3759 -17.3759 -17.3501 -17.3501 13.1153 13.1153 15.3890 15.3890 15.4696 15.4696 18.9409 18.9409 18.9987 18.9987 19.1633 19.1633 21.2222 21.2222 21.6374 21.6374 22.5569 22.5569 22.6422 22.6422 k = 0.0000 0.1346-0.0000 ( 1402 PWs) bands (ev): -46.5952 -46.5952 -44.3518 -44.3518 -20.6170 -20.6170 -18.6316 -18.6316 -18.1188 -18.1188 -18.0954 -18.0954 -17.3839 -17.3839 -17.3542 -17.3542 13.1670 13.1670 15.4160 15.4160 15.5080 15.5080 18.9368 18.9368 18.9976 18.9976 19.1813 19.1813 21.1753 21.1753 21.6545 21.6545 22.4790 22.4790 22.5661 22.5661 k = 0.0000 0.1442-0.0000 ( 1402 PWs) bands (ev): -46.5944 -46.5944 -44.3519 -44.3519 -20.6171 -20.6171 -18.6341 -18.6341 -18.1170 -18.1170 -18.0905 -18.0905 -17.3923 -17.3923 -17.3586 -17.3586 13.2222 13.2222 15.4450 15.4450 15.5486 15.5486 18.9327 18.9327 18.9961 18.9961 19.2012 19.2012 21.1254 21.1254 21.6727 21.6727 22.3987 22.3987 22.4871 22.4871 k = 0.0000 0.1538-0.0000 ( 1410 PWs) bands (ev): -46.5936 -46.5936 -44.3520 -44.3520 -20.6174 -20.6174 -18.6368 -18.6368 -18.1151 -18.1151 -18.0854 -18.0854 -17.4014 -17.4014 -17.3634 -17.3634 13.2806 13.2806 15.4758 15.4758 15.5914 15.5914 18.9283 18.9283 18.9940 18.9940 19.2228 19.2228 21.0726 21.0726 21.6918 21.6918 22.3166 22.3166 22.4059 22.4059 k = 0.0000 0.1635-0.0000 ( 1414 PWs) bands (ev): -46.5927 -46.5927 -44.3521 -44.3521 -20.6176 -20.6176 -18.6396 -18.6396 -18.1132 -18.1132 -18.0799 -18.0799 -17.4107 -17.4107 -17.3684 -17.3684 13.3422 13.3422 15.5086 15.5086 15.6361 15.6361 18.9243 18.9243 18.9919 18.9919 19.2464 19.2464 21.0171 21.0171 21.7119 21.7119 22.2329 22.2329 22.3229 22.3229 k = 0.0000 0.1731-0.0000 ( 1414 PWs) bands (ev): -46.5918 -46.5918 -44.3522 -44.3522 -20.6179 -20.6179 -18.6425 -18.6425 -18.1109 -18.1109 -18.0741 -18.0741 -17.4205 -17.4205 -17.3737 -17.3737 13.4068 13.4068 15.5432 15.5432 15.6827 15.6827 18.9203 18.9203 18.9897 18.9897 19.2716 19.2716 20.9589 20.9589 21.7328 21.7328 22.1483 22.1483 22.2385 22.2385 k = 0.0000 0.1827-0.0000 ( 1414 PWs) bands (ev): -46.5908 -46.5908 -44.3523 -44.3523 -20.6181 -20.6181 -18.6455 -18.6455 -18.1085 -18.1085 -18.0680 -18.0680 -17.4307 -17.4307 -17.3792 -17.3792 13.4745 13.4745 15.5796 15.5796 15.7311 15.7311 18.9165 18.9165 18.9875 18.9875 19.2984 19.2984 20.8982 20.8982 21.7543 21.7543 22.0633 22.0633 22.1530 22.1530 k = 0.0000 0.1923-0.0000 ( 1414 PWs) bands (ev): -46.5899 -46.5899 -44.3524 -44.3524 -20.6183 -20.6183 -18.6485 -18.6485 -18.1058 -18.1058 -18.0616 -18.0616 -17.4413 -17.4413 -17.3849 -17.3849 13.5449 13.5449 15.6178 15.6178 15.7810 15.7810 18.9129 18.9129 18.9853 18.9853 19.3268 19.3268 20.8352 20.8352 21.7756 21.7756 21.9787 21.9787 22.0668 22.0668 k = 0.0000 0.2019-0.0000 ( 1422 PWs) bands (ev): -46.5889 -46.5889 -44.3525 -44.3525 -20.6186 -20.6186 -18.6518 -18.6518 -18.1030 -18.1030 -18.0551 -18.0551 -17.4524 -17.4524 -17.3911 -17.3911 13.6181 13.6181 15.6579 15.6579 15.8323 15.8323 18.9095 18.9095 18.9832 18.9832 19.3564 19.3564 20.7699 20.7699 21.7933 21.7933 21.8984 21.8984 21.9802 21.9802 k = 0.0000 0.2115-0.0000 ( 1422 PWs) bands (ev): -46.5879 -46.5879 -44.3526 -44.3526 -20.6189 -20.6189 -18.6550 -18.6550 -18.0999 -18.0999 -18.0482 -18.0482 -17.4636 -17.4636 -17.3974 -17.3974 13.6938 13.6938 15.6996 15.6996 15.8848 15.8848 18.9065 18.9065 18.9815 18.9815 19.3877 19.3877 20.7024 20.7024 21.7776 21.7776 21.8523 21.8523 21.8934 21.8934 k = 0.0000 0.2212-0.0000 ( 1422 PWs) bands (ev): -46.5868 -46.5868 -44.3527 -44.3527 -20.6192 -20.6192 -18.6583 -18.6583 -18.0966 -18.0966 -18.0411 -18.0411 -17.4752 -17.4752 -17.4038 -17.4038 13.7719 13.7719 15.7431 15.7431 15.9382 15.9382 18.9039 18.9039 18.9801 18.9801 19.4205 19.4205 20.6330 20.6330 21.7051 21.7051 21.8068 21.8068 21.8642 21.8642 k = 0.0000 0.2308-0.0000 ( 1430 PWs) bands (ev): -46.5858 -46.5858 -44.3529 -44.3529 -20.6196 -20.6196 -18.6617 -18.6617 -18.0933 -18.0933 -18.0339 -18.0339 -17.4871 -17.4871 -17.4106 -17.4106 13.8522 13.8522 15.7881 15.7881 15.9923 15.9923 18.9017 18.9017 18.9790 18.9790 19.4546 19.4546 20.5617 20.5617 21.6219 21.6219 21.7203 21.7203 21.8877 21.8877 k = 0.0000 0.2404-0.0000 ( 1422 PWs) bands (ev): -46.5848 -46.5848 -44.3530 -44.3530 -20.6198 -20.6198 -18.6649 -18.6649 -18.0895 -18.0895 -18.0263 -18.0263 -17.4990 -17.4990 -17.4174 -17.4174 13.9347 13.9347 15.8349 15.8349 16.0470 16.0470 18.9001 18.9001 18.9786 18.9786 19.4900 19.4900 20.4888 20.4888 21.5379 21.5379 21.6346 21.6346 21.9142 21.9142 k = 0.0000 0.2500-0.0000 ( 1422 PWs) bands (ev): -46.5837 -46.5837 -44.3531 -44.3531 -20.6201 -20.6201 -18.6683 -18.6683 -18.0856 -18.0856 -18.0185 -18.0185 -17.5114 -17.5114 -17.4246 -17.4246 14.0190 14.0190 15.8832 15.8832 16.1020 16.1020 18.8989 18.8989 18.9785 18.9785 19.5267 19.5267 20.4144 20.4144 21.4541 21.4541 21.5497 21.5497 21.9417 21.9417 k = 0.0000 0.2596-0.0000 ( 1422 PWs) bands (ev): -46.5826 -46.5826 -44.3532 -44.3532 -20.6204 -20.6204 -18.6717 -18.6717 -18.0813 -18.0813 -18.0106 -18.0106 -17.5239 -17.5239 -17.4319 -17.4319 14.1049 14.1049 15.9331 15.9331 16.1570 16.1570 18.8982 18.8982 18.9790 18.9790 19.5645 19.5645 20.3386 20.3386 21.3712 21.3712 21.4658 21.4658 21.9700 21.9700 k = 0.0000 0.2692-0.0000 ( 1422 PWs) bands (ev): -46.5816 -46.5816 -44.3533 -44.3533 -20.6208 -20.6208 -18.6752 -18.6752 -18.0769 -18.0769 -18.0024 -18.0024 -17.5367 -17.5367 -17.4394 -17.4394 14.1924 14.1924 15.9844 15.9844 16.2119 16.2119 18.8981 18.8981 18.9800 18.9800 19.6034 19.6034 20.2618 20.2618 21.2893 21.2893 21.3830 21.3830 21.9992 21.9992 k = 0.0000 0.2788-0.0000 ( 1426 PWs) bands (ev): -46.5806 -46.5806 -44.3534 -44.3534 -20.6211 -20.6211 -18.6786 -18.6786 -18.0722 -18.0722 -17.9941 -17.9941 -17.5497 -17.5497 -17.4471 -17.4471 14.2811 14.2811 16.0372 16.0372 16.2662 16.2662 18.8986 18.8986 18.9816 18.9816 19.6432 19.6432 20.1842 20.1842 21.2088 21.2088 21.3016 21.3016 22.0290 22.0290 k = 0.0000 0.2885-0.0000 ( 1426 PWs) bands (ev): -46.5795 -46.5795 -44.3536 -44.3536 -20.6214 -20.6214 -18.6820 -18.6820 -18.0673 -18.0673 -17.9857 -17.9857 -17.5627 -17.5627 -17.4549 -17.4549 14.3708 14.3708 16.0912 16.0912 16.3198 16.3198 18.8998 18.8998 18.9839 18.9839 19.6835 19.6835 20.1063 20.1063 21.1298 21.1298 21.2216 21.2216 22.0596 22.0596 k = 0.0000 0.2981-0.0000 ( 1426 PWs) bands (ev): -46.5785 -46.5785 -44.3537 -44.3537 -20.6218 -20.6218 -18.6853 -18.6853 -18.0621 -18.0621 -17.9771 -17.9771 -17.5758 -17.5758 -17.4629 -17.4629 14.4614 14.4614 16.1466 16.1466 16.3724 16.3724 18.9017 18.9017 18.9870 18.9870 19.7235 19.7235 20.0292 20.0292 21.0526 21.0526 21.1433 21.1433 22.0908 22.0908 k = 0.0000 0.3077-0.0000 ( 1430 PWs) bands (ev): -46.5775 -46.5775 -44.3538 -44.3538 -20.6221 -20.6221 -18.6886 -18.6886 -18.0568 -18.0568 -17.9684 -17.9684 -17.5890 -17.5890 -17.4710 -17.4710 14.5524 14.5524 16.2030 16.2030 16.4236 16.4236 18.9042 18.9042 18.9907 18.9907 19.7603 19.7603 19.9557 19.9557 20.9771 20.9771 21.0667 21.0667 22.1227 22.1227 k = 0.0000 0.3173-0.0000 ( 1426 PWs) bands (ev): -46.5765 -46.5765 -44.3539 -44.3539 -20.6224 -20.6224 -18.6918 -18.6918 -18.0510 -18.0510 -17.9596 -17.9596 -17.6023 -17.6023 -17.4792 -17.4792 14.6436 14.6436 16.2606 16.2606 16.4734 16.4734 18.9075 18.9075 18.9952 18.9952 19.7802 19.7802 19.8998 19.8998 20.9037 20.9037 20.9922 20.9922 22.0876 22.0876 k = 0.0000 0.3269-0.0000 ( 1426 PWs) bands (ev): -46.5756 -46.5756 -44.3540 -44.3540 -20.6227 -20.6227 -18.6950 -18.6950 -18.0450 -18.0450 -17.9508 -17.9508 -17.6155 -17.6155 -17.4875 -17.4875 14.7348 14.7348 16.3191 16.3191 16.5212 16.5212 18.9115 18.9115 19.0003 19.0003 19.7467 19.7467 19.8981 19.8981 20.8324 20.8324 20.9196 20.9196 22.0301 22.0301 k = 0.0000 0.3365-0.0000 ( 1426 PWs) bands (ev): -46.5746 -46.5746 -44.3541 -44.3541 -20.6230 -20.6230 -18.6980 -18.6980 -18.0389 -18.0389 -17.9419 -17.9419 -17.6288 -17.6288 -17.4958 -17.4958 14.8255 14.8255 16.3783 16.3783 16.5669 16.5669 18.9161 18.9161 19.0062 19.0062 19.6781 19.6781 19.9326 19.9326 20.7633 20.7633 20.8492 20.8492 21.9720 21.9720 k = 0.0000 0.3462-0.0000 ( 1426 PWs) bands (ev): -46.5738 -46.5738 -44.3542 -44.3542 -20.6233 -20.6233 -18.7010 -18.7010 -18.0325 -18.0325 -17.9330 -17.9330 -17.6420 -17.6420 -17.5042 -17.5042 14.9155 14.9155 16.4383 16.4383 16.6102 16.6102 18.9214 18.9214 19.0127 19.0127 19.6014 19.6014 19.9763 19.9763 20.6967 20.6967 20.7812 20.7812 21.9134 21.9134 k = 0.0000 0.3558-0.0000 ( 1426 PWs) bands (ev): -46.5729 -46.5729 -44.3543 -44.3543 -20.6236 -20.6236 -18.7038 -18.7038 -18.0259 -18.0259 -17.9242 -17.9242 -17.6551 -17.6551 -17.5125 -17.5125 15.0043 15.0043 16.4987 16.4987 16.6508 16.6508 18.9273 18.9273 19.0198 19.0198 19.5230 19.5230 20.0233 20.0233 20.6326 20.6326 20.7157 20.7157 21.8544 21.8544 k = 0.0000 0.3654-0.0000 ( 1434 PWs) bands (ev): -46.5721 -46.5721 -44.3544 -44.3544 -20.6240 -20.6240 -18.7066 -18.7066 -18.0192 -18.0192 -17.9154 -17.9154 -17.6681 -17.6681 -17.5208 -17.5208 15.0916 15.0916 16.5593 16.5593 16.6885 16.6885 18.9338 18.9338 19.0274 19.0274 19.4445 19.4445 20.0720 20.0720 20.5710 20.5710 20.6526 20.6526 21.7950 21.7950 k = 0.0000 0.3750-0.0000 ( 1426 PWs) bands (ev): -46.5713 -46.5713 -44.3545 -44.3545 -20.6242 -20.6242 -18.7091 -18.7091 -18.0120 -18.0120 -17.9066 -17.9066 -17.6809 -17.6809 -17.5291 -17.5291 15.1769 15.1769 16.6199 16.6199 16.7232 16.7232 18.9408 18.9408 19.0352 19.0352 19.3668 19.3668 20.1219 20.1219 20.5127 20.5127 20.5928 20.5928 21.7354 21.7354 k = 0.0000 0.3846-0.0000 ( 1434 PWs) bands (ev): -46.5706 -46.5706 -44.3546 -44.3546 -20.6245 -20.6245 -18.7117 -18.7117 -18.0049 -18.0049 -17.8981 -17.8981 -17.6938 -17.6938 -17.5372 -17.5372 15.2597 15.2597 16.6803 16.6803 16.7546 16.7546 18.9482 18.9482 19.0430 19.0430 19.2908 19.2908 20.1727 20.1727 20.4572 20.4572 20.5358 20.5358 21.6756 21.6756 k = 0.0000 0.3942-0.0000 ( 1430 PWs) bands (ev): -46.5699 -46.5699 -44.3547 -44.3547 -20.6247 -20.6247 -18.7139 -18.7139 -17.9976 -17.9976 -17.8897 -17.8897 -17.7061 -17.7061 -17.5452 -17.5452 15.3396 15.3396 16.7400 16.7400 16.7827 16.7827 18.9560 18.9560 19.0500 19.0500 19.2178 19.2178 20.2242 20.2242 20.4050 20.4050 20.4821 20.4821 21.6159 21.6159 k = 0.0000 0.4038-0.0000 ( 1430 PWs) bands (ev): -46.5693 -46.5693 -44.3548 -44.3548 -20.6250 -20.6250 -18.7160 -18.7160 -17.9902 -17.9902 -17.8816 -17.8816 -17.7182 -17.7182 -17.5529 -17.5529 15.4159 15.4159 16.7986 16.7986 16.8073 16.8073 18.9640 18.9640 19.0529 19.0529 19.1512 19.1512 20.2760 20.2760 20.3562 20.3562 20.4319 20.4319 21.5563 21.5563 k = 0.0000 0.4135-0.0000 ( 1430 PWs) bands (ev): -46.5687 -46.5687 -44.3548 -44.3548 -20.6252 -20.6252 -18.7180 -18.7180 -17.9828 -17.9828 -17.8738 -17.8738 -17.7299 -17.7299 -17.5603 -17.5603 15.4881 15.4881 16.8286 16.8286 16.8557 16.8557 18.9720 18.9720 19.0365 19.0365 19.1068 19.1068 20.3110 20.3110 20.3269 20.3269 20.3866 20.3866 21.4971 21.4971 k = 0.0000 0.4231-0.0000 ( 1434 PWs) bands (ev): -46.5682 -46.5682 -44.3549 -44.3549 -20.6254 -20.6254 -18.7198 -18.7198 -17.9755 -17.9755 -17.8665 -17.8665 -17.7412 -17.7412 -17.5675 -17.5675 15.5555 15.5555 16.8464 16.8464 16.9106 16.9106 18.9799 18.9799 18.9869 18.9869 19.0988 19.0988 20.2696 20.2696 20.3376 20.3376 20.3854 20.3854 21.4384 21.4384 k = 0.0000 0.4327-0.0000 ( 1434 PWs) bands (ev): -46.5677 -46.5677 -44.3549 -44.3549 -20.6256 -20.6256 -18.7213 -18.7213 -17.9682 -17.9682 -17.8596 -17.8596 -17.7519 -17.7519 -17.5741 -17.5741 15.6175 15.6175 16.8611 16.8611 16.9626 16.9626 18.9288 18.9288 18.9876 18.9876 19.1033 19.1033 20.2324 20.2324 20.3009 20.3009 20.4354 20.4354 21.3808 21.3808 k = 0.0000 0.4423-0.0000 ( 1426 PWs) bands (ev): -46.5673 -46.5673 -44.3550 -44.3550 -20.6257 -20.6257 -18.7226 -18.7226 -17.9612 -17.9612 -17.8532 -17.8532 -17.7618 -17.7618 -17.5800 -17.5800 15.6733 15.6733 16.8728 16.8728 17.0109 17.0109 18.8732 18.8732 18.9949 18.9949 19.1103 19.1103 20.1995 20.1995 20.2668 20.2668 20.4866 20.4866 21.3245 21.3245 k = 0.0000 0.4519-0.0000 ( 1430 PWs) bands (ev): -46.5670 -46.5670 -44.3550 -44.3550 -20.6259 -20.6259 -18.7239 -18.7239 -17.9546 -17.9546 -17.8477 -17.8477 -17.7711 -17.7711 -17.5854 -17.5854 15.7222 15.7222 16.8818 16.8818 17.0545 17.0545 18.8224 18.8224 19.0014 19.0014 19.1172 19.1172 20.1710 20.1710 20.2371 20.2371 20.5365 20.5365 21.2704 21.2704 k = 0.0000 0.4615-0.0000 ( 1422 PWs) bands (ev): -46.5667 -46.5667 -44.3551 -44.3551 -20.6259 -20.6259 -18.7247 -18.7247 -17.9486 -17.9486 -17.8428 -17.8428 -17.7791 -17.7791 -17.5900 -17.5900 15.7636 15.7636 16.8884 16.8884 17.0925 17.0925 18.7784 18.7784 19.0072 19.0072 19.1237 19.1237 20.1475 20.1475 20.2124 20.2124 20.5841 20.5841 21.2196 21.2196 k = 0.0000 0.4712-0.0000 ( 1422 PWs) bands (ev): -46.5664 -46.5664 -44.3551 -44.3551 -20.6260 -20.6260 -18.7255 -18.7255 -17.9435 -17.9435 -17.8389 -17.8389 -17.7858 -17.7858 -17.5937 -17.5937 15.7966 15.7966 16.8930 16.8930 17.1235 17.1235 18.7425 18.7425 19.0118 19.0118 19.1291 19.1291 20.1289 20.1289 20.1927 20.1927 20.6273 20.6273 21.1737 21.1737 k = 0.0000 0.4808-0.0000 ( 1422 PWs) bands (ev): -46.5663 -46.5663 -44.3551 -44.3551 -20.6261 -20.6261 -18.7260 -18.7260 -17.9395 -17.9395 -17.8361 -17.8361 -17.7909 -17.7909 -17.5965 -17.5965 15.8206 15.8206 16.8960 16.8960 17.1467 17.1467 18.7158 18.7158 19.0153 19.0153 19.1331 19.1331 20.1154 20.1154 20.1785 20.1785 20.6635 20.6635 21.1357 21.1357 k = 0.0000 0.4904-0.0000 ( 1422 PWs) bands (ev): -46.5662 -46.5662 -44.3551 -44.3551 -20.6261 -20.6261 -18.7264 -18.7264 -17.9370 -17.9370 -17.8343 -17.8343 -17.7942 -17.7942 -17.5982 -17.5982 15.8353 15.8353 16.8977 16.8977 17.1609 17.1609 18.6994 18.6994 19.0174 19.0174 19.1356 19.1356 20.1073 20.1073 20.1699 20.1699 20.6883 20.6883 21.1098 21.1098 k = 0.0000 0.5000-0.0000 ( 1422 PWs) bands (ev): -46.5662 -46.5662 -44.3551 -44.3551 -20.6261 -20.6261 -18.7265 -18.7265 -17.9362 -17.9362 -17.8338 -17.8338 -17.7953 -17.7953 -17.5987 -17.5987 15.8402 15.8402 16.8982 16.8982 17.1658 17.1658 18.6938 18.6938 19.0182 19.0182 19.1365 19.1365 20.1046 20.1046 20.1670 20.1670 20.6973 20.6973 21.1004 21.1004 k = 0.0000 0.5000-0.0000 ( 1422 PWs) bands (ev): -46.5662 -46.5662 -44.3551 -44.3551 -20.6261 -20.6261 -18.7265 -18.7265 -17.9362 -17.9362 -17.8338 -17.8338 -17.7953 -17.7953 -17.5987 -17.5987 15.8402 15.8402 16.8982 16.8982 17.1658 17.1658 18.6938 18.6938 19.0182 19.0182 19.1365 19.1365 20.1046 20.1046 20.1670 20.1670 20.6973 20.6973 21.1004 21.1004 k = 0.0096 0.5000-0.0000 ( 1422 PWs) bands (ev): -46.5661 -46.5661 -44.3551 -44.3551 -20.6262 -20.6262 -18.7267 -18.7267 -17.9364 -17.9364 -17.8360 -17.8360 -17.7929 -17.7929 -17.5985 -17.5985 15.8413 15.8413 16.8968 16.8968 17.1660 17.1660 18.6824 18.6824 19.0239 19.0239 19.1419 19.1419 20.0957 20.0957 20.1606 20.1606 20.7141 20.7141 21.1046 21.1046 k = 0.0192 0.5000-0.0000 ( 1422 PWs) bands (ev): -46.5661 -46.5661 -44.3551 -44.3551 -20.6265 -20.6265 -18.7273 -18.7273 -17.9370 -17.9370 -17.8416 -17.8416 -17.7871 -17.7871 -17.5980 -17.5980 15.8444 15.8444 16.8926 16.8926 17.1669 17.1669 18.6527 18.6527 19.0315 19.0315 19.1630 19.1630 20.0619 20.0619 20.1538 20.1538 20.7596 20.7596 21.1171 21.1171 k = 0.0288 0.5000-0.0000 ( 1422 PWs) bands (ev): -46.5660 -46.5660 -44.3550 -44.3550 -20.6270 -20.6270 -18.7284 -18.7284 -17.9381 -17.9381 -17.8488 -17.8488 -17.7794 -17.7794 -17.5970 -17.5970 15.8496 15.8496 16.8853 16.8853 17.1683 17.1683 18.6136 18.6136 19.0275 19.0275 19.2050 19.2050 20.0033 20.0033 20.1559 20.1559 20.8241 20.8241 21.1376 21.1376 k = 0.0385 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5658 -46.5658 -44.3549 -44.3549 -20.6278 -20.6278 -18.7300 -18.7300 -17.9397 -17.9397 -17.8569 -17.8569 -17.7708 -17.7708 -17.5958 -17.5958 15.8565 15.8565 16.8749 16.8749 17.1706 17.1706 18.5714 18.5714 19.0107 19.0107 19.2631 19.2631 19.9306 19.9306 20.1637 20.1637 20.9000 20.9000 21.1657 21.1657 k = 0.0481 0.5000-0.0000 ( 1432 PWs) bands (ev): -46.5657 -46.5657 -44.3548 -44.3548 -20.6287 -20.6287 -18.7320 -18.7320 -17.9416 -17.9416 -17.8652 -17.8652 -17.7617 -17.7617 -17.5941 -17.5941 15.8651 15.8651 16.8610 16.8610 17.1741 17.1741 18.5304 18.5304 18.9847 18.9847 19.3305 19.3305 19.8504 19.8504 20.1756 20.1756 20.9825 20.9825 21.2008 21.2008 k = 0.0577 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5655 -46.5655 -44.3547 -44.3547 -20.6298 -20.6298 -18.7343 -18.7343 -17.9439 -17.9439 -17.8735 -17.8735 -17.7524 -17.7524 -17.5921 -17.5921 15.8751 15.8751 16.8434 16.8434 17.1791 17.1791 18.4930 18.4930 18.9518 18.9518 19.4033 19.4033 19.7663 19.7663 20.1909 20.1909 21.0688 21.0688 21.2423 21.2423 k = 0.0673 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5652 -46.5652 -44.3545 -44.3545 -20.6311 -20.6311 -18.7370 -18.7370 -17.9465 -17.9465 -17.8818 -17.8818 -17.7429 -17.7429 -17.5898 -17.5898 15.8860 15.8860 16.8218 16.8218 17.1860 17.1860 18.4606 18.4606 18.9135 18.9135 19.4783 19.4783 19.6810 19.6810 20.2090 20.2090 21.1573 21.1573 21.2895 21.2895 k = 0.0769 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5649 -46.5649 -44.3543 -44.3543 -20.6326 -20.6326 -18.7402 -18.7402 -17.9495 -17.9495 -17.8900 -17.8900 -17.7333 -17.7333 -17.5872 -17.5872 15.8976 15.8976 16.7960 16.7960 17.1952 17.1952 18.4345 18.4345 18.8709 18.8709 19.5438 19.5438 19.6060 19.6060 20.2296 20.2296 21.2470 21.2470 21.3419 21.3419 k = 0.0865 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5646 -46.5646 -44.3541 -44.3541 -20.6343 -20.6343 -18.7437 -18.7437 -17.9529 -17.9529 -17.8981 -17.8981 -17.7237 -17.7237 -17.5844 -17.5844 15.9093 15.9093 16.7658 16.7658 17.2073 17.2073 18.4152 18.4152 18.8247 18.8247 19.4946 19.4946 19.6463 19.6463 20.2527 20.2527 21.3369 21.3369 21.3990 21.3990 k = 0.0962 0.5000-0.0000 ( 1426 PWs) bands (ev): -46.5642 -46.5642 -44.3538 -44.3538 -20.6361 -20.6361 -18.7475 -18.7475 -17.9565 -17.9565 -17.9059 -17.9059 -17.7140 -17.7140 -17.5813 -17.5813 15.9208 15.9208 16.7313 16.7313 17.2229 17.2229 18.4032 18.4032 18.7757 18.7757 19.4086 19.4086 19.7242 19.7242 20.2781 20.2781 21.4258 21.4258 21.4611 21.4611 k = 0.1058 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5639 -46.5639 -44.3536 -44.3536 -20.6382 -20.6382 -18.7519 -18.7519 -17.9604 -17.9604 -17.9136 -17.9136 -17.7044 -17.7044 -17.5780 -17.5780 15.9315 15.9315 16.6925 16.6925 17.2425 17.2425 18.3987 18.3987 18.7244 18.7244 19.3208 19.3208 19.8042 19.8042 20.3055 20.3055 21.5091 21.5091 21.5318 21.5318 k = 0.1154 0.5000-0.0000 ( 1434 PWs) bands (ev): -46.5634 -46.5634 -44.3533 -44.3533 -20.6404 -20.6404 -18.7565 -18.7565 -17.9647 -17.9647 -17.9210 -17.9210 -17.6949 -17.6949 -17.5745 -17.5745 15.9410 15.9410 16.6496 16.6496 17.2667 17.2667 18.4019 18.4019 18.6713 18.6713 19.2331 19.2331 19.8845 19.8845 20.3348 20.3348 21.5818 21.5818 21.6152 21.6152 k = 0.1250 0.5000-0.0000 ( 1434 PWs) bands (ev): -46.5630 -46.5630 -44.3530 -44.3530 -20.6427 -20.6427 -18.7615 -18.7615 -17.9691 -17.9691 -17.9281 -17.9281 -17.6854 -17.6854 -17.5709 -17.5709 15.9488 15.9488 16.6030 16.6030 17.2960 17.2960 18.4125 18.4125 18.6171 18.6171 19.1460 19.1460 19.9644 19.9644 20.3658 20.3658 21.6518 21.6518 21.7031 21.7031 k = 0.1346 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5625 -46.5625 -44.3526 -44.3526 -20.6452 -20.6452 -18.7667 -18.7667 -17.9738 -17.9738 -17.9349 -17.9349 -17.6759 -17.6759 -17.5671 -17.5671 15.9546 15.9546 16.5530 16.5530 17.3310 17.3310 18.4302 18.4302 18.5622 18.5622 19.0597 19.0597 20.0437 20.0437 20.3985 20.3985 21.7227 21.7227 21.7912 21.7912 k = 0.1442 0.5000-0.0000 ( 1434 PWs) bands (ev): -46.5620 -46.5620 -44.3523 -44.3523 -20.6479 -20.6479 -18.7723 -18.7723 -17.9787 -17.9787 -17.9415 -17.9415 -17.6667 -17.6667 -17.5632 -17.5632 15.9580 15.9580 16.5000 16.5000 17.3718 17.3718 18.4526 18.4526 18.5088 18.5088 18.9745 18.9745 20.1221 20.1221 20.4326 20.4326 21.7946 21.7946 21.8785 21.8785 k = 0.1538 0.5000-0.0000 ( 1434 PWs) bands (ev): -46.5615 -46.5615 -44.3519 -44.3519 -20.6507 -20.6507 -18.7781 -18.7781 -17.9838 -17.9838 -17.9477 -17.9477 -17.6574 -17.6574 -17.5592 -17.5592 15.9589 15.9589 16.4447 16.4447 17.4189 17.4189 18.4427 18.4427 18.4941 18.4941 18.8905 18.8905 20.1993 20.1993 20.4679 20.4679 21.8676 21.8676 21.9650 21.9650 k = 0.1635 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5609 -46.5609 -44.3516 -44.3516 -20.6535 -20.6535 -18.7841 -18.7841 -17.9890 -17.9890 -17.9536 -17.9536 -17.6483 -17.6483 -17.5551 -17.5551 15.9572 15.9572 16.3874 16.3874 17.4723 17.4723 18.3896 18.3896 18.5289 18.5289 18.8079 18.8079 20.2751 20.2751 20.5045 20.5045 21.9415 21.9415 22.0502 22.0502 k = 0.1731 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5604 -46.5604 -44.3512 -44.3512 -20.6566 -20.6566 -18.7904 -18.7904 -17.9944 -17.9944 -17.9592 -17.9592 -17.6394 -17.6394 -17.5510 -17.5510 15.9529 15.9529 16.3286 16.3286 17.5322 17.5322 18.3339 18.3339 18.5721 18.5721 18.7268 18.7268 20.3493 20.3493 20.5420 20.5420 22.0158 22.0158 22.1341 22.1341 k = 0.1827 0.5000-0.0000 ( 1436 PWs) bands (ev): -46.5598 -46.5598 -44.3508 -44.3508 -20.6597 -20.6597 -18.7970 -18.7970 -17.9999 -17.9999 -17.9646 -17.9646 -17.6306 -17.6306 -17.5469 -17.5469 15.9459 15.9459 16.2686 16.2686 17.5983 17.5983 18.2781 18.2781 18.6197 18.6197 18.6486 18.6486 20.4218 20.4218 20.5802 20.5802 22.0904 22.0904 22.2165 22.2165 k = 0.1923 0.5000-0.0000 ( 1436 PWs) bands (ev): -46.5592 -46.5592 -44.3504 -44.3504 -20.6629 -20.6629 -18.8037 -18.8037 -18.0054 -18.0054 -17.9696 -17.9696 -17.6220 -17.6220 -17.5427 -17.5427 15.9366 15.9366 16.2079 16.2079 17.6707 17.6707 18.2227 18.2227 18.5681 18.5681 18.6768 18.6768 20.4924 20.4924 20.6193 20.6193 22.1651 22.1651 22.2974 22.2974 k = 0.2019 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5585 -46.5585 -44.3499 -44.3499 -20.6662 -20.6662 -18.8104 -18.8104 -18.0109 -18.0109 -17.9743 -17.9743 -17.6135 -17.6135 -17.5385 -17.5385 15.9252 15.9252 16.1469 16.1469 17.7490 17.7490 18.1680 18.1680 18.4922 18.4922 18.7362 18.7362 20.5609 20.5609 20.6592 20.6592 22.2397 22.2397 22.3765 22.3765 k = 0.2115 0.5000-0.0000 ( 1432 PWs) bands (ev): -46.5579 -46.5579 -44.3495 -44.3495 -20.6696 -20.6696 -18.8175 -18.8175 -18.0165 -18.0165 -17.9789 -17.9789 -17.6052 -17.6052 -17.5344 -17.5344 15.9117 15.9117 16.0858 16.0858 17.8329 17.8329 18.1142 18.1142 18.4180 18.4180 18.8003 18.8003 20.6270 20.6270 20.6997 20.6997 22.3138 22.3138 22.4538 22.4538 k = 0.2212 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5573 -46.5573 -44.3491 -44.3491 -20.6730 -20.6730 -18.8245 -18.8245 -18.0219 -18.0219 -17.9832 -17.9832 -17.5972 -17.5972 -17.5303 -17.5303 15.8965 15.8965 16.0250 16.0250 17.9215 17.9215 18.0617 18.0617 18.3460 18.3460 18.8689 18.8689 20.6902 20.6902 20.7412 20.7412 22.3876 22.3876 22.5292 22.5292 k = 0.2308 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5566 -46.5566 -44.3486 -44.3486 -20.6764 -20.6764 -18.8317 -18.8317 -18.0273 -18.0273 -17.9873 -17.9873 -17.5893 -17.5893 -17.5262 -17.5262 15.8797 15.8797 15.9647 15.9647 17.9976 17.9976 18.0267 18.0267 18.2774 18.2774 18.9414 18.9414 20.7493 20.7493 20.7848 20.7848 22.4605 22.4605 22.6026 22.6026 k = 0.2404 0.5000-0.0000 ( 1432 PWs) bands (ev): -46.5560 -46.5560 -44.3482 -44.3482 -20.6800 -20.6800 -18.8389 -18.8389 -18.0327 -18.0327 -17.9912 -17.9912 -17.5817 -17.5817 -17.5222 -17.5222 15.8617 15.8617 15.9051 15.9051 17.9558 17.9558 18.1075 18.1075 18.2187 18.2187 19.0177 19.0177 20.8018 20.8018 20.8326 20.8326 22.5326 22.5326 22.6737 22.6737 k = 0.2500 0.5000-0.0000 ( 1436 PWs) bands (ev): -46.5553 -46.5553 -44.3477 -44.3477 -20.6835 -20.6835 -18.8462 -18.8462 -18.0380 -18.0380 -17.9949 -17.9949 -17.5742 -17.5742 -17.5183 -17.5183 15.8415 15.8415 15.8478 15.8478 17.9065 17.9065 18.1200 18.1200 18.2440 18.2440 19.0974 19.0974 20.8475 20.8475 20.8848 20.8848 22.6036 22.6036 22.7424 22.7424 k = 0.2596 0.5000-0.0000 ( 1424 PWs) bands (ev): -46.5547 -46.5547 -44.3473 -44.3473 -20.6870 -20.6870 -18.8533 -18.8533 -18.0430 -18.0430 -17.9982 -17.9982 -17.5670 -17.5670 -17.5143 -17.5143 15.7887 15.7887 15.8236 15.8236 17.8583 17.8583 18.0639 18.0639 18.3450 18.3450 19.1807 19.1807 20.8896 20.8896 20.9383 20.9383 22.6735 22.6735 22.8082 22.8082 k = 0.2692 0.5000-0.0000 ( 1424 PWs) bands (ev): -46.5540 -46.5540 -44.3468 -44.3468 -20.6905 -20.6905 -18.8604 -18.8604 -18.0480 -18.0480 -18.0015 -18.0015 -17.5600 -17.5600 -17.5105 -17.5105 15.7326 15.7326 15.8033 15.8033 17.8113 17.8113 18.0032 18.0032 18.4569 18.4569 19.2670 19.2670 20.9299 20.9299 20.9906 20.9906 22.7418 22.7418 22.8697 22.8697 k = 0.2788 0.5000-0.0000 ( 1424 PWs) bands (ev): -46.5533 -46.5533 -44.3464 -44.3464 -20.6940 -20.6940 -18.8676 -18.8676 -18.0528 -18.0528 -18.0045 -18.0045 -17.5533 -17.5533 -17.5067 -17.5067 15.6778 15.6778 15.7827 15.7827 17.7656 17.7656 17.9436 17.9436 18.5740 18.5740 19.3561 19.3561 20.9690 20.9690 21.0411 21.0411 22.8083 22.8083 22.9218 22.9218 k = 0.2885 0.5000-0.0000 ( 1424 PWs) bands (ev): -46.5527 -46.5527 -44.3460 -44.3460 -20.6975 -20.6975 -18.8746 -18.8746 -18.0575 -18.0575 -18.0074 -18.0074 -17.5468 -17.5468 -17.5031 -17.5031 15.6246 15.6246 15.7620 15.7620 17.7215 17.7215 17.8857 17.8857 18.6952 18.6952 19.4480 19.4480 21.0073 21.0073 21.0894 21.0894 22.8729 22.8729 22.9477 22.9477 k = 0.2981 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5521 -46.5521 -44.3455 -44.3455 -20.7010 -20.7010 -18.8816 -18.8816 -18.0621 -18.0621 -18.0102 -18.0102 -17.5406 -17.5406 -17.4996 -17.4996 15.5731 15.5731 15.7412 15.7412 17.6788 17.6788 17.8300 17.8300 18.8200 18.8200 19.5423 19.5423 21.0445 21.0445 21.1356 21.1356 22.9340 22.9340 22.9475 22.9475 k = 0.3077 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5515 -46.5515 -44.3451 -44.3451 -20.7043 -20.7043 -18.8884 -18.8884 -18.0665 -18.0665 -18.0128 -18.0128 -17.5347 -17.5347 -17.4962 -17.4962 15.5234 15.5234 15.7206 15.7206 17.6378 17.6378 17.7765 17.7765 18.9480 18.9480 19.6390 19.6390 21.0809 21.0809 21.1794 21.1794 22.9335 22.9335 22.9952 22.9952 k = 0.3173 0.5000-0.0000 ( 1426 PWs) bands (ev): -46.5508 -46.5508 -44.3447 -44.3447 -20.7076 -20.7076 -18.8951 -18.8951 -18.0707 -18.0707 -18.0152 -18.0152 -17.5290 -17.5290 -17.4928 -17.4928 15.4757 15.4757 15.7003 15.7003 17.5985 17.5985 17.7254 17.7254 19.0788 19.0788 19.7376 19.7376 21.1163 21.1163 21.2210 21.2210 22.9158 22.9158 23.0501 23.0501 k = 0.3269 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5503 -46.5503 -44.3443 -44.3443 -20.7109 -20.7109 -18.9016 -18.9016 -18.0747 -18.0747 -18.0174 -18.0174 -17.5237 -17.5237 -17.4896 -17.4896 15.4299 15.4299 15.6804 15.6804 17.5608 17.5608 17.6767 17.6767 19.2121 19.2121 19.8381 19.8381 21.1505 21.1505 21.2603 21.2603 22.8935 22.8935 23.0955 23.0955 k = 0.3365 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5497 -46.5497 -44.3439 -44.3439 -20.7140 -20.7140 -18.9078 -18.9078 -18.0785 -18.0785 -18.0195 -18.0195 -17.5186 -17.5186 -17.4866 -17.4866 15.3862 15.3862 15.6611 15.6611 17.5248 17.5248 17.6305 17.6305 19.3476 19.3476 19.9404 19.9404 21.1835 21.1835 21.2972 21.2972 22.8670 22.8670 23.1150 23.1150 k = 0.3462 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5491 -46.5491 -44.3435 -44.3435 -20.7170 -20.7170 -18.9139 -18.9139 -18.0821 -18.0821 -18.0215 -18.0215 -17.5138 -17.5138 -17.4836 -17.4836 15.3446 15.3446 15.6423 15.6423 17.4906 17.4906 17.5869 17.5869 19.4851 19.4851 20.0441 20.0441 21.2152 21.2152 21.3319 21.3319 22.8363 22.8363 23.0976 23.0976 k = 0.3558 0.5000-0.0000 ( 1432 PWs) bands (ev): -46.5486 -46.5486 -44.3432 -44.3432 -20.7199 -20.7199 -18.9197 -18.9197 -18.0856 -18.0856 -18.0233 -18.0233 -17.5093 -17.5093 -17.4808 -17.4808 15.3053 15.3053 15.6243 15.6243 17.4582 17.4582 17.5458 17.5458 19.6241 19.6241 20.1491 20.1491 21.2455 21.2455 21.3644 21.3644 22.8015 22.8015 23.0610 23.0610 k = 0.3654 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5481 -46.5481 -44.3428 -44.3428 -20.7227 -20.7227 -18.9251 -18.9251 -18.0887 -18.0887 -18.0250 -18.0250 -17.5050 -17.5050 -17.4781 -17.4781 15.2682 15.2682 15.6071 15.6071 17.4275 17.4275 17.5074 17.5074 19.7643 19.7643 20.2551 20.2551 21.2744 21.2744 21.3946 21.3946 22.7624 22.7624 23.0152 23.0152 k = 0.3750 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5476 -46.5476 -44.3425 -44.3425 -20.7253 -20.7253 -18.9303 -18.9303 -18.0917 -18.0917 -18.0265 -18.0265 -17.5011 -17.5011 -17.4755 -17.4755 15.2335 15.2335 15.5908 15.5908 17.3987 17.3987 17.4717 17.4717 19.9054 19.9054 20.3619 20.3619 21.3016 21.3016 21.4226 21.4226 22.7191 22.7191 22.9627 22.9627 k = 0.3846 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5472 -46.5472 -44.3422 -44.3422 -20.7278 -20.7278 -18.9352 -18.9352 -18.0945 -18.0945 -18.0279 -18.0279 -17.4975 -17.4975 -17.4731 -17.4731 15.2012 15.2012 15.5755 15.5755 17.3717 17.3717 17.4387 17.4387 20.0469 20.0469 20.4693 20.4693 21.3272 21.3272 21.4484 21.4484 22.6715 22.6715 22.9043 22.9043 k = 0.3942 0.5000-0.0000 ( 1436 PWs) bands (ev): -46.5468 -46.5468 -44.3419 -44.3419 -20.7302 -20.7302 -18.9399 -18.9399 -18.0972 -18.0972 -18.0292 -18.0292 -17.4943 -17.4943 -17.4709 -17.4709 15.1713 15.1713 15.5611 15.5611 17.3465 17.3465 17.4084 17.4084 20.1885 20.1885 20.5770 20.5770 21.3510 21.3510 21.4720 21.4720 22.6196 22.6196 22.8403 22.8403 k = 0.4038 0.5000-0.0000 ( 1432 PWs) bands (ev): -46.5464 -46.5464 -44.3416 -44.3416 -20.7323 -20.7323 -18.9441 -18.9441 -18.0995 -18.0995 -18.0303 -18.0303 -17.4913 -17.4913 -17.4688 -17.4688 15.1439 15.1439 15.5479 15.5479 17.3234 17.3234 17.3811 17.3811 20.3298 20.3298 20.6847 20.6847 21.3730 21.3730 21.4935 21.4935 22.5637 22.5637 22.7710 22.7710 k = 0.4135 0.5000-0.0000 ( 1432 PWs) bands (ev): -46.5460 -46.5460 -44.3414 -44.3414 -20.7343 -20.7343 -18.9479 -18.9479 -18.1017 -18.1017 -18.0314 -18.0314 -17.4886 -17.4886 -17.4668 -17.4668 15.1190 15.1190 15.5357 15.5357 17.3021 17.3021 17.3564 17.3564 20.4701 20.4701 20.7923 20.7923 21.3932 21.3932 21.5129 21.5129 22.5040 22.5040 22.6964 22.6964 k = 0.4231 0.5000-0.0000 ( 1432 PWs) bands (ev): -46.5457 -46.5457 -44.3412 -44.3412 -20.7361 -20.7361 -18.9514 -18.9514 -18.1036 -18.1036 -18.0323 -18.0323 -17.4863 -17.4863 -17.4651 -17.4651 15.0966 15.0966 15.5247 15.5247 17.2827 17.2827 17.3345 17.3345 20.6089 20.6089 20.8993 20.8993 21.4114 21.4114 21.5302 21.5302 22.4405 22.4405 22.6168 22.6168 k = 0.4327 0.5000-0.0000 ( 1428 PWs) bands (ev): -46.5454 -46.5454 -44.3410 -44.3410 -20.7377 -20.7377 -18.9545 -18.9545 -18.1053 -18.1053 -18.0330 -18.0330 -17.4841 -17.4841 -17.4635 -17.4635 15.0768 15.0768 15.5150 15.5150 17.2654 17.2654 17.3154 17.3154 20.7454 20.7454 21.0055 21.0055 21.4277 21.4277 21.5456 21.5456 22.3738 22.3738 22.5324 22.5324 k = 0.4423 0.5000-0.0000 ( 1434 PWs) bands (ev): -46.5452 -46.5452 -44.3408 -44.3408 -20.7391 -20.7391 -18.9573 -18.9573 -18.1068 -18.1068 -18.0338 -18.0338 -17.4824 -17.4824 -17.4621 -17.4621 15.0596 15.0596 15.5064 15.5064 17.2502 17.2502 17.2990 17.2990 20.8786 20.8786 21.1105 21.1105 21.4419 21.4419 21.5589 21.5589 22.3043 22.3043 22.4436 22.4436 k = 0.4519 0.5000-0.0000 ( 1430 PWs) bands (ev): -46.5449 -46.5449 -44.3407 -44.3407 -20.7403 -20.7403 -18.9596 -18.9596 -18.1080 -18.1080 -18.0344 -18.0344 -17.4808 -17.4808 -17.4609 -17.4609 15.0450 15.0450 15.4991 15.4991 17.2372 17.2372 17.2851 17.2851 21.0071 21.0071 21.2136 21.2136 21.4541 21.4541 21.5706 21.5706 22.2330 22.2330 22.3512 22.3512 k = 0.4615 0.5000-0.0000 ( 1438 PWs) bands (ev): -46.5448 -46.5448 -44.3405 -44.3405 -20.7413 -20.7413 -18.9615 -18.9615 -18.1091 -18.1091 -18.0350 -18.0350 -17.4797 -17.4797 -17.4600 -17.4600 15.0329 15.0329 15.4931 15.4931 17.2263 17.2263 17.2738 17.2738 21.1287 21.1287 21.3138 21.3138 21.4643 21.4643 21.5805 21.5805 22.1612 22.1612 22.2562 22.2562 k = 0.4712 0.5000-0.0000 ( 1446 PWs) bands (ev): -46.5446 -46.5446 -44.3405 -44.3405 -20.7421 -20.7421 -18.9631 -18.9631 -18.1100 -18.1100 -18.0354 -18.0354 -17.4788 -17.4788 -17.4592 -17.4592 15.0236 15.0236 15.4884 15.4884 17.2177 17.2177 17.2650 17.2650 21.2398 21.2398 21.4075 21.4075 21.4741 21.4741 21.5897 21.5897 22.0915 22.0915 22.1607 22.1607 k = 0.4808 0.5000-0.0000 ( 1452 PWs) bands (ev): -46.5445 -46.5445 -44.3404 -44.3404 -20.7427 -20.7427 -18.9643 -18.9643 -18.1106 -18.1106 -18.0357 -18.0357 -17.4782 -17.4782 -17.4587 -17.4587 15.0169 15.0169 15.4850 15.4850 17.2116 17.2116 17.2588 17.2588 21.3345 21.3345 21.4646 21.4646 21.5070 21.5070 21.6011 21.6011 22.0288 22.0288 22.0691 22.0691 k = 0.4904 0.5000-0.0000 ( 1452 PWs) bands (ev): -46.5445 -46.5445 -44.3403 -44.3403 -20.7430 -20.7430 -18.9649 -18.9649 -18.1110 -18.1110 -18.0359 -18.0359 -17.4778 -17.4778 -17.4584 -17.4584 15.0129 15.0129 15.4830 15.4830 17.2080 17.2080 17.2551 17.2551 21.4037 21.4037 21.4700 21.4700 21.5563 21.5563 21.6255 21.6255 21.9818 21.9818 21.9932 21.9932 k = 0.5000 0.5000-0.0000 ( 1452 PWs) bands (ev): -46.5445 -46.5445 -44.3403 -44.3403 -20.7431 -20.7431 -18.9651 -18.9651 -18.1111 -18.1111 -18.0359 -18.0359 -17.4776 -17.4776 -17.4583 -17.4583 15.0116 15.0116 15.4824 15.4824 17.2068 17.2068 17.2539 17.2539 21.4325 21.4325 21.4674 21.4674 21.5688 21.5688 21.6467 21.6467 21.9579 21.9579 21.9655 21.9655 k = 0.5000 0.5000-0.0000 ( 1452 PWs) bands (ev): -46.5445 -46.5445 -44.3403 -44.3403 -20.7431 -20.7431 -18.9651 -18.9651 -18.1111 -18.1111 -18.0359 -18.0359 -17.4776 -17.4776 -17.4583 -17.4583 15.0116 15.0116 15.4824 15.4824 17.2068 17.2068 17.2539 17.2539 21.4325 21.4325 21.4674 21.4674 21.5688 21.5688 21.6467 21.6467 21.9579 21.9579 21.9655 21.9655 k = 0.4932 0.4932-0.0000 ( 1452 PWs) bands (ev): -46.5445 -46.5445 -44.3403 -44.3403 -20.7430 -20.7430 -18.9649 -18.9649 -18.1110 -18.1110 -18.0359 -18.0359 -17.4778 -17.4778 -17.4584 -17.4584 15.0129 15.0129 15.4830 15.4830 17.2080 17.2080 17.2551 17.2551 21.4037 21.4037 21.4687 21.4687 21.5572 21.5572 21.6286 21.6286 21.9620 21.9620 22.0103 22.0103 k = 0.4865 0.4865-0.0000 ( 1452 PWs) bands (ev): -46.5445 -46.5445 -44.3404 -44.3404 -20.7427 -20.7427 -18.9643 -18.9643 -18.1107 -18.1107 -18.0357 -18.0357 -17.4782 -17.4782 -17.4587 -17.4587 15.0168 15.0168 15.4850 15.4850 17.2115 17.2115 17.2588 17.2588 21.3293 21.3293 21.4544 21.4544 21.5263 21.5263 21.6154 21.6154 21.9612 21.9612 22.1190 22.1190 k = 0.4797 0.4797-0.0000 ( 1450 PWs) bands (ev): -46.5446 -46.5446 -44.3405 -44.3405 -20.7421 -20.7421 -18.9632 -18.9632 -18.1101 -18.1101 -18.0354 -18.0354 -17.4789 -17.4789 -17.4592 -17.4592 15.0234 15.0234 15.4884 15.4884 17.2172 17.2172 17.2652 17.2652 21.2211 21.2211 21.4175 21.4175 21.5021 21.5021 21.6146 21.6146 21.9597 21.9597 22.2496 22.2496 k = 0.4730 0.4730-0.0000 ( 1438 PWs) bands (ev): -46.5448 -46.5448 -44.3405 -44.3405 -20.7413 -20.7413 -18.9616 -18.9616 -18.1092 -18.1092 -18.0349 -18.0349 -17.4799 -17.4799 -17.4596 -17.4596 15.0325 15.0325 15.4930 15.4930 17.2247 17.2247 17.2749 17.2749 21.0953 21.0953 21.3672 21.3672 21.4826 21.4826 21.6159 21.6159 21.9574 21.9574 22.3894 22.3894 k = 0.4662 0.4662-0.0000 ( 1432 PWs) bands (ev): -46.5449 -46.5449 -44.3407 -44.3407 -20.7403 -20.7403 -18.9596 -18.9596 -18.1083 -18.1083 -18.0343 -18.0343 -17.4816 -17.4816 -17.4600 -17.4600 15.0440 15.0440 15.4990 15.4990 17.2336 17.2336 17.2878 17.2878 20.9617 20.9617 21.3084 21.3084 21.4613 21.4613 21.6163 21.6163 21.9545 21.9545 22.5336 22.5336 k = 0.4595 0.4595-0.0000 ( 1438 PWs) bands (ev): -46.5452 -46.5452 -44.3408 -44.3408 -20.7392 -20.7392 -18.9574 -18.9574 -18.1073 -18.1073 -18.0335 -18.0335 -17.4839 -17.4839 -17.4605 -17.4605 15.0579 15.0579 15.5062 15.5062 17.2435 17.2435 17.3043 17.3043 20.8247 20.8247 21.2419 21.2419 21.4362 21.4362 21.6148 21.6148 21.9507 21.9507 22.6803 22.6803 k = 0.4527 0.4527-0.0000 ( 1428 PWs) bands (ev): -46.5454 -46.5454 -44.3410 -44.3410 -20.7377 -20.7377 -18.9546 -18.9546 -18.1061 -18.1061 -18.0324 -18.0324 -17.4867 -17.4867 -17.4606 -17.4606 15.0741 15.0741 15.5148 15.5148 17.2545 17.2545 17.3248 17.3248 20.6862 20.6862 21.1680 21.1680 21.4076 21.4076 21.6113 21.6113 21.9462 21.9462 22.8289 22.8289 k = 0.4459 0.4459-0.0000 ( 1430 PWs) bands (ev): -46.5457 -46.5457 -44.3412 -44.3412 -20.7362 -20.7362 -18.9515 -18.9515 -18.1049 -18.1049 -18.0311 -18.0311 -17.4903 -17.4903 -17.4606 -17.4606 15.0922 15.0922 15.5246 15.5246 17.2663 17.2663 17.3489 17.3489 20.5473 20.5473 21.0872 21.0872 21.3753 21.3753 21.6059 21.6059 21.9409 21.9409 22.9784 22.9784 k = 0.4392 0.4392-0.0000 ( 1426 PWs) bands (ev): -46.5460 -46.5460 -44.3414 -44.3414 -20.7344 -20.7344 -18.9480 -18.9480 -18.1038 -18.1038 -18.0293 -18.0293 -17.4945 -17.4945 -17.4603 -17.4603 15.1123 15.1123 15.5358 15.5358 17.2791 17.2791 17.3769 17.3769 20.4084 20.4084 20.9999 20.9999 21.3395 21.3395 21.5988 21.5988 21.9350 21.9350 23.1284 23.1284 k = 0.4324 0.4324-0.0000 ( 1426 PWs) bands (ev): -46.5464 -46.5464 -44.3416 -44.3416 -20.7324 -20.7324 -18.9441 -18.9441 -18.1027 -18.1027 -18.0273 -18.0273 -17.4993 -17.4993 -17.4599 -17.4599 15.1339 15.1339 15.5484 15.5484 17.2929 17.2929 17.4086 17.4086 20.2699 20.2699 20.9066 20.9066 21.3006 21.3006 21.5900 21.5900 21.9285 21.9285 23.2776 23.2776 k = 0.4257 0.4257-0.0000 ( 1426 PWs) bands (ev): -46.5468 -46.5468 -44.3419 -44.3419 -20.7303 -20.7303 -18.9399 -18.9399 -18.1018 -18.1018 -18.0248 -18.0248 -17.5047 -17.5047 -17.4593 -17.4593 15.1569 15.1569 15.5623 15.5623 17.3077 17.3077 17.4439 17.4439 20.1322 20.1322 20.8081 20.8081 21.2588 21.2588 21.5797 21.5797 21.9212 21.9212 23.3335 23.3335 k = 0.4189 0.4189-0.0000 ( 1426 PWs) bands (ev): -46.5473 -46.5473 -44.3421 -44.3421 -20.7281 -20.7281 -18.9353 -18.9353 -18.1010 -18.1010 -18.0217 -18.0217 -17.5106 -17.5106 -17.4585 -17.4585 15.1808 15.1808 15.5777 15.5777 17.3237 17.3237 17.4827 17.4827 19.9953 19.9953 20.7049 20.7049 21.2146 21.2146 21.5681 21.5681 21.9134 21.9134 23.2738 23.2738 k = 0.4122 0.4122-0.0000 ( 1432 PWs) bands (ev): -46.5477 -46.5477 -44.3424 -44.3424 -20.7257 -20.7257 -18.9305 -18.9305 -18.1005 -18.1005 -18.0182 -18.0182 -17.5171 -17.5171 -17.4577 -17.4577 15.2053 15.2053 15.5946 15.5946 17.3407 17.3407 17.5249 17.5249 19.8593 19.8593 20.5978 20.5978 21.1681 21.1681 21.5550 21.5550 21.9050 21.9050 23.2087 23.2087 k = 0.4054 0.4054-0.0000 ( 1432 PWs) bands (ev): -46.5483 -46.5483 -44.3427 -44.3427 -20.7231 -20.7231 -18.9252 -18.9252 -18.1002 -18.1002 -18.0141 -18.0141 -17.5241 -17.5241 -17.4566 -17.4566 15.2298 15.2298 15.6132 15.6132 17.3589 17.3589 17.5705 17.5705 19.7244 19.7244 20.4875 20.4875 21.1202 21.1202 21.5410 21.5410 21.8961 21.8961 23.1396 23.1396 k = 0.3986 0.3986-0.0000 ( 1432 PWs) bands (ev): -46.5488 -46.5488 -44.3431 -44.3431 -20.7204 -20.7204 -18.9197 -18.9197 -18.1001 -18.1001 -18.0094 -18.0094 -17.5314 -17.5314 -17.4554 -17.4554 15.2539 15.2539 15.6337 15.6337 17.3782 17.3782 17.6194 17.6194 19.5907 19.5907 20.3748 20.3748 21.0710 21.0710 21.5259 21.5259 21.8868 21.8868 23.0668 23.0668 k = 0.3919 0.3919-0.0000 ( 1432 PWs) bands (ev): -46.5494 -46.5494 -44.3434 -44.3434 -20.7175 -20.7175 -18.9138 -18.9138 -18.1003 -18.1003 -18.0042 -18.0042 -17.5392 -17.5392 -17.4541 -17.4541 15.2770 15.2770 15.6560 15.6560 17.3987 17.3987 17.6716 17.6716 19.4582 19.4582 20.2603 20.2603 21.0211 21.0211 21.5099 21.5099 21.8770 21.8770 22.9906 22.9906 k = 0.3851 0.3851-0.0000 ( 1428 PWs) bands (ev): -46.5501 -46.5501 -44.3437 -44.3437 -20.7146 -20.7146 -18.9077 -18.9077 -18.1008 -18.1008 -17.9983 -17.9983 -17.5474 -17.5474 -17.4526 -17.4526 15.2984 15.2984 15.6805 15.6805 17.4204 17.4204 17.7271 17.7271 19.3270 19.3270 20.1448 20.1448 20.9708 20.9708 21.4931 21.4931 21.8670 21.8670 22.9116 22.9116 k = 0.3784 0.3784-0.0000 ( 1428 PWs) bands (ev): -46.5507 -46.5507 -44.3441 -44.3441 -20.7115 -20.7115 -18.9013 -18.9013 -18.1014 -18.1014 -17.9920 -17.9920 -17.5559 -17.5559 -17.4511 -17.4511 15.3177 15.3177 15.7071 15.7071 17.4431 17.4431 17.7856 17.7856 19.1972 19.1972 20.0290 20.0290 20.9206 20.9206 21.4755 21.4755 21.8565 21.8565 22.8296 22.8296 k = 0.3716 0.3716-0.0000 ( 1424 PWs) bands (ev): -46.5515 -46.5515 -44.3444 -44.3444 -20.7084 -20.7084 -18.8945 -18.8945 -18.1023 -18.1023 -17.9851 -17.9851 -17.5647 -17.5647 -17.4494 -17.4494 15.3342 15.3342 15.7359 15.7359 17.4669 17.4669 17.8473 17.8473 19.0688 19.0688 19.9136 19.9136 20.8712 20.8712 21.4573 21.4573 21.8458 21.8458 22.7452 22.7452 k = 0.3649 0.3649-0.0000 ( 1428 PWs) bands (ev): -46.5522 -46.5522 -44.3448 -44.3448 -20.7052 -20.7052 -18.8878 -18.8878 -18.1034 -18.1034 -17.9779 -17.9779 -17.5737 -17.5737 -17.4477 -17.4477 15.3473 15.3473 15.7667 15.7667 17.4917 17.4917 17.9121 17.9121 18.9419 18.9419 19.7992 19.7992 20.8227 20.8227 21.4385 21.4385 21.8348 21.8348 22.6584 22.6584 k = 0.3581 0.3581-0.0000 ( 1428 PWs) bands (ev): -46.5530 -46.5530 -44.3452 -44.3452 -20.7019 -20.7019 -18.8807 -18.8807 -18.1046 -18.1046 -17.9703 -17.9703 -17.5830 -17.5830 -17.4458 -17.4458 15.3567 15.3567 15.7993 15.7993 17.5176 17.5176 17.9798 17.9798 18.8166 18.8166 19.6868 19.6868 20.7759 20.7759 21.4192 21.4192 21.8236 21.8236 22.5697 22.5697 k = 0.3514 0.3514-0.0000 ( 1424 PWs) bands (ev): -46.5538 -46.5538 -44.3456 -44.3456 -20.6986 -20.6986 -18.8734 -18.8734 -18.1059 -18.1059 -17.9622 -17.9622 -17.5924 -17.5924 -17.4438 -17.4438 15.3623 15.3623 15.8333 15.8333 17.5447 17.5447 18.0505 18.0505 18.6928 18.6928 19.5769 19.5769 20.7312 20.7312 21.3996 21.3996 21.8122 21.8122 22.4793 22.4793 k = 0.3446 0.3446-0.0000 ( 1428 PWs) bands (ev): -46.5547 -46.5547 -44.3459 -44.3459 -20.6953 -20.6953 -18.8660 -18.8660 -18.1074 -18.1074 -17.9540 -17.9540 -17.6020 -17.6020 -17.4417 -17.4417 15.3635 15.3635 15.8684 15.8684 17.5726 17.5726 18.1237 18.1237 18.5708 18.5708 19.4702 19.4702 20.6890 20.6890 21.3797 21.3797 21.8006 21.8006 22.3875 22.3875 k = 0.3378 0.3378-0.0000 ( 1428 PWs) bands (ev): -46.5556 -46.5556 -44.3463 -44.3463 -20.6919 -20.6919 -18.8584 -18.8584 -18.1090 -18.1090 -17.9455 -17.9455 -17.6115 -17.6115 -17.4396 -17.4396 15.3601 15.3601 15.9039 15.9039 17.6014 17.6014 18.1996 18.1996 18.4507 18.4507 19.3675 19.3675 20.6499 20.6499 21.3596 21.3596 21.7889 21.7889 22.2946 22.2946 k = 0.3311 0.3311-0.0000 ( 1424 PWs) bands (ev): -46.5565 -46.5565 -44.3467 -44.3467 -20.6885 -20.6885 -18.8506 -18.8506 -18.1106 -18.1106 -17.9368 -17.9368 -17.6209 -17.6209 -17.4373 -17.4373 15.3521 15.3521 15.9393 15.9393 17.6311 17.6311 18.2749 18.2749 18.3357 18.3357 19.2693 19.2693 20.6144 20.6144 21.3394 21.3394 21.7773 21.7773 22.2009 22.2009 k = 0.3243 0.3243-0.0000 ( 1428 PWs) bands (ev): -46.5574 -46.5574 -44.3470 -44.3470 -20.6851 -20.6851 -18.8429 -18.8429 -18.1123 -18.1123 -17.9283 -17.9283 -17.6302 -17.6302 -17.4350 -17.4350 15.3391 15.3391 15.9740 15.9740 17.6616 17.6616 18.2120 18.2120 18.3633 18.3633 19.1765 19.1765 20.5829 20.5829 21.3191 21.3191 21.7652 21.7652 22.1066 22.1066 k = 0.3176 0.3176-0.0000 ( 1428 PWs) bands (ev): -46.5584 -46.5584 -44.3474 -44.3474 -20.6818 -20.6818 -18.8350 -18.8350 -18.1140 -18.1140 -17.9198 -17.9198 -17.6392 -17.6392 -17.4326 -17.4326 15.3211 15.3211 16.0073 16.0073 17.6928 17.6928 18.0979 18.0979 18.4463 18.4463 19.0897 19.0897 20.5559 20.5559 21.2991 21.2991 21.7526 21.7526 22.0124 22.0124 k = 0.3108 0.3108-0.0000 ( 1420 PWs) bands (ev): -46.5594 -46.5594 -44.3477 -44.3477 -20.6783 -20.6783 -18.8269 -18.8269 -18.1156 -18.1156 -17.9115 -17.9115 -17.6476 -17.6476 -17.4301 -17.4301 15.2980 15.2980 16.0387 16.0387 17.7244 17.7244 17.9854 17.9854 18.5323 18.5323 19.0097 19.0097 20.5338 20.5338 21.2792 21.2792 21.7390 21.7390 21.9192 21.9192 k = 0.3041 0.3041-0.0000 ( 1428 PWs) bands (ev): -46.5604 -46.5604 -44.3481 -44.3481 -20.6751 -20.6751 -18.8190 -18.8190 -18.1175 -18.1175 -17.9037 -17.9037 -17.6556 -17.6556 -17.4276 -17.4276 15.2695 15.2695 16.0676 16.0676 17.7552 17.7552 17.8759 17.8759 18.6195 18.6195 18.9375 18.9375 20.5170 20.5170 21.2597 21.2597 21.7217 21.7217 21.8298 21.8298 k = 0.2973 0.2973-0.0000 ( 1428 PWs) bands (ev): -46.5615 -46.5615 -44.3484 -44.3484 -20.6718 -20.6718 -18.8110 -18.8110 -18.1192 -18.1192 -17.8964 -17.8964 -17.6626 -17.6626 -17.4250 -17.4250 15.2357 15.2357 16.0933 16.0933 17.7507 17.7507 17.8044 17.8044 18.7059 18.7059 18.8761 18.8761 20.5058 20.5058 21.2406 21.2406 21.6865 21.6865 21.7588 21.7588 k = 0.2905 0.2905-0.0000 ( 1420 PWs) bands (ev): -46.5626 -46.5626 -44.3487 -44.3487 -20.6685 -20.6685 -18.8029 -18.8029 -18.1208 -18.1208 -17.8900 -17.8900 -17.6685 -17.6685 -17.4222 -17.4222 15.1967 15.1967 16.1155 16.1155 17.6514 17.6514 17.8302 17.8302 18.7667 18.7667 18.8501 18.8501 20.5006 20.5006 21.2221 21.2221 21.6131 21.6131 21.7269 21.7269 k = 0.2838 0.2838-0.0000 ( 1420 PWs) bands (ev): -46.5637 -46.5637 -44.3491 -44.3491 -20.6653 -20.6653 -18.7949 -18.7949 -18.1224 -18.1224 -17.8848 -17.8848 -17.6731 -17.6731 -17.4195 -17.4195 15.1524 15.1524 16.1335 16.1335 17.5466 17.5466 17.8640 17.8640 18.7443 18.7443 18.9171 18.9171 20.5016 20.5016 21.2041 21.2041 21.5249 21.5249 21.7108 21.7108 k = 0.2770 0.2770-0.0000 ( 1420 PWs) bands (ev): -46.5648 -46.5648 -44.3494 -44.3494 -20.6623 -20.6623 -18.7869 -18.7869 -18.1240 -18.1240 -17.8810 -17.8810 -17.6760 -17.6760 -17.4167 -17.4167 15.1030 15.1030 16.1471 16.1471 17.4431 17.4431 17.8991 17.8991 18.7061 18.7061 19.0099 19.0099 20.5091 20.5091 21.1867 21.1867 21.4345 21.4345 21.6982 21.6982 k = 0.2703 0.2703-0.0000 ( 1416 PWs) bands (ev): -46.5660 -46.5660 -44.3496 -44.3496 -20.6592 -20.6592 -18.7789 -18.7789 -18.1256 -18.1256 -17.8789 -17.8789 -17.6771 -17.6771 -17.4137 -17.4137 15.0488 15.0488 16.1560 16.1560 17.3413 17.3413 17.9350 17.9350 18.6728 18.6728 19.1072 19.1072 20.5231 20.5231 21.1697 21.1697 21.3450 21.3450 21.6872 21.6872 k = 0.2635 0.2635-0.0000 ( 1422 PWs) bands (ev): -46.5672 -46.5672 -44.3499 -44.3499 -20.6563 -20.6563 -18.7712 -18.7712 -18.1271 -18.1271 -17.8786 -17.8786 -17.6761 -17.6761 -17.4109 -17.4109 14.9899 14.9899 16.1600 16.1600 17.2414 17.2414 17.9712 17.9712 18.6465 18.6465 19.2065 19.2065 20.5437 20.5437 21.1523 21.1523 21.2581 21.2581 21.6765 21.6765 k = 0.2568 0.2568-0.0000 ( 1422 PWs) bands (ev): -46.5683 -46.5683 -44.3502 -44.3502 -20.6535 -20.6535 -18.7634 -18.7634 -18.1285 -18.1285 -17.8802 -17.8802 -17.6731 -17.6731 -17.4079 -17.4079 14.9267 14.9267 16.1591 16.1591 17.1436 17.1436 18.0080 18.0080 18.6272 18.6272 19.3071 19.3071 20.5711 20.5711 21.1281 21.1281 21.1812 21.1812 21.6666 21.6666 k = 0.2500 0.2500-0.0000 ( 1422 PWs) bands (ev): -46.5695 -46.5695 -44.3504 -44.3504 -20.6507 -20.6507 -18.7558 -18.7558 -18.1298 -18.1298 -17.8835 -17.8835 -17.6681 -17.6681 -17.4049 -17.4049 14.8596 14.8596 16.1533 16.1533 17.0479 17.0479 18.0451 18.0451 18.6148 18.6148 19.4081 19.4081 20.6051 20.6051 21.0702 21.0702 21.1420 21.1420 21.6571 21.6571 k = 0.2432 0.2432-0.0000 ( 1422 PWs) bands (ev): -46.5707 -46.5707 -44.3506 -44.3506 -20.6481 -20.6481 -18.7483 -18.7483 -18.1310 -18.1310 -17.8883 -17.8883 -17.6614 -17.6614 -17.4019 -17.4019 14.7891 14.7891 16.1428 16.1428 16.9542 16.9542 18.0824 18.0824 18.6087 18.6087 19.5088 19.5088 20.6456 20.6456 20.9939 20.9939 21.1261 21.1261 21.6481 21.6481 k = 0.2365 0.2365-0.0000 ( 1420 PWs) bands (ev): -46.5720 -46.5720 -44.3508 -44.3508 -20.6456 -20.6456 -18.7409 -18.7409 -18.1321 -18.1321 -17.8945 -17.8945 -17.6531 -17.6531 -17.3988 -17.3988 14.7155 14.7155 16.1279 16.1279 16.8628 16.8628 18.1200 18.1200 18.6085 18.6085 19.6080 19.6080 20.6926 20.6926 20.9190 20.9190 21.1151 21.1151 21.6394 21.6394 k = 0.2297 0.2297-0.0000 ( 1420 PWs) bands (ev): -46.5732 -46.5732 -44.3510 -44.3510 -20.6432 -20.6432 -18.7337 -18.7337 -18.1331 -18.1331 -17.9018 -17.9018 -17.6435 -17.6435 -17.3957 -17.3957 14.6393 14.6393 16.1089 16.1089 16.7735 16.7735 18.1577 18.1577 18.6133 18.6133 19.7038 19.7038 20.7453 20.7453 20.8499 20.8499 21.1066 21.1066 21.6312 21.6312 k = 0.2230 0.2230-0.0000 ( 1420 PWs) bands (ev): -46.5744 -46.5744 -44.3512 -44.3512 -20.6408 -20.6408 -18.7267 -18.7267 -18.1340 -18.1340 -17.9100 -17.9100 -17.6328 -17.6328 -17.3926 -17.3926 14.5610 14.5610 16.0862 16.0862 16.6864 16.6864 18.1954 18.1954 18.6225 18.6225 19.7939 19.7939 20.7844 20.7844 20.8089 20.8089 21.1002 21.1002 21.6233 21.6233 k = 0.2162 0.2162-0.0000 ( 1420 PWs) bands (ev): -46.5757 -46.5757 -44.3513 -44.3513 -20.6387 -20.6387 -18.7198 -18.7198 -18.1348 -18.1348 -17.9188 -17.9188 -17.6213 -17.6213 -17.3894 -17.3894 14.4810 14.4810 16.0602 16.0602 16.6016 16.6016 18.2331 18.2331 18.6354 18.6354 19.8740 19.8740 20.7396 20.7396 20.8702 20.8702 21.0959 21.0959 21.6159 21.6159 k = 0.2095 0.2095-0.0000 ( 1416 PWs) bands (ev): -46.5769 -46.5769 -44.3514 -44.3514 -20.6366 -20.6366 -18.7131 -18.7131 -18.1354 -18.1354 -17.9280 -17.9280 -17.6092 -17.6092 -17.3863 -17.3863 14.3998 14.3998 16.0313 16.0313 16.5190 16.5190 18.2708 18.2708 18.6514 18.6514 19.9384 19.9384 20.7105 20.7105 20.9398 20.9398 21.0938 21.0938 21.6088 21.6088 k = 0.2027 0.2027-0.0000 ( 1422 PWs) bands (ev): -46.5781 -46.5781 -44.3516 -44.3516 -20.6347 -20.6347 -18.7066 -18.7066 -18.1361 -18.1361 -17.9378 -17.9378 -17.5965 -17.5965 -17.3832 -17.3832 14.3178 14.3178 15.9999 15.9999 16.4387 16.4387 18.3082 18.3082 18.6696 18.6696 19.9805 19.9805 20.7064 20.7064 21.0129 21.0129 21.0947 21.0947 21.6022 21.6022 k = 0.1959 0.1959-0.0000 ( 1426 PWs) bands (ev): -46.5794 -46.5794 -44.3517 -44.3517 -20.6329 -20.6329 -18.7004 -18.7004 -18.1366 -18.1366 -17.9478 -17.9478 -17.5835 -17.5835 -17.3801 -17.3801 14.2354 14.2354 15.9665 15.9665 16.3608 16.3608 18.3454 18.3454 18.6896 18.6896 19.9960 19.9960 20.7318 20.7318 21.0794 21.0794 21.1091 21.1091 21.5958 21.5958 k = 0.1892 0.1892-0.0000 ( 1426 PWs) bands (ev): -46.5806 -46.5806 -44.3517 -44.3517 -20.6311 -20.6311 -18.6943 -18.6943 -18.1369 -18.1369 -17.9578 -17.9578 -17.5702 -17.5702 -17.3770 -17.3770 14.1530 14.1530 15.9315 15.9315 16.2853 16.2853 18.3824 18.3824 18.7108 18.7108 19.9864 19.9864 20.7852 20.7852 21.0947 21.0947 21.1808 21.1808 21.5900 21.5900 k = 0.1824 0.1824-0.0000 ( 1418 PWs) bands (ev): -46.5818 -46.5818 -44.3518 -44.3518 -20.6295 -20.6295 -18.6884 -18.6884 -18.1371 -18.1371 -17.9678 -17.9678 -17.5568 -17.5568 -17.3739 -17.3739 14.0710 14.0710 15.8952 15.8952 16.2123 16.2123 18.4189 18.4189 18.7327 18.7327 19.9576 19.9576 20.8607 20.8607 21.1019 21.1019 21.2663 21.2663 21.5848 21.5848 k = 0.1757 0.1757-0.0000 ( 1418 PWs) bands (ev): -46.5830 -46.5830 -44.3519 -44.3519 -20.6280 -20.6280 -18.6828 -18.6828 -18.1373 -18.1373 -17.9778 -17.9778 -17.5433 -17.5433 -17.3709 -17.3709 13.9897 13.9897 15.8579 15.8579 16.1415 16.1415 18.4550 18.4550 18.7548 18.7548 19.9161 19.9161 20.9513 20.9513 21.1104 21.1104 21.3554 21.3554 21.5802 21.5802 k = 0.1689 0.1689-0.0000 ( 1418 PWs) bands (ev): -46.5841 -46.5841 -44.3519 -44.3519 -20.6266 -20.6266 -18.6774 -18.6774 -18.1373 -18.1373 -17.9878 -17.9878 -17.5297 -17.5297 -17.3678 -17.3678 13.9094 13.9094 15.8200 15.8200 16.0732 16.0732 18.4906 18.4906 18.7768 18.7768 19.8672 19.8672 21.0513 21.0513 21.1214 21.1214 21.4463 21.4463 21.5771 21.5771 k = 0.1622 0.1622-0.0000 ( 1418 PWs) bands (ev): -46.5853 -46.5853 -44.3519 -44.3519 -20.6254 -20.6254 -18.6722 -18.6722 -18.1373 -18.1373 -17.9976 -17.9976 -17.5163 -17.5163 -17.3649 -17.3649 13.8304 13.8304 15.7817 15.7817 16.0074 16.0074 18.5255 18.5255 18.7984 18.7984 19.8142 19.8142 21.1293 21.1293 21.1627 21.1627 21.5313 21.5313 21.5826 21.5826 k = 0.1554 0.1554-0.0000 ( 1416 PWs) bands (ev): -46.5864 -46.5864 -44.3519 -44.3519 -20.6242 -20.6242 -18.6672 -18.6672 -18.1373 -18.1373 -18.0073 -18.0073 -17.5029 -17.5029 -17.3619 -17.3619 13.7530 13.7530 15.7434 15.7434 15.9441 15.9441 18.5597 18.5597 18.8194 18.8194 19.7593 19.7593 21.1454 21.1454 21.2719 21.2719 21.5582 21.5582 21.6483 21.6483 k = 0.1486 0.1486-0.0000 ( 1420 PWs) bands (ev): -46.5875 -46.5875 -44.3519 -44.3519 -20.6232 -20.6232 -18.6625 -18.6625 -18.1371 -18.1371 -18.0168 -18.0168 -17.4898 -17.4898 -17.3591 -17.3591 13.6774 13.6774 15.7053 15.7053 15.8833 15.8833 18.5931 18.5931 18.8392 18.8392 19.7039 19.7039 21.1614 21.1614 21.3851 21.3851 21.5581 21.5581 21.7427 21.7427 k = 0.1419 0.1419-0.0000 ( 1420 PWs) bands (ev): -46.5886 -46.5886 -44.3519 -44.3519 -20.6222 -20.6222 -18.6580 -18.6580 -18.1369 -18.1369 -18.0260 -18.0260 -17.4768 -17.4768 -17.3563 -17.3563 13.6039 13.6039 15.6677 15.6677 15.8250 15.8250 18.6257 18.6257 18.8582 18.8582 19.6489 19.6489 21.1789 21.1789 21.4973 21.4973 21.5588 21.5588 21.8402 21.8402 k = 0.1351 0.1351-0.0000 ( 1416 PWs) bands (ev): -46.5897 -46.5897 -44.3519 -44.3519 -20.6213 -20.6213 -18.6537 -18.6537 -18.1365 -18.1365 -18.0349 -18.0349 -17.4642 -17.4642 -17.3536 -17.3536 13.5326 13.5326 15.6307 15.6307 15.7694 15.7694 18.6573 18.6573 18.8760 18.8760 19.5949 19.5949 21.1978 21.1978 21.5470 21.5470 21.6225 21.6225 21.9385 21.9385 k = 0.1284 0.1284-0.0000 ( 1416 PWs) bands (ev): -46.5907 -46.5907 -44.3519 -44.3519 -20.6205 -20.6205 -18.6497 -18.6497 -18.1362 -18.1362 -18.0436 -18.0436 -17.4519 -17.4519 -17.3509 -17.3509 13.4638 13.4638 15.5944 15.5944 15.7163 15.7163 18.6878 18.6878 18.8926 18.8926 19.5425 19.5425 21.2179 21.2179 21.5466 21.5466 21.7362 21.7362 22.0365 22.0365 k = 0.1216 0.1216-0.0000 ( 1416 PWs) bands (ev): -46.5917 -46.5917 -44.3519 -44.3519 -20.6198 -20.6198 -18.6459 -18.6459 -18.1358 -18.1358 -18.0519 -18.0519 -17.4399 -17.4399 -17.3484 -17.3484 13.3975 13.3975 15.5592 15.5592 15.6657 15.6657 18.7172 18.7172 18.9079 18.9079 19.4919 19.4919 21.2390 21.2390 21.5446 21.5446 21.8511 21.8511 22.1338 22.1338 k = 0.1149 0.1149-0.0000 ( 1412 PWs) bands (ev): -46.5926 -46.5926 -44.3518 -44.3518 -20.6192 -20.6192 -18.6423 -18.6423 -18.1354 -18.1354 -18.0599 -18.0599 -17.4283 -17.4283 -17.3459 -17.3459 13.3341 13.3341 15.5251 15.5251 15.6178 15.6178 18.7455 18.7455 18.9219 18.9219 19.4436 19.4436 21.2610 21.2610 21.5424 21.5424 21.9651 21.9651 22.2298 22.2298 k = 0.1081 0.1081-0.0000 ( 1410 PWs) bands (ev): -46.5935 -46.5935 -44.3518 -44.3518 -20.6186 -20.6186 -18.6389 -18.6389 -18.1349 -18.1349 -18.0675 -18.0675 -17.4172 -17.4172 -17.3435 -17.3435 13.2736 13.2736 15.4924 15.4924 15.5726 15.5726 18.7724 18.7724 18.9346 18.9346 19.3974 19.3974 21.2835 21.2835 21.5403 21.5403 22.0773 22.0773 22.3240 22.3240 k = 0.1014 0.1014-0.0000 ( 1410 PWs) bands (ev): -46.5944 -46.5944 -44.3517 -44.3517 -20.6181 -20.6181 -18.6358 -18.6358 -18.1344 -18.1344 -18.0747 -18.0747 -17.4066 -17.4066 -17.3413 -17.3413 13.2162 13.2162 15.4610 15.4610 15.5300 15.5300 18.7978 18.7978 18.9461 18.9461 19.3538 19.3538 21.3064 21.3064 21.5383 21.5383 22.1871 22.1871 22.4158 22.4158 k = 0.0946 0.0946-0.0000 ( 1408 PWs) bands (ev): -46.5952 -46.5952 -44.3517 -44.3517 -20.6177 -20.6177 -18.6328 -18.6328 -18.1340 -18.1340 -18.0815 -18.0815 -17.3965 -17.3965 -17.3391 -17.3391 13.1619 13.1619 15.4312 15.4312 15.4900 15.4900 18.8217 18.8217 18.9564 18.9564 19.3128 19.3128 21.3293 21.3293 21.5367 21.5367 22.2940 22.2940 22.5046 22.5046 k = 0.0878 0.0878-0.0000 ( 1404 PWs) bands (ev): -46.5960 -46.5960 -44.3516 -44.3516 -20.6173 -20.6173 -18.6301 -18.6301 -18.1334 -18.1334 -18.0879 -18.0879 -17.3869 -17.3869 -17.3371 -17.3371 13.1109 13.1109 15.4031 15.4031 15.4528 15.4528 18.8441 18.8441 18.9654 18.9654 19.2747 19.2747 21.3520 21.3520 21.5351 21.5351 22.3973 22.3973 22.5901 22.5901 k = 0.0811 0.0811-0.0000 ( 1396 PWs) bands (ev): -46.5967 -46.5967 -44.3516 -44.3516 -20.6170 -20.6170 -18.6275 -18.6275 -18.1329 -18.1329 -18.0939 -18.0939 -17.3778 -17.3778 -17.3351 -17.3351 13.0634 13.0634 15.3767 15.3767 15.4182 15.4182 18.8647 18.8647 18.9734 18.9734 19.2398 19.2398 21.3743 21.3743 21.5339 21.5339 22.4965 22.4965 22.6716 22.6716 k = 0.0743 0.0743-0.0000 ( 1396 PWs) bands (ev): -46.5974 -46.5974 -44.3515 -44.3515 -20.6167 -20.6167 -18.6253 -18.6253 -18.1324 -18.1324 -18.0995 -18.0995 -17.3695 -17.3695 -17.3333 -17.3333 13.0193 13.0193 15.3521 15.3521 15.3864 15.3864 18.8836 18.8836 18.9800 18.9800 19.2080 19.2080 21.3958 21.3958 21.5326 21.5326 22.5908 22.5908 22.7486 22.7486 k = 0.0676 0.0676-0.0000 ( 1390 PWs) bands (ev): -46.5980 -46.5980 -44.3515 -44.3515 -20.6165 -20.6165 -18.6231 -18.6231 -18.1319 -18.1319 -18.1046 -18.1046 -17.3617 -17.3617 -17.3317 -17.3317 12.9788 12.9788 15.3294 15.3294 15.3573 15.3573 18.9006 18.9006 18.9855 18.9855 19.1797 19.1797 21.4164 21.4164 21.5316 21.5316 22.6795 22.6795 22.8207 22.8207 k = 0.0608 0.0608-0.0000 ( 1386 PWs) bands (ev): -46.5986 -46.5986 -44.3514 -44.3514 -20.6163 -20.6163 -18.6212 -18.6212 -18.1315 -18.1315 -18.1092 -18.1092 -17.3545 -17.3545 -17.3301 -17.3301 12.9419 12.9419 15.3086 15.3086 15.3309 15.3309 18.9156 18.9156 18.9895 18.9895 19.1551 19.1551 21.4358 21.4358 21.5306 21.5306 22.7621 22.7621 22.8871 22.8871 k = 0.0541 0.0541-0.0000 ( 1385 PWs) bands (ev): -46.5991 -46.5991 -44.3514 -44.3514 -20.6161 -20.6161 -18.6195 -18.6195 -18.1311 -18.1311 -18.1134 -18.1134 -17.3481 -17.3481 -17.3288 -17.3288 12.9088 12.9088 15.2899 15.2899 15.3073 15.3073 18.9288 18.9288 18.9918 18.9918 19.1344 19.1344 21.4538 21.4538 21.5298 21.5298 22.8378 22.8378 22.9473 22.9473 k = 0.0473 0.0473-0.0000 ( 1387 PWs) bands (ev): -46.5995 -46.5995 -44.3513 -44.3513 -20.6160 -20.6160 -18.6181 -18.6181 -18.1307 -18.1307 -18.1171 -18.1171 -17.3425 -17.3425 -17.3276 -17.3276 12.8794 12.8794 15.2733 15.2733 15.2864 15.2864 18.9400 18.9400 18.9921 18.9921 19.1179 19.1179 21.4701 21.4701 21.5290 21.5290 22.9058 22.9058 23.0002 23.0002 k = 0.0405 0.0405-0.0000 ( 1387 PWs) bands (ev): -46.5999 -46.5999 -44.3513 -44.3513 -20.6159 -20.6159 -18.6169 -18.6169 -18.1304 -18.1304 -18.1204 -18.1204 -17.3375 -17.3375 -17.3266 -17.3266 12.8538 12.8538 15.2588 15.2588 15.2683 15.2683 18.9493 18.9493 18.9906 18.9906 19.1059 19.1059 21.4846 21.4846 21.5284 21.5284 22.9657 22.9657 23.0447 23.0447 k = 0.0338 0.0338-0.0000 ( 1387 PWs) bands (ev): -46.6003 -46.6003 -44.3512 -44.3512 -20.6158 -20.6158 -18.6158 -18.6158 -18.1301 -18.1301 -18.1231 -18.1231 -17.3333 -17.3333 -17.3257 -17.3257 12.8321 12.8321 15.2465 15.2465 15.2530 15.2530 18.9568 18.9568 18.9875 18.9875 19.0978 19.0978 21.4972 21.4972 21.5279 21.5279 23.0169 23.0169 23.0797 23.0797 k = 0.0270 0.0270-0.0000 ( 1383 PWs) bands (ev): -46.6006 -46.6006 -44.3512 -44.3512 -20.6157 -20.6157 -18.6149 -18.6149 -18.1297 -18.1297 -18.1253 -18.1253 -17.3299 -17.3299 -17.3250 -17.3250 12.8143 12.8143 15.2364 15.2364 15.2405 15.2405 18.9627 18.9627 18.9834 18.9834 19.0928 19.0928 21.5077 21.5077 21.5275 21.5275 23.0591 23.0591 23.1044 23.1044 k = 0.0203 0.0203-0.0000 ( 1379 PWs) bands (ev): -46.6008 -46.6008 -44.3512 -44.3512 -20.6156 -20.6156 -18.6142 -18.6142 -18.1294 -18.1294 -18.1270 -18.1270 -17.3272 -17.3272 -17.3244 -17.3244 12.8004 12.8004 15.2285 15.2285 15.2308 15.2308 18.9671 18.9671 18.9792 18.9792 19.0902 19.0902 21.5160 21.5160 21.5272 21.5272 23.0920 23.0920 23.1200 23.1200 k = 0.0135 0.0135-0.0000 ( 1375 PWs) bands (ev): -46.6009 -46.6009 -44.3512 -44.3512 -20.6155 -20.6155 -18.6137 -18.6137 -18.1292 -18.1292 -18.1282 -18.1282 -17.3252 -17.3252 -17.3240 -17.3240 12.7905 12.7905 15.2229 15.2229 15.2238 15.2238 18.9702 18.9702 18.9757 18.9757 19.0889 19.0889 21.5220 21.5220 21.5270 21.5270 23.1156 23.1156 23.1288 23.1288 k = 0.0068 0.0068-0.0000 ( 1365 PWs) bands (ev): -46.6010 -46.6010 -44.3512 -44.3512 -20.6154 -20.6154 -18.6133 -18.6133 -18.1290 -18.1290 -18.1287 -18.1287 -17.3241 -17.3241 -17.3237 -17.3237 12.7846 12.7846 15.2195 15.2195 15.2198 15.2198 18.9720 18.9720 18.9734 18.9734 19.0884 19.0884 21.5256 21.5256 21.5269 21.5269 23.1299 23.1299 23.1333 23.1333 k = 0.0000 0.0000 0.0000 ( 1365 PWs) bands (ev): -46.6010 -46.6010 -44.3512 -44.3512 -20.6154 -20.6154 -18.6132 -18.6132 -18.1290 -18.1290 -18.1290 -18.1290 -17.3237 -17.3237 -17.3237 -17.3237 12.7826 12.7826 15.2184 15.2184 15.2184 15.2184 18.9726 18.9726 18.9726 18.9726 19.0882 19.0882 21.5268 21.5268 21.5268 21.5268 23.1346 23.1346 23.1346 23.1346 k = 0.0000 0.0000 0.0000 ( 1365 PWs) bands (ev): -46.6010 -46.6010 -44.3512 -44.3512 -20.6154 -20.6154 -18.6132 -18.6132 -18.1290 -18.1290 -18.1290 -18.1290 -17.3237 -17.3237 -17.3237 -17.3237 12.7826 12.7826 15.2184 15.2184 15.2184 15.2184 18.9726 18.9726 18.9726 18.9726 19.0882 19.0882 21.5268 21.5268 21.5268 21.5268 23.1346 23.1346 23.1346 23.1346 k = 0.0056 0.0056 0.0056 ( 1365 PWs) bands (ev): -46.6010 -46.6010 -44.3512 -44.3512 -20.6154 -20.6154 -18.6133 -18.6133 -18.1290 -18.1290 -18.1287 -18.1287 -17.3241 -17.3241 -17.3237 -17.3237 12.7846 12.7846 15.2197 15.2197 15.2197 15.2197 18.9719 18.9719 18.9735 18.9735 19.0884 19.0884 21.5262 21.5262 21.5263 21.5263 23.1296 23.1296 23.1335 23.1335 k = 0.0111 0.0111 0.0111 ( 1371 PWs) bands (ev): -46.6009 -46.6009 -44.3512 -44.3512 -20.6155 -20.6155 -18.6137 -18.6137 -18.1292 -18.1292 -18.1281 -18.1281 -17.3253 -17.3253 -17.3239 -17.3239 12.7906 12.7906 15.2235 15.2235 15.2235 15.2235 18.9698 18.9698 18.9760 18.9760 19.0890 19.0890 21.5243 21.5243 21.5246 21.5246 23.1139 23.1139 23.1301 23.1301 k = 0.0167 0.0167 0.0167 ( 1386 PWs) bands (ev): -46.6008 -46.6008 -44.3512 -44.3512 -20.6157 -20.6157 -18.6143 -18.6143 -18.1297 -18.1297 -18.1269 -18.1269 -17.3274 -17.3274 -17.3243 -17.3243 12.8007 12.8007 15.2296 15.2296 15.2298 15.2298 18.9664 18.9664 18.9797 18.9797 19.0905 19.0905 21.5211 21.5211 21.5219 21.5219 23.0867 23.0867 23.1243 23.1243 k = 0.0222 0.0222 0.0222 ( 1386 PWs) bands (ev): -46.6005 -46.6005 -44.3512 -44.3512 -20.6157 -20.6157 -18.6150 -18.6150 -18.1300 -18.1300 -18.1250 -18.1250 -17.3302 -17.3302 -17.3247 -17.3247 12.8147 12.8147 15.2385 15.2385 15.2388 15.2388 18.9616 18.9616 18.9836 18.9836 19.0938 19.0938 21.5168 21.5168 21.5182 21.5182 23.0468 23.0468 23.1166 23.1166 k = 0.0278 0.0278 0.0278 ( 1386 PWs) bands (ev): -46.6003 -46.6003 -44.3512 -44.3512 -20.6158 -20.6158 -18.6158 -18.6158 -18.1305 -18.1305 -18.1226 -18.1226 -17.3339 -17.3339 -17.3253 -17.3253 12.8328 12.8328 15.2500 15.2500 15.2504 15.2504 18.9554 18.9554 18.9864 18.9864 19.1002 19.1002 21.5114 21.5114 21.5135 21.5135 22.9938 22.9938 23.1068 23.1068 k = 0.0333 0.0333 0.0333 ( 1386 PWs) bands (ev): -46.5999 -46.5999 -44.3513 -44.3513 -20.6159 -20.6159 -18.6169 -18.6169 -18.1310 -18.1310 -18.1196 -18.1196 -17.3383 -17.3383 -17.3260 -17.3260 12.8548 12.8548 15.2639 15.2639 15.2645 15.2645 18.9478 18.9478 18.9870 18.9870 19.1109 19.1109 21.5049 21.5049 21.5079 21.5079 22.9281 22.9281 23.0950 23.0950 k = 0.0389 0.0389 0.0389 ( 1385 PWs) bands (ev): -46.5995 -46.5995 -44.3513 -44.3513 -20.6160 -20.6160 -18.6182 -18.6182 -18.1315 -18.1315 -18.1161 -18.1161 -17.3435 -17.3435 -17.3269 -17.3269 12.8807 12.8807 15.2804 15.2804 15.2811 15.2811 18.9387 18.9387 18.9844 18.9844 19.1268 19.1268 21.4975 21.4975 21.5016 21.5016 22.8506 22.8506 23.0811 23.0811 k = 0.0444 0.0444 0.0444 ( 1385 PWs) bands (ev): -46.5991 -46.5991 -44.3514 -44.3514 -20.6161 -20.6161 -18.6197 -18.6197 -18.1322 -18.1322 -18.1120 -18.1120 -17.3495 -17.3495 -17.3278 -17.3278 12.9105 12.9105 15.2993 15.2993 15.3003 15.3003 18.9282 18.9282 18.9784 18.9784 19.1479 19.1479 21.4892 21.4892 21.4945 21.4945 22.7622 22.7622 23.0653 23.0653 k = 0.0500 0.0500 0.0500 ( 1391 PWs) bands (ev): -46.5985 -46.5985 -44.3514 -44.3514 -20.6163 -20.6163 -18.6215 -18.6215 -18.1330 -18.1330 -18.1075 -18.1075 -17.3563 -17.3563 -17.3290 -17.3290 12.9442 12.9442 15.3207 15.3207 15.3219 15.3219 18.9161 18.9161 18.9692 18.9692 19.1735 19.1735 21.4802 21.4802 21.4869 21.4869 22.6641 22.6641 23.0476 23.0476 k = 0.0556 0.0556 0.0556 ( 1391 PWs) bands (ev): -46.5980 -46.5980 -44.3515 -44.3515 -20.6165 -20.6165 -18.6234 -18.6234 -18.1338 -18.1338 -18.1024 -18.1024 -17.3636 -17.3636 -17.3302 -17.3302 12.9816 12.9816 15.3445 15.3445 15.3460 15.3460 18.9026 18.9026 18.9573 18.9573 19.2042 19.2042 21.4706 21.4706 21.4788 21.4788 22.5572 22.5572 23.0281 23.0281 k = 0.0611 0.0611 0.0611 ( 1394 PWs) bands (ev): -46.5973 -46.5973 -44.3515 -44.3515 -20.6168 -20.6168 -18.6255 -18.6255 -18.1347 -18.1347 -18.0969 -18.0969 -17.3717 -17.3717 -17.3316 -17.3316 13.0227 13.0227 15.3707 15.3707 15.3725 15.3725 18.8874 18.8874 18.9429 18.9429 19.2390 19.2390 21.4605 21.4605 21.4704 21.4704 22.4426 22.4426 23.0069 23.0069 k = 0.0667 0.0667 0.0667 ( 1394 PWs) bands (ev): -46.5966 -46.5966 -44.3515 -44.3515 -20.6171 -20.6171 -18.6279 -18.6279 -18.1357 -18.1357 -18.0908 -18.0908 -17.3804 -17.3804 -17.3332 -17.3332 13.0674 13.0674 15.3992 15.3992 15.4014 15.4014 18.8707 18.8707 18.9262 18.9262 19.2777 19.2777 21.4502 21.4502 21.4617 21.4617 22.3212 22.3212 22.9840 22.9840 k = 0.0722 0.0722 0.0722 ( 1394 PWs) bands (ev): -46.5959 -46.5959 -44.3516 -44.3516 -20.6175 -20.6175 -18.6305 -18.6305 -18.1367 -18.1367 -18.0843 -18.0843 -17.3896 -17.3896 -17.3348 -17.3348 13.1158 13.1158 15.4301 15.4301 15.4326 15.4326 18.8524 18.8524 18.9074 18.9074 19.3201 19.3201 21.4396 21.4396 21.4530 21.4530 22.1940 22.1940 22.9597 22.9597 k = 0.0778 0.0778 0.0778 ( 1400 PWs) bands (ev): -46.5951 -46.5951 -44.3516 -44.3516 -20.6179 -20.6179 -18.6333 -18.6333 -18.1378 -18.1378 -18.0773 -18.0773 -17.3995 -17.3995 -17.3367 -17.3367 13.1676 13.1676 15.4633 15.4633 15.4661 15.4661 18.8324 18.8324 18.8866 18.8866 19.3660 19.3660 21.4288 21.4288 21.4441 21.4441 22.0618 22.0618 22.9340 22.9340 k = 0.0833 0.0833 0.0833 ( 1400 PWs) bands (ev): -46.5943 -46.5943 -44.3517 -44.3517 -20.6184 -20.6184 -18.6364 -18.6364 -18.1389 -18.1389 -18.0698 -18.0698 -17.4098 -17.4098 -17.3387 -17.3387 13.2228 13.2228 15.4987 15.4987 15.5019 15.5019 18.8109 18.8109 18.8638 18.8638 19.4151 19.4151 21.4183 21.4183 21.4355 21.4355 21.9256 21.9256 22.9069 22.9069 k = 0.0889 0.0889 0.0889 ( 1400 PWs) bands (ev): -46.5934 -46.5934 -44.3517 -44.3517 -20.6190 -20.6190 -18.6396 -18.6396 -18.1401 -18.1401 -18.0620 -18.0620 -17.4205 -17.4205 -17.3407 -17.3407 13.2813 13.2813 15.5363 15.5363 15.5399 15.5399 18.7877 18.7877 18.8391 18.8391 19.4671 19.4671 21.4081 21.4081 21.4272 21.4272 21.7863 21.7863 22.8787 22.8787 k = 0.0944 0.0944 0.0944 ( 1400 PWs) bands (ev): -46.5924 -46.5924 -44.3517 -44.3517 -20.6196 -20.6196 -18.6431 -18.6431 -18.1414 -18.1414 -18.0537 -18.0537 -17.4317 -17.4317 -17.3430 -17.3430 13.3431 13.3431 15.5761 15.5761 15.5801 15.5801 18.7628 18.7628 18.8126 18.8126 19.5218 19.5218 21.3983 21.3983 21.4189 21.4189 21.6453 21.6453 22.8493 22.8493 k = 0.1000 0.1000 0.1000 ( 1421 PWs) bands (ev): -46.5915 -46.5915 -44.3518 -44.3518 -20.6205 -20.6205 -18.6471 -18.6471 -18.1429 -18.1429 -18.0452 -18.0452 -17.4434 -17.4434 -17.3456 -17.3456 13.4080 13.4080 15.6179 15.6179 15.6223 15.6223 18.7362 18.7362 18.7840 18.7840 19.5786 19.5786 21.3887 21.3887 21.4087 21.4087 21.5050 21.5050 22.8189 22.8189 k = 0.1056 0.1056 0.1056 ( 1418 PWs) bands (ev): -46.5905 -46.5905 -44.3518 -44.3518 -20.6213 -20.6213 -18.6510 -18.6510 -18.1442 -18.1442 -18.0362 -18.0362 -17.4553 -17.4553 -17.3480 -17.3480 13.4760 13.4760 15.6618 15.6618 15.6666 15.6666 18.7082 18.7082 18.7540 18.7540 19.6370 19.6370 21.3494 21.3494 21.3800 21.3800 21.4150 21.4150 22.7877 22.7877 k = 0.1111 0.1111 0.1111 ( 1418 PWs) bands (ev): -46.5894 -46.5894 -44.3518 -44.3518 -20.6222 -20.6222 -18.6551 -18.6551 -18.1455 -18.1455 -18.0270 -18.0270 -17.4675 -17.4675 -17.3507 -17.3507 13.5468 13.5468 15.7077 15.7077 15.7129 15.7129 18.6786 18.6786 18.7222 18.7222 19.6959 19.6959 21.2133 21.2133 21.3721 21.3721 21.4042 21.4042 22.7558 22.7558 k = 0.1167 0.1167 0.1167 ( 1418 PWs) bands (ev): -46.5883 -46.5883 -44.3518 -44.3518 -20.6232 -20.6232 -18.6595 -18.6595 -18.1468 -18.1468 -18.0174 -18.0174 -17.4799 -17.4799 -17.3536 -17.3536 13.6205 13.6205 15.7554 15.7554 15.7610 15.7610 18.6474 18.6474 18.6888 18.6888 19.7537 19.7537 21.0764 21.0764 21.3650 21.3650 21.3985 21.3985 22.7233 22.7233 k = 0.1222 0.1222 0.1222 ( 1418 PWs) bands (ev): -46.5872 -46.5872 -44.3517 -44.3517 -20.6243 -20.6243 -18.6641 -18.6641 -18.1482 -18.1482 -18.0076 -18.0076 -17.4925 -17.4925 -17.3566 -17.3566 13.6969 13.6969 15.8051 15.8051 15.8110 15.8110 18.6147 18.6147 18.6538 18.6538 19.8079 19.8079 20.9455 20.9455 21.3588 21.3588 21.3944 21.3944 22.6902 22.6902 k = 0.1278 0.1278 0.1278 ( 1424 PWs) bands (ev): -46.5861 -46.5861 -44.3517 -44.3517 -20.6256 -20.6256 -18.6689 -18.6689 -18.1496 -18.1496 -17.9977 -17.9977 -17.5052 -17.5052 -17.3597 -17.3597 13.7759 13.7759 15.8564 15.8564 15.8627 15.8627 18.5807 18.5807 18.6173 18.6173 19.8539 19.8539 20.8259 20.8259 21.3536 21.3536 21.3914 21.3914 22.6566 22.6566 k = 0.1333 0.1333 0.1333 ( 1424 PWs) bands (ev): -46.5849 -46.5849 -44.3516 -44.3516 -20.6270 -20.6270 -18.6739 -18.6739 -18.1510 -18.1510 -17.9876 -17.9876 -17.5179 -17.5179 -17.3630 -17.3630 13.8573 13.8573 15.9095 15.9095 15.9161 15.9161 18.5453 18.5453 18.5795 18.5795 19.8843 19.8843 20.7258 20.7258 21.3495 21.3495 21.3896 21.3896 22.6229 22.6229 k = 0.1389 0.1389 0.1389 ( 1424 PWs) bands (ev): -46.5837 -46.5837 -44.3515 -44.3515 -20.6284 -20.6284 -18.6791 -18.6791 -18.1523 -18.1523 -17.9773 -17.9773 -17.5307 -17.5307 -17.3665 -17.3665 13.9411 13.9411 15.9642 15.9642 15.9711 15.9711 18.5086 18.5086 18.5403 18.5403 19.8884 19.8884 20.6558 20.6558 21.3465 21.3465 21.3889 21.3889 22.5889 22.5889 k = 0.1444 0.1444 0.1444 ( 1418 PWs) bands (ev): -46.5824 -46.5824 -44.3514 -44.3514 -20.6299 -20.6299 -18.6843 -18.6843 -18.1536 -18.1536 -17.9670 -17.9670 -17.5432 -17.5432 -17.3701 -17.3701 14.0270 14.0270 16.0204 16.0204 16.0276 16.0276 18.4709 18.4709 18.5000 18.5000 19.8568 19.8568 20.6262 20.6262 21.3448 21.3448 21.3894 21.3894 22.5548 22.5548 k = 0.1500 0.1500 0.1500 ( 1418 PWs) bands (ev): -46.5812 -46.5812 -44.3513 -44.3513 -20.6316 -20.6316 -18.6899 -18.6899 -18.1549 -18.1549 -17.9568 -17.9568 -17.5557 -17.5557 -17.3738 -17.3738 14.1151 14.1151 16.0780 16.0780 16.0855 16.0855 18.4321 18.4321 18.4586 18.4586 19.7888 19.7888 20.6375 20.6375 21.3441 21.3441 21.3910 21.3910 22.5207 22.5207 k = 0.1556 0.1556 0.1556 ( 1424 PWs) bands (ev): -46.5799 -46.5799 -44.3512 -44.3512 -20.6335 -20.6335 -18.6956 -18.6956 -18.1562 -18.1562 -17.9468 -17.9468 -17.5681 -17.5681 -17.3779 -17.3779 14.2050 14.2050 16.1370 16.1370 16.1446 16.1446 18.3922 18.3922 18.4160 18.4160 19.6930 19.6930 20.6814 20.6814 21.3445 21.3445 21.3937 21.3937 22.4867 22.4867 k = 0.1611 0.1611 0.1611 ( 1430 PWs) bands (ev): -46.5786 -46.5786 -44.3510 -44.3510 -20.6354 -20.6354 -18.7015 -18.7015 -18.1575 -18.1575 -17.9370 -17.9370 -17.5801 -17.5801 -17.3821 -17.3821 14.2968 14.2968 16.1971 16.1971 16.2047 16.2047 18.3516 18.3516 18.3728 18.3728 19.5800 19.5800 20.7479 20.7479 21.3461 21.3461 21.3976 21.3976 22.4529 22.4529 k = 0.1667 0.1667 0.1667 ( 1436 PWs) bands (ev): -46.5773 -46.5773 -44.3509 -44.3509 -20.6375 -20.6375 -18.7076 -18.7076 -18.1587 -18.1587 -17.9274 -17.9274 -17.5917 -17.5917 -17.3864 -17.3864 14.3902 14.3902 16.2584 16.2584 16.2660 16.2660 18.3103 18.3103 18.3287 18.3287 19.4572 19.4572 20.8294 20.8294 21.3489 21.3489 21.4026 21.4026 22.4194 22.4194 k = 0.1722 0.1722 0.1722 ( 1424 PWs) bands (ev): -46.5759 -46.5759 -44.3507 -44.3507 -20.6395 -20.6395 -18.7135 -18.7135 -18.1598 -18.1598 -17.9180 -17.9180 -17.6027 -17.6027 -17.3908 -17.3908 14.4851 14.4851 16.3207 16.3207 16.3283 16.3283 18.2687 18.2687 18.2843 18.2843 19.3298 19.3298 20.9216 20.9216 21.3529 21.3529 21.4091 21.4091 22.3864 22.3864 k = 0.1778 0.1778 0.1778 ( 1424 PWs) bands (ev): -46.5746 -46.5746 -44.3504 -44.3504 -20.6418 -20.6418 -18.7196 -18.7196 -18.1608 -18.1608 -17.9094 -17.9094 -17.6131 -17.6131 -17.3954 -17.3954 14.5814 14.5814 16.3840 16.3840 16.3912 16.3912 18.2266 18.2266 18.2393 18.2393 19.2001 19.2001 21.0212 21.0212 21.3579 21.3579 21.4168 21.4168 22.3516 22.3516 k = 0.1833 0.1833 0.1833 ( 1424 PWs) bands (ev): -46.5733 -46.5733 -44.3502 -44.3502 -20.6441 -20.6441 -18.7258 -18.7258 -18.1618 -18.1618 -17.9014 -17.9014 -17.6228 -17.6228 -17.4002 -17.4002 14.6788 14.6788 16.4479 16.4479 16.4548 16.4548 18.1843 18.1843 18.1940 18.1940 19.0702 19.0702 21.1264 21.1264 21.3640 21.3640 21.4263 21.4263 22.3158 22.3158 k = 0.1889 0.1889 0.1889 ( 1424 PWs) bands (ev): -46.5719 -46.5719 -44.3499 -44.3499 -20.6466 -20.6466 -18.7321 -18.7321 -18.1627 -18.1627 -17.8943 -17.8943 -17.6316 -17.6316 -17.4052 -17.4052 14.7772 14.7772 16.5125 16.5125 16.5188 16.5188 18.1419 18.1419 18.1484 18.1484 18.9413 18.9413 21.2350 21.2350 21.3712 21.3712 21.4387 21.4387 22.2806 22.2806 k = 0.1944 0.1944 0.1944 ( 1430 PWs) bands (ev): -46.5706 -46.5706 -44.3496 -44.3496 -20.6492 -20.6492 -18.7385 -18.7385 -18.1635 -18.1635 -17.8883 -17.8883 -17.6394 -17.6394 -17.4104 -17.4104 14.8764 14.8764 16.5775 16.5775 16.5830 16.5830 18.0997 18.0997 18.1028 18.1028 18.8142 18.8142 21.3406 21.3406 21.3793 21.3793 21.4595 21.4595 22.2461 22.2461 k = 0.2000 0.2000 0.2000 ( 1430 PWs) bands (ev): -46.5692 -46.5692 -44.3493 -44.3493 -20.6518 -20.6518 -18.7448 -18.7448 -18.1642 -18.1642 -17.8833 -17.8833 -17.6460 -17.6460 -17.4157 -17.4157 14.9763 14.9763 16.6429 16.6429 16.6473 16.6473 18.0573 18.0573 18.0579 18.0579 18.6897 18.6897 21.3884 21.3884 21.4154 21.4154 21.5162 21.5162 22.2126 22.2126 k = 0.2056 0.2056 0.2056 ( 1430 PWs) bands (ev): -46.5678 -46.5678 -44.3490 -44.3490 -20.6545 -20.6545 -18.7511 -18.7511 -18.1648 -18.1648 -17.8795 -17.8795 -17.6513 -17.6513 -17.4212 -17.4212 15.0766 15.0766 16.7084 16.7084 16.7114 16.7114 18.0120 18.0120 18.0166 18.0166 18.5684 18.5684 21.3984 21.3984 21.4448 21.4448 21.6228 21.6228 22.1800 22.1800 k = 0.2111 0.2111 0.2111 ( 1424 PWs) bands (ev): -46.5665 -46.5665 -44.3486 -44.3486 -20.6573 -20.6573 -18.7573 -18.7573 -18.1652 -18.1652 -17.8770 -17.8770 -17.6553 -17.6553 -17.4269 -17.4269 15.1771 15.1771 16.7738 16.7738 16.7750 16.7750 17.9671 17.9671 17.9762 17.9762 18.4507 18.4507 21.4092 21.4092 21.4618 21.4618 21.7459 21.7459 22.1487 22.1487 k = 0.2167 0.2167 0.2167 ( 1424 PWs) bands (ev): -46.5651 -46.5651 -44.3482 -44.3482 -20.6602 -20.6602 -18.7635 -18.7635 -18.1655 -18.1655 -17.8760 -17.8760 -17.6579 -17.6579 -17.4328 -17.4328 15.2776 15.2776 16.8378 16.8378 16.8389 16.8389 17.9226 17.9226 17.9369 17.9369 18.3369 18.3369 21.4207 21.4207 21.4765 21.4765 21.8751 21.8751 22.1186 22.1186 k = 0.2222 0.2222 0.2222 ( 1430 PWs) bands (ev): -46.5638 -46.5638 -44.3478 -44.3478 -20.6631 -20.6631 -18.7697 -18.7697 -18.1658 -18.1658 -17.8766 -17.8766 -17.6591 -17.6591 -17.4388 -17.4388 15.3778 15.3778 16.8993 16.8993 16.9034 16.9034 17.8788 17.8788 17.8991 17.8991 18.2277 18.2277 21.4330 21.4330 21.4907 21.4907 22.0067 22.0067 22.0911 22.0911 k = 0.2278 0.2278 0.2278 ( 1430 PWs) bands (ev): -46.5624 -46.5624 -44.3474 -44.3474 -20.6661 -20.6661 -18.7757 -18.7757 -18.1658 -18.1658 -17.8784 -17.8784 -17.6591 -17.6591 -17.4450 -17.4450 15.4774 15.4774 16.9591 16.9591 16.9670 16.9670 17.8357 17.8357 17.8633 17.8633 18.1235 18.1235 21.4459 21.4459 21.5050 21.5050 22.0580 22.0580 22.0957 22.0957 k = 0.2333 0.2333 0.2333 ( 1433 PWs) bands (ev): -46.5611 -46.5611 -44.3469 -44.3469 -20.6691 -20.6691 -18.7816 -18.7816 -18.1658 -18.1658 -17.8814 -17.8814 -17.6580 -17.6580 -17.4514 -17.4514 15.5761 15.5761 17.0164 17.0164 17.0291 17.0291 17.7934 17.7934 17.8302 17.8302 18.0250 18.0250 21.4594 21.4594 21.5194 21.5194 22.0330 22.0330 22.0723 22.0723 k = 0.2389 0.2389 0.2389 ( 1430 PWs) bands (ev): -46.5598 -46.5598 -44.3465 -44.3465 -20.6721 -20.6721 -18.7873 -18.7873 -18.1656 -18.1656 -17.8854 -17.8854 -17.6560 -17.6560 -17.4580 -17.4580 15.6734 15.6734 17.0705 17.0705 17.0893 17.0893 17.7518 17.7518 17.8005 17.8005 17.9335 17.9335 21.4735 21.4735 21.5342 21.5342 22.0081 22.0081 22.0503 22.0503 k = 0.2444 0.2444 0.2444 ( 1442 PWs) bands (ev): -46.5585 -46.5585 -44.3460 -44.3460 -20.6752 -20.6752 -18.7930 -18.7930 -18.1654 -18.1654 -17.8904 -17.8904 -17.6533 -17.6533 -17.4648 -17.4648 15.7689 15.7689 17.1200 17.1200 17.1466 17.1466 17.7101 17.7101 17.7753 17.7753 17.8507 17.8507 21.4880 21.4880 21.5491 21.5491 21.9841 21.9841 22.0292 22.0292 k = 0.2500 0.2500 0.2500 ( 1442 PWs) bands (ev): -46.5572 -46.5572 -44.3455 -44.3455 -20.6783 -20.6783 -18.7984 -18.7984 -18.1648 -18.1648 -17.8961 -17.8961 -17.6501 -17.6501 -17.4717 -17.4717 15.8620 15.8620 17.1638 17.1638 17.2000 17.2000 17.6665 17.6665 17.7560 17.7560 17.7802 17.7802 21.5029 21.5029 21.5642 21.5642 21.9620 21.9620 22.0099 22.0099 k = 0.2556 0.2556 0.2556 ( 1442 PWs) bands (ev): -46.5559 -46.5559 -44.3450 -44.3450 -20.6814 -20.6814 -18.8035 -18.8035 -18.1641 -18.1641 -17.9022 -17.9022 -17.6465 -17.6465 -17.4788 -17.4788 15.9521 15.9521 17.2001 17.2001 17.2475 17.2475 17.6183 17.6183 17.7273 17.7273 17.7441 17.7441 21.5182 21.5182 21.5794 21.5794 21.9415 21.9415 21.9920 21.9920 k = 0.2611 0.2611 0.2611 ( 1433 PWs) bands (ev): -46.5546 -46.5546 -44.3444 -44.3444 -20.6843 -20.6843 -18.8084 -18.8084 -18.1631 -18.1631 -17.9087 -17.9087 -17.6426 -17.6426 -17.4861 -17.4861 16.0383 16.0383 17.2271 17.2271 17.2862 17.2862 17.5661 17.5661 17.6949 17.6949 17.7413 17.7413 21.5337 21.5337 21.5947 21.5947 21.9230 21.9230 21.9759 21.9759 k = 0.2667 0.2667 0.2667 ( 1433 PWs) bands (ev): -46.5533 -46.5533 -44.3439 -44.3439 -20.6874 -20.6874 -18.8131 -18.8131 -18.1621 -18.1621 -17.9155 -17.9155 -17.6388 -17.6388 -17.4935 -17.4935 16.1195 16.1195 17.2439 17.2439 17.3129 17.3129 17.5151 17.5151 17.6817 17.6817 17.7486 17.7486 21.5495 21.5495 21.6100 21.6100 21.9059 21.9059 21.9610 21.9610 k = 0.2722 0.2722 0.2722 ( 1439 PWs) bands (ev): -46.5521 -46.5521 -44.3433 -44.3433 -20.6904 -20.6904 -18.8176 -18.8176 -18.1608 -18.1608 -17.9226 -17.9226 -17.6352 -17.6352 -17.5012 -17.5012 16.1945 16.1945 17.2505 17.2505 17.3250 17.3250 17.4703 17.4703 17.6864 17.6864 17.7658 17.7658 21.5653 21.5653 21.6251 21.6251 21.8907 21.8907 21.9477 21.9477 k = 0.2778 0.2778 0.2778 ( 1439 PWs) bands (ev): -46.5508 -46.5508 -44.3427 -44.3427 -20.6933 -20.6933 -18.8217 -18.8217 -18.1593 -18.1593 -17.9297 -17.9297 -17.6317 -17.6317 -17.5089 -17.5089 16.2619 16.2619 17.2480 17.2480 17.3231 17.3231 17.4350 17.4350 17.7065 17.7065 17.7917 17.7917 21.5814 21.5814 21.6402 21.6402 21.8774 21.8774 21.9360 21.9360 k = 0.2833 0.2833 0.2833 ( 1439 PWs) bands (ev): -46.5496 -46.5496 -44.3422 -44.3422 -20.6962 -20.6962 -18.8255 -18.8255 -18.1577 -18.1577 -17.9368 -17.9368 -17.6286 -17.6286 -17.5169 -17.5169 16.3202 16.3202 17.2384 17.2384 17.3104 17.3104 17.4113 17.4113 17.7378 17.7378 17.8243 17.8243 21.5976 21.5976 21.6551 21.6551 21.8660 21.8660 21.9259 21.9259 k = 0.2889 0.2889 0.2889 ( 1439 PWs) bands (ev): -46.5484 -46.5484 -44.3416 -44.3416 -20.6990 -20.6990 -18.8290 -18.8290 -18.1558 -18.1558 -17.9438 -17.9438 -17.6259 -17.6259 -17.5250 -17.5250 16.3681 16.3681 17.2237 17.2237 17.2913 17.2913 17.4002 17.4002 17.7761 17.7761 17.8614 17.8614 21.6138 21.6138 21.6696 21.6696 21.8567 21.8567 21.9173 21.9173 k = 0.2944 0.2944 0.2944 ( 1439 PWs) bands (ev): -46.5472 -46.5472 -44.3410 -44.3410 -20.7018 -20.7018 -18.8322 -18.8322 -18.1538 -18.1538 -17.9507 -17.9507 -17.6236 -17.6236 -17.5332 -17.5332 16.4048 16.4048 17.2054 17.2054 17.2689 17.2689 17.4023 17.4023 17.8181 17.8181 17.9015 17.9015 21.6300 21.6300 21.6836 21.6836 21.8495 21.8495 21.9103 21.9103 k = 0.3000 0.3000 0.3000 ( 1439 PWs) bands (ev): -46.5461 -46.5461 -44.3404 -44.3404 -20.7045 -20.7045 -18.8351 -18.8351 -18.1515 -18.1515 -17.9575 -17.9575 -17.6219 -17.6219 -17.5416 -17.5416 16.4303 16.4303 17.1849 17.1849 17.2446 17.2446 17.4179 17.4179 17.8619 17.8619 17.9431 17.9431 21.6461 21.6461 21.6971 21.6971 21.8445 21.8445 21.9049 21.9049 k = 0.3056 0.3056 0.3056 ( 1439 PWs) bands (ev): -46.5449 -46.5449 -44.3398 -44.3398 -20.7071 -20.7071 -18.8376 -18.8376 -18.1490 -18.1490 -17.9640 -17.9640 -17.6207 -17.6207 -17.5502 -17.5502 16.4456 16.4456 17.1631 17.1631 17.2196 17.2196 17.4461 17.4461 17.9061 17.9061 17.9853 17.9853 21.6622 21.6622 21.7100 21.7100 21.8417 21.8417 21.9010 21.9010 k = 0.3111 0.3111 0.3111 ( 1445 PWs) bands (ev): -46.5438 -46.5438 -44.3392 -44.3392 -20.7096 -20.7096 -18.8399 -18.8399 -18.1463 -18.1463 -17.9705 -17.9705 -17.6201 -17.6201 -17.5589 -17.5589 16.4526 16.4526 17.1407 17.1407 17.1942 17.1942 17.4849 17.4849 17.9498 17.9498 18.0273 18.0273 21.6781 21.6781 21.7221 21.7221 21.8411 21.8411 21.8986 21.8986 k = 0.3167 0.3167 0.3167 ( 1445 PWs) bands (ev): -46.5428 -46.5427 -44.3385 -44.3385 -20.7120 -20.7120 -18.8417 -18.8417 -18.1434 -18.1434 -17.9766 -17.9766 -17.6201 -17.6201 -17.5677 -17.5677 16.4532 16.4532 17.1180 17.1180 17.1691 17.1691 17.5324 17.5324 17.9926 17.9926 18.0686 18.0686 21.6939 21.6939 21.7336 21.7336 21.8426 21.8426 21.8976 21.8976 k = 0.3222 0.3222 0.3222 ( 1439 PWs) bands (ev): -46.5417 -46.5417 -44.3379 -44.3379 -20.7143 -20.7143 -18.8431 -18.8431 -18.1402 -18.1402 -17.9823 -17.9823 -17.6207 -17.6207 -17.5766 -17.5766 16.4496 16.4496 17.0956 17.0956 17.1445 17.1445 17.5861 17.5861 18.0340 18.0340 18.1089 18.1089 21.7098 21.7098 21.7444 21.7444 21.8463 21.8463 21.8979 21.8979 k = 0.3278 0.3278 0.3278 ( 1436 PWs) bands (ev): -46.5406 -46.5406 -44.3373 -44.3373 -20.7164 -20.7164 -18.8441 -18.8441 -18.1369 -18.1369 -17.9876 -17.9876 -17.6221 -17.6221 -17.5856 -17.5856 16.4434 16.4434 17.0736 17.0736 17.1207 17.1207 17.6440 17.6440 18.0739 18.0739 18.1477 18.1477 21.7253 21.7253 21.7546 21.7546 21.8518 21.8518 21.8995 21.8995 k = 0.3333 0.3333 0.3333 ( 1436 PWs) bands (ev): -46.5396 -46.5396 -44.3367 -44.3367 -20.7185 -20.7185 -18.8449 -18.8449 -18.1333 -18.1333 -17.9928 -17.9928 -17.6240 -17.6240 -17.5948 -17.5948 16.4363 16.4363 17.0521 17.0521 17.0976 17.0976 17.7045 17.7045 18.1120 18.1120 18.1850 18.1850 21.7407 21.7407 21.7645 21.7645 21.8588 21.8588 21.9022 21.9022 k = 0.3389 0.3389 0.3389 ( 1436 PWs) bands (ev): -46.5386 -46.5386 -44.3362 -44.3362 -20.7204 -20.7204 -18.8453 -18.8453 -18.1295 -18.1295 -17.9977 -17.9977 -17.6267 -17.6267 -17.6042 -17.6042 16.4294 16.4294 17.0313 17.0313 17.0754 17.0754 17.7660 17.7660 18.1483 18.1483 18.2206 18.2206 21.7558 21.7558 21.7743 21.7743 21.8670 21.8670 21.9060 21.9060 k = 0.3444 0.3444 0.3444 ( 1433 PWs) bands (ev): -46.5377 -46.5377 -44.3356 -44.3356 -20.7222 -20.7222 -18.8454 -18.8454 -18.1255 -18.1255 -18.0021 -18.0021 -17.6299 -17.6299 -17.6136 -17.6136 16.4235 16.4235 17.0113 17.0113 17.0543 17.0543 17.8275 17.8275 18.1827 18.1827 18.2544 18.2544 21.7709 21.7709 21.7842 21.7842 21.8760 21.8760 21.9106 21.9106 k = 0.3500 0.3500 0.3500 ( 1442 PWs) bands (ev): -46.5367 -46.5367 -44.3350 -44.3350 -20.7240 -20.7240 -18.8453 -18.8453 -18.1213 -18.1213 -18.0064 -18.0064 -17.6338 -17.6338 -17.6232 -17.6232 16.4190 16.4190 16.9921 16.9921 17.0341 17.0341 17.8880 17.8880 18.2152 18.2152 18.2862 18.2862 21.7856 21.7856 21.7943 21.7943 21.8855 21.8855 21.9161 21.9161 k = 0.3556 0.3556 0.3556 ( 1442 PWs) bands (ev): -46.5358 -46.5358 -44.3344 -44.3344 -20.7256 -20.7256 -18.8448 -18.8448 -18.1168 -18.1168 -18.0101 -18.0101 -17.6384 -17.6384 -17.6329 -17.6329 16.4164 16.4164 16.9739 16.9739 17.0150 17.0150 17.9469 17.9469 18.2460 18.2460 18.3161 18.3161 21.8003 21.8003 21.8048 21.8048 21.8954 21.8954 21.9222 21.9222 k = 0.3611 0.3611 0.3611 ( 1442 PWs) bands (ev): -46.5349 -46.5349 -44.3339 -44.3339 -20.7271 -20.7271 -18.8439 -18.8439 -18.1121 -18.1121 -18.0134 -18.0134 -17.6437 -17.6437 -17.6425 -17.6425 16.4160 16.4160 16.9566 16.9566 16.9971 16.9971 18.0034 18.0034 18.2750 18.2750 18.3442 18.3442 21.8148 21.8148 21.8158 21.8158 21.9055 21.9055 21.9289 21.9289 k = 0.3667 0.3667 0.3667 ( 1442 PWs) bands (ev): -46.5341 -46.5341 -44.3334 -44.3334 -20.7284 -20.7284 -18.8428 -18.8428 -18.1072 -18.1072 -18.0163 -18.0163 -17.6523 -17.6523 -17.6495 -17.6495 16.4181 16.4181 16.9403 16.9403 16.9802 16.9802 18.0571 18.0571 18.3024 18.3024 18.3702 18.3702 21.8272 21.8272 21.8291 21.8291 21.9156 21.9156 21.9360 21.9360 k = 0.3722 0.3722 0.3722 ( 1436 PWs) bands (ev): -46.5333 -46.5333 -44.3328 -44.3328 -20.7296 -20.7296 -18.8414 -18.8414 -18.1021 -18.1021 -18.0187 -18.0187 -17.6621 -17.6621 -17.6560 -17.6560 16.4226 16.4226 16.9250 16.9250 16.9645 16.9645 18.1074 18.1074 18.3285 18.3285 18.3944 18.3944 21.8390 21.8390 21.8434 21.8434 21.9257 21.9257 21.9435 21.9435 k = 0.3778 0.3778 0.3778 ( 1436 PWs) bands (ev): -46.5325 -46.5325 -44.3323 -44.3323 -20.7307 -20.7307 -18.8397 -18.8397 -18.0968 -18.0968 -18.0207 -18.0207 -17.6719 -17.6719 -17.6630 -17.6630 16.4296 16.4296 16.9106 16.9106 16.9497 16.9497 18.1539 18.1539 18.3533 18.3533 18.4167 18.4167 21.8512 21.8512 21.8573 21.8573 21.9355 21.9355 21.9511 21.9511 k = 0.3833 0.3833 0.3833 ( 1436 PWs) bands (ev): -46.5317 -46.5317 -44.3318 -44.3318 -20.7318 -20.7318 -18.8379 -18.8379 -18.0913 -18.0913 -18.0223 -18.0223 -17.6819 -17.6819 -17.6706 -17.6706 16.4391 16.4391 16.8972 16.8972 16.9360 16.9360 18.1962 18.1962 18.3771 18.3771 18.4373 18.4373 21.8637 21.8637 21.8709 21.8709 21.9451 21.9451 21.9589 21.9589 k = 0.3889 0.3889 0.3889 ( 1436 PWs) bands (ev): -46.5310 -46.5310 -44.3314 -44.3314 -20.7327 -20.7327 -18.8359 -18.8359 -18.0856 -18.0856 -18.0234 -18.0234 -17.6918 -17.6918 -17.6787 -17.6787 16.4509 16.4509 16.8847 16.8847 16.9233 16.9233 18.2340 18.2340 18.4001 18.4001 18.4560 18.4560 21.8764 21.8764 21.8843 21.8843 21.9543 21.9543 21.9666 21.9666 k = 0.3944 0.3944 0.3944 ( 1439 PWs) bands (ev): -46.5303 -46.5303 -44.3309 -44.3309 -20.7335 -20.7335 -18.8337 -18.8337 -18.0798 -18.0798 -18.0240 -18.0240 -17.7018 -17.7018 -17.6874 -17.6874 16.4649 16.4649 16.8731 16.8731 16.9117 16.9117 18.2671 18.2671 18.4225 18.4225 18.4731 18.4731 21.8891 21.8891 21.8973 21.8973 21.9632 21.9632 21.9743 21.9743 k = 0.4000 0.4000 0.4000 ( 1433 PWs) bands (ev): -46.5296 -46.5296 -44.3305 -44.3305 -20.7342 -20.7342 -18.8313 -18.8313 -18.0737 -18.0737 -18.0240 -18.0240 -17.7117 -17.7117 -17.6964 -17.6964 16.4811 16.4811 16.8624 16.8624 16.9010 16.9010 18.2955 18.2955 18.4443 18.4443 18.4887 18.4887 21.9019 21.9019 21.9100 21.9100 21.9718 21.9718 21.9819 21.9819 k = 0.4056 0.4056 0.4056 ( 1433 PWs) bands (ev): -46.5290 -46.5290 -44.3301 -44.3301 -20.7348 -20.7348 -18.8288 -18.8288 -18.0675 -18.0675 -18.0237 -18.0237 -17.7217 -17.7217 -17.7058 -17.7058 16.4991 16.4991 16.8526 16.8526 16.8912 16.8912 18.3195 18.3195 18.4652 18.4652 18.5027 18.5027 21.9146 21.9146 21.9222 21.9222 21.9800 21.9800 21.9894 21.9894 k = 0.4111 0.4111 0.4111 ( 1424 PWs) bands (ev): -46.5284 -46.5284 -44.3297 -44.3297 -20.7353 -20.7353 -18.8262 -18.8262 -18.0610 -18.0610 -18.0228 -18.0228 -17.7316 -17.7316 -17.7153 -17.7153 16.5190 16.5190 16.8435 16.8435 16.8823 16.8823 18.3395 18.3395 18.4851 18.4851 18.5153 18.5153 21.9273 21.9273 21.9339 21.9339 21.9878 21.9878 21.9969 21.9969 k = 0.4167 0.4167 0.4167 ( 1424 PWs) bands (ev): -46.5278 -46.5278 -44.3293 -44.3293 -20.7358 -20.7358 -18.8236 -18.8236 -18.0545 -18.0545 -18.0214 -18.0214 -17.7414 -17.7414 -17.7254 -17.7254 16.5401 16.5401 16.8353 16.8353 16.8743 16.8743 18.3559 18.3559 18.5036 18.5036 18.5266 18.5266 21.9394 21.9394 21.9451 21.9451 21.9953 21.9953 22.0038 22.0038 k = 0.4222 0.4222 0.4222 ( 1424 PWs) bands (ev): -46.5273 -46.5273 -44.3289 -44.3289 -20.7362 -20.7362 -18.8210 -18.8210 -18.0478 -18.0478 -18.0196 -18.0196 -17.7512 -17.7512 -17.7356 -17.7356 16.5623 16.5623 16.8278 16.8278 16.8671 16.8671 18.3693 18.3693 18.5204 18.5204 18.5366 18.5366 21.9510 21.9510 21.9558 21.9558 22.0023 22.0023 22.0105 22.0105 k = 0.4278 0.4278 0.4278 ( 1424 PWs) bands (ev): -46.5268 -46.5268 -44.3286 -44.3286 -20.7365 -20.7365 -18.8184 -18.8184 -18.0411 -18.0411 -18.0173 -18.0173 -17.7609 -17.7609 -17.7461 -17.7461 16.5854 16.5854 16.8210 16.8210 16.8606 16.8606 18.3801 18.3801 18.5352 18.5352 18.5455 18.5455 21.9621 21.9621 21.9658 21.9658 22.0090 22.0090 22.0168 22.0168 k = 0.4333 0.4333 0.4333 ( 1430 PWs) bands (ev): -46.5263 -46.5263 -44.3283 -44.3283 -20.7368 -20.7368 -18.8159 -18.8159 -18.0343 -18.0343 -18.0146 -18.0146 -17.7706 -17.7706 -17.7566 -17.7566 16.6088 16.6088 16.8149 16.8149 16.8549 16.8549 18.3888 18.3888 18.5479 18.5479 18.5532 18.5532 21.9726 21.9726 21.9751 21.9751 22.0152 22.0152 22.0228 22.0228 k = 0.4389 0.4389 0.4389 ( 1430 PWs) bands (ev): -46.5259 -46.5259 -44.3280 -44.3280 -20.7370 -20.7370 -18.8134 -18.8134 -18.0275 -18.0275 -18.0114 -18.0114 -17.7800 -17.7800 -17.7672 -17.7672 16.6324 16.6324 16.8094 16.8094 16.8500 16.8500 18.3957 18.3957 18.5586 18.5586 18.5601 18.5601 21.9823 21.9823 21.9839 21.9839 22.0213 22.0213 22.0284 22.0284 k = 0.4444 0.4444 0.4444 ( 1430 PWs) bands (ev): -46.5255 -46.5255 -44.3277 -44.3277 -20.7372 -20.7372 -18.8110 -18.8110 -18.0206 -18.0206 -18.0078 -18.0078 -17.7892 -17.7892 -17.7777 -17.7777 16.6556 16.6556 16.8046 16.8046 16.8458 16.8458 18.4010 18.4010 18.5660 18.5660 18.5674 18.5674 21.9911 21.9911 21.9918 21.9918 22.0270 22.0270 22.0337 22.0337 k = 0.4500 0.4500 0.4500 ( 1430 PWs) bands (ev): -46.5251 -46.5251 -44.3275 -44.3275 -20.7374 -20.7374 -18.8087 -18.8087 -18.0138 -18.0138 -18.0039 -18.0039 -17.7981 -17.7981 -17.7880 -17.7880 16.6781 16.6781 16.8003 16.8003 16.8423 16.8423 18.4052 18.4052 18.5711 18.5711 18.5743 18.5743 21.9990 21.9990 21.9991 21.9991 22.0324 22.0324 22.0385 22.0385 k = 0.4556 0.4556 0.4556 ( 1430 PWs) bands (ev): -46.5248 -46.5248 -44.3273 -44.3273 -20.7375 -20.7375 -18.8066 -18.8066 -18.0072 -18.0072 -17.9997 -17.9997 -17.8067 -17.8067 -17.7981 -17.7981 16.6994 16.6994 16.7966 16.7966 16.8396 16.8396 18.4082 18.4082 18.5755 18.5755 18.5796 18.5796 22.0056 22.0056 22.0060 22.0060 22.0375 22.0375 22.0428 22.0428 k = 0.4611 0.4611 0.4611 ( 1430 PWs) bands (ev): -46.5245 -46.5245 -44.3271 -44.3271 -20.7376 -20.7376 -18.8047 -18.8047 -18.0007 -18.0007 -17.9952 -17.9952 -17.8148 -17.8148 -17.8078 -17.8078 16.7191 16.7191 16.7934 16.7934 16.8376 16.8376 18.4104 18.4104 18.5792 18.5792 18.5834 18.5834 22.0113 22.0113 22.0120 22.0120 22.0423 22.0423 22.0468 22.0468 k = 0.4667 0.4667 0.4667 ( 1430 PWs) bands (ev): -46.5243 -46.5243 -44.3269 -44.3269 -20.7376 -20.7376 -18.8030 -18.8030 -17.9945 -17.9945 -17.9907 -17.9907 -17.8225 -17.8225 -17.8169 -17.8169 16.7367 16.7367 16.7907 16.7907 16.8364 16.8364 18.4118 18.4118 18.5823 18.5823 18.5862 18.5862 22.0163 22.0163 22.0170 22.0170 22.0467 22.0467 22.0502 22.0502 k = 0.4722 0.4722 0.4722 ( 1430 PWs) bands (ev): -46.5241 -46.5241 -44.3268 -44.3268 -20.7377 -20.7377 -18.8015 -18.8015 -17.9888 -17.9888 -17.9863 -17.9863 -17.8294 -17.8294 -17.8253 -17.8253 16.7517 16.7517 16.7885 16.7885 16.8361 16.8361 18.4127 18.4127 18.5848 18.5848 18.5880 18.5880 22.0205 22.0205 22.0211 22.0211 22.0505 22.0505 22.0532 22.0532 k = 0.4778 0.4778 0.4778 ( 1430 PWs) bands (ev): -46.5239 -46.5239 -44.3267 -44.3267 -20.7377 -20.7377 -18.8003 -18.8003 -17.9837 -17.9837 -17.9822 -17.9822 -17.8356 -17.8356 -17.8328 -17.8328 16.7638 16.7638 16.7867 16.7867 16.8365 16.8365 18.4132 18.4132 18.5868 18.5868 18.5891 18.5891 22.0239 22.0239 22.0244 22.0244 22.0539 22.0539 22.0557 22.0557 k = 0.4833 0.4833 0.4833 ( 1430 PWs) bands (ev): -46.5238 -46.5238 -44.3266 -44.3266 -20.7377 -20.7377 -18.7993 -18.7993 -17.9793 -17.9793 -17.9785 -17.9785 -17.8407 -17.8407 -17.8390 -17.8390 16.7729 16.7729 16.7853 16.7853 16.8376 16.8376 18.4135 18.4135 18.5884 18.5884 18.5897 18.5897 22.0265 22.0265 22.0268 22.0268 22.0566 22.0566 22.0576 22.0576 k = 0.4889 0.4889 0.4889 ( 1436 PWs) bands (ev): -46.5237 -46.5237 -44.3265 -44.3265 -20.7378 -20.7378 -18.7987 -18.7987 -17.9762 -17.9762 -17.9757 -17.9757 -17.8446 -17.8446 -17.8438 -17.8438 16.7789 16.7789 16.7843 16.7843 16.8390 16.8390 18.4135 18.4135 18.5894 18.5894 18.5900 18.5900 22.0283 22.0283 22.0284 22.0284 22.0585 22.0585 22.0589 22.0589 k = 0.4944 0.4944 0.4944 ( 1454 PWs) bands (ev): -46.5236 -46.5236 -44.3265 -44.3265 -20.7379 -20.7379 -18.7985 -18.7985 -17.9743 -17.9743 -17.9740 -17.9740 -17.8472 -17.8472 -17.8469 -17.8469 16.7824 16.7824 16.7836 16.7836 16.8400 16.8400 18.4134 18.4134 18.5898 18.5898 18.5901 18.5901 22.0292 22.0292 22.0293 22.0293 22.0596 22.0596 22.0597 22.0597 k = 0.5000 0.5000 0.5000 ( 1472 PWs) bands (ev): -46.5236 -46.5236 -44.3265 -44.3265 -20.7380 -20.7380 -18.7985 -18.7985 -17.9737 -17.9737 -17.9737 -17.9737 -17.8481 -17.8481 -17.8481 -17.8481 16.7834 16.7834 16.7834 16.7834 16.8404 16.8404 18.4132 18.4132 18.5899 18.5899 18.5899 18.5899 22.0293 22.0293 22.0293 22.0293 22.0598 22.0598 22.0598 22.0598 k = 0.5000 0.5000 0.5000 ( 1472 PWs) bands (ev): -46.5236 -46.5236 -44.3265 -44.3265 -20.7380 -20.7380 -18.7985 -18.7985 -17.9737 -17.9737 -17.9737 -17.9737 -17.8481 -17.8481 -17.8481 -17.8481 16.7834 16.7834 16.7834 16.7834 16.8404 16.8404 18.4132 18.4132 18.5899 18.5899 18.5899 18.5899 22.0293 22.0293 22.0293 22.0293 22.0598 22.0598 22.0598 22.0598 k = 0.4932 0.5000 0.4932 ( 1456 PWs) bands (ev): -46.5236 -46.5236 -44.3265 -44.3265 -20.7379 -20.7379 -18.7985 -18.7985 -17.9743 -17.9743 -17.9740 -17.9740 -17.8472 -17.8472 -17.8469 -17.8469 16.7823 16.7823 16.7837 16.7837 16.8400 16.8400 18.4134 18.4134 18.5890 18.5890 18.5909 18.5909 22.0291 22.0291 22.0292 22.0292 22.0594 22.0594 22.0598 22.0598 k = 0.4865 0.5000 0.4865 ( 1444 PWs) bands (ev): -46.5237 -46.5237 -44.3265 -44.3265 -20.7378 -20.7378 -18.7987 -18.7987 -17.9762 -17.9762 -17.9758 -17.9758 -17.8447 -17.8447 -17.8439 -17.8439 16.7789 16.7789 16.7843 16.7843 16.8390 16.8390 18.4133 18.4133 18.5861 18.5861 18.5933 18.5933 22.0280 22.0280 22.0287 22.0287 22.0578 22.0578 22.0595 22.0595 k = 0.4797 0.5000 0.4797 ( 1436 PWs) bands (ev): -46.5238 -46.5238 -44.3266 -44.3266 -20.7378 -20.7378 -18.7994 -18.7994 -17.9792 -17.9792 -17.9787 -17.9787 -17.8407 -17.8407 -17.8393 -17.8393 16.7727 16.7727 16.7854 16.7854 16.8377 16.8377 18.4129 18.4129 18.5813 18.5813 18.5975 18.5975 22.0257 22.0257 22.0276 22.0276 22.0551 22.0551 22.0590 22.0590 k = 0.4730 0.5000 0.4730 ( 1428 PWs) bands (ev): -46.5239 -46.5239 -44.3267 -44.3267 -20.7377 -20.7377 -18.8002 -18.8002 -17.9831 -17.9831 -17.9824 -17.9824 -17.8355 -17.8355 -17.8331 -17.8331 16.7634 16.7634 16.7869 16.7869 16.8368 16.8368 18.4116 18.4116 18.5744 18.5744 18.6037 18.6037 22.0225 22.0225 22.0261 22.0261 22.0513 22.0513 22.0583 22.0583 k = 0.4662 0.5000 0.4662 ( 1428 PWs) bands (ev): -46.5240 -46.5240 -44.3268 -44.3268 -20.7377 -20.7377 -18.8015 -18.8015 -17.9879 -17.9879 -17.9869 -17.9869 -17.8294 -17.8294 -17.8258 -17.8258 16.7508 16.7508 16.7888 16.7888 16.8366 16.8366 18.4089 18.4089 18.5655 18.5655 18.6122 18.6122 22.0184 22.0184 22.0236 22.0236 22.0467 22.0467 22.0572 22.0572 k = 0.4595 0.5000 0.4595 ( 1428 PWs) bands (ev): -46.5243 -46.5243 -44.3269 -44.3269 -20.7376 -20.7376 -18.8029 -18.8029 -17.9930 -17.9930 -17.9919 -17.9919 -17.8223 -17.8223 -17.8176 -17.8176 16.7351 16.7351 16.7911 16.7911 16.8372 16.8372 18.4045 18.4045 18.5548 18.5548 18.6231 18.6231 22.0136 22.0136 22.0202 22.0202 22.0416 22.0416 22.0557 22.0557 k = 0.4527 0.5000 0.4527 ( 1424 PWs) bands (ev): -46.5245 -46.5245 -44.3271 -44.3271 -20.7375 -20.7375 -18.8046 -18.8046 -17.9983 -17.9983 -17.9971 -17.9971 -17.8147 -17.8147 -17.8085 -17.8085 16.7166 16.7166 16.7939 16.7939 16.8388 16.8388 18.3982 18.3982 18.5422 18.5422 18.6366 18.6366 22.0080 22.0080 22.0153 22.0153 22.0365 22.0365 22.0540 22.0540 k = 0.4459 0.5000 0.4459 ( 1424 PWs) bands (ev): -46.5248 -46.5248 -44.3273 -44.3273 -20.7375 -20.7375 -18.8066 -18.8066 -18.0038 -18.0038 -18.0024 -18.0024 -17.8065 -17.8065 -17.7989 -17.7989 16.6955 16.6955 16.7969 16.7969 16.8413 16.8413 18.3896 18.3896 18.5277 18.5277 18.6524 18.6524 22.0015 22.0015 22.0085 22.0085 22.0319 22.0319 22.0520 22.0520 k = 0.4392 0.5000 0.4392 ( 1424 PWs) bands (ev): -46.5251 -46.5251 -44.3275 -44.3275 -20.7374 -20.7374 -18.8087 -18.8087 -18.0093 -18.0093 -18.0078 -18.0078 -17.7979 -17.7979 -17.7889 -17.7889 16.6724 16.6724 16.8003 16.8003 16.8446 16.8446 18.3788 18.3788 18.5115 18.5115 18.6703 18.6703 21.9940 21.9940 21.9999 21.9999 22.0279 22.0279 22.0496 22.0496 k = 0.4324 0.5000 0.4324 ( 1424 PWs) bands (ev): -46.5254 -46.5254 -44.3277 -44.3277 -20.7373 -20.7373 -18.8110 -18.8110 -18.0149 -18.0149 -18.0130 -18.0130 -17.7890 -17.7890 -17.7785 -17.7785 16.6476 16.6476 16.8041 16.8041 16.8486 16.8486 18.3658 18.3658 18.4935 18.4935 18.6900 18.6900 21.9849 21.9849 21.9904 21.9904 22.0245 22.0245 22.0471 22.0471 k = 0.4257 0.5000 0.4257 ( 1424 PWs) bands (ev): -46.5258 -46.5258 -44.3280 -44.3280 -20.7371 -20.7371 -18.8135 -18.8135 -18.0203 -18.0203 -18.0181 -18.0181 -17.7799 -17.7799 -17.7678 -17.7678 16.6214 16.6214 16.8083 16.8083 16.8534 16.8534 18.3508 18.3508 18.4738 18.4738 18.7111 18.7111 21.9732 21.9732 21.9810 21.9810 22.0214 22.0214 22.0444 22.0444 k = 0.4189 0.5000 0.4189 ( 1424 PWs) bands (ev): -46.5262 -46.5262 -44.3282 -44.3282 -20.7370 -20.7370 -18.8161 -18.8161 -18.0256 -18.0256 -18.0229 -18.0229 -17.7707 -17.7707 -17.7570 -17.7570 16.5942 16.5942 16.8128 16.8128 16.8589 16.8589 18.3339 18.3339 18.4525 18.4525 18.7333 18.7333 21.9593 21.9593 21.9716 21.9716 22.0185 22.0185 22.0416 22.0416 k = 0.4122 0.5000 0.4122 ( 1424 PWs) bands (ev): -46.5267 -46.5267 -44.3285 -44.3285 -20.7368 -20.7368 -18.8189 -18.8189 -18.0308 -18.0308 -18.0275 -18.0275 -17.7613 -17.7613 -17.7460 -17.7460 16.5662 16.5662 16.8176 16.8176 16.8652 16.8652 18.3151 18.3151 18.4296 18.4296 18.7562 18.7562 21.9437 21.9437 21.9616 21.9616 22.0157 22.0157 22.0389 22.0389 k = 0.4054 0.5000 0.4054 ( 1424 PWs) bands (ev): -46.5272 -46.5272 -44.3289 -44.3289 -20.7365 -20.7365 -18.8217 -18.8217 -18.0357 -18.0357 -18.0317 -18.0317 -17.7520 -17.7520 -17.7350 -17.7350 16.5378 16.5378 16.8229 16.8229 16.8721 16.8721 18.2947 18.2947 18.4051 18.4051 18.7795 18.7795 21.9265 21.9265 21.9510 21.9510 22.0132 22.0132 22.0363 22.0363 k = 0.3986 0.5000 0.3986 ( 1428 PWs) bands (ev): -46.5277 -46.5277 -44.3292 -44.3292 -20.7362 -20.7362 -18.8246 -18.8246 -18.0405 -18.0405 -18.0356 -18.0356 -17.7426 -17.7426 -17.7241 -17.7241 16.5092 16.5092 16.8285 16.8285 16.8796 16.8796 18.2728 18.2728 18.3791 18.3791 18.8029 18.8029 21.9080 21.9080 21.9395 21.9395 22.0107 22.0107 22.0339 22.0339 k = 0.3919 0.5000 0.3919 ( 1432 PWs) bands (ev): -46.5282 -46.5282 -44.3296 -44.3296 -20.7359 -20.7359 -18.8276 -18.8276 -18.0450 -18.0450 -18.0392 -18.0392 -17.7333 -17.7333 -17.7132 -17.7132 16.4806 16.4806 16.8346 16.8346 16.8877 16.8877 18.2494 18.2494 18.3517 18.3517 18.8261 18.8261 21.8880 21.8880 21.9269 21.9269 22.0084 22.0084 22.0318 22.0318 k = 0.3851 0.5000 0.3851 ( 1430 PWs) bands (ev): -46.5288 -46.5288 -44.3300 -44.3300 -20.7355 -20.7355 -18.8305 -18.8305 -18.0492 -18.0492 -18.0425 -18.0425 -17.7241 -17.7241 -17.7023 -17.7023 16.4524 16.4524 16.8412 16.8412 16.8965 16.8965 18.2249 18.2249 18.3230 18.3230 18.8489 18.8489 21.8667 21.8667 21.9135 21.9135 22.0065 22.0065 22.0302 22.0302 k = 0.3784 0.5000 0.3784 ( 1434 PWs) bands (ev): -46.5294 -46.5294 -44.3304 -44.3304 -20.7351 -20.7351 -18.8335 -18.8335 -18.0531 -18.0531 -18.0454 -18.0454 -17.7150 -17.7150 -17.6917 -17.6917 16.4246 16.4246 16.8483 16.8483 16.9057 16.9057 18.1992 18.1992 18.2930 18.2930 18.8711 18.8711 21.8440 21.8440 21.8988 21.8988 22.0048 22.0048 22.0292 22.0292 k = 0.3716 0.5000 0.3716 ( 1430 PWs) bands (ev): -46.5300 -46.5300 -44.3308 -44.3308 -20.7345 -20.7345 -18.8363 -18.8363 -18.0567 -18.0567 -18.0479 -18.0479 -17.7059 -17.7059 -17.6811 -17.6811 16.3975 16.3975 16.8559 16.8559 16.9154 16.9154 18.1726 18.1726 18.2619 18.2619 18.8925 18.8925 21.8203 21.8203 21.8831 21.8831 22.0037 22.0037 22.0288 22.0288 k = 0.3649 0.5000 0.3649 ( 1430 PWs) bands (ev): -46.5307 -46.5307 -44.3312 -44.3312 -20.7339 -20.7339 -18.8391 -18.8391 -18.0600 -18.0600 -18.0502 -18.0502 -17.6971 -17.6971 -17.6708 -17.6708 16.3712 16.3712 16.8641 16.8641 16.9254 16.9254 18.1452 18.1452 18.2298 18.2298 18.9130 18.9130 21.7951 21.7951 21.8660 21.8660 22.0029 22.0029 22.0291 22.0291 k = 0.3581 0.5000 0.3581 ( 1430 PWs) bands (ev): -46.5314 -46.5314 -44.3317 -44.3317 -20.7332 -20.7332 -18.8418 -18.8418 -18.0629 -18.0629 -18.0520 -18.0520 -17.6885 -17.6885 -17.6607 -17.6607 16.3459 16.3459 16.8729 16.8729 16.9357 16.9357 18.1171 18.1171 18.1967 18.1967 18.9323 18.9323 21.7688 21.7688 21.8475 21.8475 22.0028 22.0028 22.0302 22.0302 k = 0.3514 0.5000 0.3514 ( 1426 PWs) bands (ev): -46.5321 -46.5321 -44.3321 -44.3321 -20.7324 -20.7324 -18.8443 -18.8443 -18.0656 -18.0656 -18.0536 -18.0536 -17.6801 -17.6801 -17.6508 -17.6508 16.3219 16.3219 16.8823 16.8823 16.9461 16.9461 18.0886 18.0886 18.1630 18.1630 18.9504 18.9504 21.7412 21.7412 21.8275 21.8275 22.0032 22.0032 22.0320 22.0320 k = 0.3446 0.5000 0.3446 ( 1426 PWs) bands (ev): -46.5328 -46.5328 -44.3326 -44.3326 -20.7316 -20.7316 -18.8468 -18.8468 -18.0679 -18.0679 -18.0548 -18.0548 -17.6720 -17.6720 -17.6413 -17.6413 16.2990 16.2990 16.8924 16.8924 16.9563 16.9563 18.0597 18.0597 18.1289 18.1289 18.9672 18.9672 21.7125 21.7125 21.8060 21.8060 22.0043 22.0043 22.0346 22.0346 k = 0.3378 0.5000 0.3378 ( 1426 PWs) bands (ev): -46.5336 -46.5336 -44.3331 -44.3331 -20.7307 -20.7307 -18.8490 -18.8490 -18.0699 -18.0699 -18.0558 -18.0558 -17.6641 -17.6641 -17.6321 -17.6321 16.2775 16.2775 16.9033 16.9033 16.9663 16.9663 18.0306 18.0306 18.0945 18.0945 18.9825 18.9825 21.6826 21.6826 21.7829 21.7829 22.0061 22.0061 22.0380 22.0380 k = 0.3311 0.5000 0.3311 ( 1430 PWs) bands (ev): -46.5343 -46.5343 -44.3337 -44.3337 -20.7296 -20.7296 -18.8512 -18.8512 -18.0715 -18.0715 -18.0564 -18.0564 -17.6566 -17.6566 -17.6233 -17.6233 16.2575 16.2575 16.9149 16.9149 16.9757 16.9757 18.0015 18.0015 18.0602 18.0602 18.9964 18.9964 21.6515 21.6515 21.7581 21.7581 22.0085 22.0085 22.0423 22.0423 k = 0.3243 0.5000 0.3243 ( 1430 PWs) bands (ev): -46.5351 -46.5351 -44.3342 -44.3342 -20.7285 -20.7285 -18.8530 -18.8530 -18.0729 -18.0729 -18.0567 -18.0567 -17.6494 -17.6494 -17.6149 -17.6149 16.2391 16.2391 16.9272 16.9272 16.9843 16.9843 17.9724 17.9724 18.0265 18.0265 19.0088 19.0088 21.6194 21.6194 21.7317 21.7317 22.0117 22.0117 22.0475 22.0475 k = 0.3176 0.5000 0.3176 ( 1430 PWs) bands (ev): -46.5359 -46.5359 -44.3347 -44.3347 -20.7273 -20.7273 -18.8547 -18.8547 -18.0738 -18.0738 -18.0568 -18.0568 -17.6426 -17.6426 -17.6068 -17.6068 16.2224 16.2224 16.9404 16.9404 16.9918 16.9918 17.9434 17.9434 17.9940 17.9940 19.0197 19.0197 21.5863 21.5863 21.7035 21.7035 22.0155 22.0155 22.0535 22.0535 k = 0.3108 0.5000 0.3108 ( 1430 PWs) bands (ev): -46.5368 -46.5368 -44.3353 -44.3353 -20.7260 -20.7260 -18.8561 -18.8561 -18.0745 -18.0745 -18.0565 -18.0565 -17.6361 -17.6361 -17.5991 -17.5991 16.2074 16.2074 16.9543 16.9543 16.9977 16.9977 17.9142 17.9142 17.9634 17.9634 19.0290 19.0290 21.5523 21.5523 21.6737 21.6737 22.0200 22.0200 22.0604 22.0604 k = 0.3041 0.5000 0.3041 ( 1430 PWs) bands (ev): -46.5376 -46.5376 -44.3358 -44.3358 -20.7245 -20.7245 -18.8572 -18.8572 -18.0748 -18.0748 -18.0560 -18.0560 -17.6300 -17.6300 -17.5919 -17.5919 16.1942 16.1942 16.9688 16.9688 17.0018 17.0018 17.8846 17.8846 17.9358 17.9358 19.0368 19.0368 21.5172 21.5172 21.6420 21.6420 22.0251 22.0251 22.0681 22.0681 k = 0.2973 0.5000 0.2973 ( 1442 PWs) bands (ev): -46.5385 -46.5385 -44.3364 -44.3364 -20.7231 -20.7231 -18.8582 -18.8582 -18.0750 -18.0750 -18.0553 -18.0553 -17.6243 -17.6243 -17.5851 -17.5851 16.1829 16.1829 16.9833 16.9833 17.0042 17.0042 17.8543 17.8543 17.9120 17.9120 19.0431 19.0431 21.4813 21.4813 21.6085 21.6085 22.0306 22.0306 22.0765 22.0765 k = 0.2905 0.5000 0.2905 ( 1442 PWs) bands (ev): -46.5393 -46.5393 -44.3370 -44.3370 -20.7214 -20.7214 -18.8588 -18.8588 -18.0746 -18.0746 -18.0543 -18.0543 -17.6190 -17.6190 -17.5787 -17.5787 16.1736 16.1736 16.9932 16.9932 17.0091 17.0091 17.8236 17.8236 17.8928 17.8928 19.0479 19.0479 21.4445 21.4445 21.5733 21.5733 22.0367 22.0367 22.0857 22.0857 k = 0.2838 0.5000 0.2838 ( 1442 PWs) bands (ev): -46.5402 -46.5402 -44.3376 -44.3376 -20.7197 -20.7197 -18.8591 -18.8591 -18.0740 -18.0740 -18.0530 -18.0530 -17.6142 -17.6142 -17.5728 -17.5728 16.1662 16.1662 16.9913 16.9913 17.0233 17.0233 17.7926 17.7926 17.8785 17.8785 19.0513 19.0513 21.4070 21.4070 21.5362 21.5362 22.0433 22.0433 22.0955 22.0955 k = 0.2770 0.5000 0.2770 ( 1440 PWs) bands (ev): -46.5411 -46.5411 -44.3382 -44.3382 -20.7178 -20.7178 -18.8590 -18.8590 -18.0730 -18.0730 -18.0515 -18.0515 -17.6098 -17.6098 -17.5674 -17.5674 16.1608 16.1608 16.9826 16.9826 17.0413 17.0413 17.7617 17.7617 17.8694 17.8694 19.0534 19.0534 21.3688 21.3688 21.4973 21.4973 22.0503 22.0503 22.1060 22.1060 k = 0.2703 0.5000 0.2703 ( 1440 PWs) bands (ev): -46.5420 -46.5420 -44.3388 -44.3388 -20.7158 -20.7158 -18.8586 -18.8586 -18.0718 -18.0718 -18.0498 -18.0498 -17.6058 -17.6058 -17.5624 -17.5624 16.1575 16.1575 16.9693 16.9693 17.0610 17.0610 17.7311 17.7311 17.8657 17.8657 19.0542 19.0542 21.3299 21.3299 21.4567 21.4567 22.0574 22.0574 22.1168 22.1168 k = 0.2635 0.5000 0.2635 ( 1440 PWs) bands (ev): -46.5429 -46.5429 -44.3394 -44.3394 -20.7137 -20.7137 -18.8580 -18.8580 -18.0703 -18.0703 -18.0478 -18.0478 -17.6024 -17.6024 -17.5579 -17.5579 16.1563 16.1563 16.9514 16.9514 17.0819 17.0819 17.7010 17.7010 17.8676 17.8676 19.0538 19.0538 21.2904 21.2904 21.4142 21.4142 22.0647 22.0647 22.1280 22.1280 k = 0.2568 0.5000 0.2568 ( 1440 PWs) bands (ev): -46.5438 -46.5438 -44.3400 -44.3400 -20.7115 -20.7115 -18.8570 -18.8570 -18.0685 -18.0685 -18.0457 -18.0457 -17.5994 -17.5994 -17.5539 -17.5539 16.1571 16.1571 16.9293 16.9293 17.1039 17.1039 17.6716 17.6716 17.8750 17.8750 19.0523 19.0523 21.2503 21.2503 21.3699 21.3699 22.0721 22.0721 22.1394 22.1394 k = 0.2500 0.5000 0.2500 ( 1432 PWs) bands (ev): -46.5447 -46.5447 -44.3406 -44.3406 -20.7092 -20.7092 -18.8556 -18.8556 -18.0663 -18.0663 -18.0433 -18.0433 -17.5968 -17.5968 -17.5502 -17.5502 16.1601 16.1601 16.9033 16.9033 17.1271 17.1271 17.6430 17.6430 17.8878 17.8878 19.0498 19.0498 21.2099 21.2099 21.3240 21.3240 22.0795 22.0795 22.1509 22.1509 k = 0.2432 0.5000 0.2432 ( 1448 PWs) bands (ev): -46.5456 -46.5456 -44.3412 -44.3412 -20.7069 -20.7069 -18.8542 -18.8542 -18.0641 -18.0641 -18.0408 -18.0408 -17.5950 -17.5950 -17.5473 -17.5473 16.1649 16.1649 16.8735 16.8735 17.1514 17.1514 17.6150 17.6150 17.9056 17.9056 19.0463 19.0463 21.1689 21.1689 21.2762 21.2762 22.0864 22.0864 22.1621 22.1621 k = 0.2365 0.5000 0.2365 ( 1448 PWs) bands (ev): -46.5465 -46.5465 -44.3418 -44.3418 -20.7044 -20.7044 -18.8523 -18.8523 -18.0614 -18.0614 -18.0381 -18.0381 -17.5936 -17.5936 -17.5446 -17.5446 16.1719 16.1719 16.8406 16.8406 17.1769 17.1769 17.5880 17.5880 17.9284 17.9284 19.0420 19.0420 21.1277 21.1277 21.2268 21.2268 22.0933 22.0933 22.1731 22.1731 k = 0.2297 0.5000 0.2297 ( 1448 PWs) bands (ev): -46.5474 -46.5474 -44.3424 -44.3424 -20.7019 -20.7019 -18.8500 -18.8500 -18.0586 -18.0586 -18.0351 -18.0351 -17.5927 -17.5927 -17.5424 -17.5424 16.1809 16.1809 16.8051 16.8051 17.2035 17.2035 17.5618 17.5618 17.9558 17.9558 19.0371 19.0371 21.0862 21.0862 21.1757 21.1757 22.0996 22.0996 22.1836 22.1836 k = 0.2230 0.5000 0.2230 ( 1448 PWs) bands (ev): -46.5483 -46.5483 -44.3430 -44.3430 -20.6992 -20.6992 -18.8475 -18.8475 -18.0554 -18.0554 -18.0320 -18.0320 -17.5923 -17.5923 -17.5407 -17.5407 16.1919 16.1919 16.7675 16.7675 17.2312 17.2312 17.5367 17.5367 17.9874 17.9874 19.0316 19.0316 21.0445 21.0445 21.1231 21.1231 22.1053 22.1053 22.1934 22.1934 k = 0.2162 0.5000 0.2162 ( 1438 PWs) bands (ev): -46.5492 -46.5492 -44.3436 -44.3436 -20.6964 -20.6964 -18.8445 -18.8445 -18.0520 -18.0520 -18.0286 -18.0286 -17.5924 -17.5924 -17.5393 -17.5393 16.2048 16.2048 16.7281 16.7281 17.2601 17.2601 17.5127 17.5127 18.0229 18.0229 19.0257 19.0257 21.0027 21.0027 21.0690 21.0690 22.1103 22.1103 22.2022 22.2022 k = 0.2095 0.5000 0.2095 ( 1438 PWs) bands (ev): -46.5501 -46.5501 -44.3442 -44.3442 -20.6936 -20.6936 -18.8414 -18.8414 -18.0484 -18.0484 -18.0251 -18.0251 -17.5931 -17.5931 -17.5384 -17.5384 16.2197 16.2197 16.6874 16.6874 17.2898 17.2898 17.4898 17.4898 18.0620 18.0620 19.0194 19.0194 20.9608 20.9608 21.0135 21.0135 22.1141 22.1141 22.2097 22.2097 k = 0.2027 0.5000 0.2027 ( 1442 PWs) bands (ev): -46.5509 -46.5509 -44.3448 -44.3448 -20.6908 -20.6908 -18.8381 -18.8381 -18.0447 -18.0447 -18.0215 -18.0215 -17.5944 -17.5944 -17.5380 -17.5380 16.2363 16.2363 16.6456 16.6456 17.3201 17.3201 17.4685 17.4685 18.1044 18.1044 19.0130 19.0130 20.9186 20.9186 20.9568 20.9568 22.1166 22.1166 22.2155 22.2155 k = 0.1959 0.5000 0.1959 ( 1442 PWs) bands (ev): -46.5518 -46.5518 -44.3454 -44.3454 -20.6879 -20.6879 -18.8344 -18.8344 -18.0408 -18.0408 -18.0176 -18.0176 -17.5961 -17.5961 -17.5379 -17.5379 16.2547 16.2547 16.6034 16.6034 17.3499 17.3499 17.4498 17.4498 18.1500 18.1500 19.0064 19.0064 20.8756 20.8756 20.8997 20.8997 22.1175 22.1175 22.2194 22.2194 k = 0.1892 0.5000 0.1892 ( 1446 PWs) bands (ev): -46.5527 -46.5527 -44.3460 -44.3460 -20.6850 -20.6850 -18.8306 -18.8306 -18.0367 -18.0367 -18.0136 -18.0136 -17.5985 -17.5985 -17.5382 -17.5382 16.2748 16.2748 16.5608 16.5608 17.3749 17.3749 17.4382 17.4382 18.1985 18.1985 18.9999 18.9999 20.8283 20.8283 20.8459 20.8459 22.1165 22.1165 22.2210 22.2210 k = 0.1824 0.5000 0.1824 ( 1444 PWs) bands (ev): -46.5535 -46.5535 -44.3465 -44.3465 -20.6820 -20.6820 -18.8265 -18.8265 -18.0324 -18.0324 -18.0094 -18.0094 -17.6013 -17.6013 -17.5388 -17.5388 16.2964 16.2964 16.5183 16.5183 17.3819 17.3819 17.4468 17.4468 18.2498 18.2498 18.9935 18.9935 20.7717 20.7717 20.8004 20.8004 22.1134 22.1134 22.2199 22.2199 k = 0.1757 0.5000 0.1757 ( 1440 PWs) bands (ev): -46.5543 -46.5543 -44.3471 -44.3471 -20.6789 -20.6789 -18.8221 -18.8221 -18.0280 -18.0280 -18.0049 -18.0049 -17.6047 -17.6047 -17.5398 -17.5398 16.3195 16.3195 16.4760 16.4760 17.3716 17.3716 17.4750 17.4750 18.3037 18.3037 18.9875 18.9875 20.7106 20.7106 20.7589 20.7589 22.1076 22.1076 22.2155 22.2155 k = 0.1689 0.5000 0.1689 ( 1434 PWs) bands (ev): -46.5551 -46.5551 -44.3476 -44.3476 -20.6759 -20.6759 -18.8175 -18.8175 -18.0233 -18.0233 -18.0003 -18.0003 -17.6085 -17.6085 -17.5410 -17.5410 16.3438 16.3438 16.4344 16.4344 17.3565 17.3565 17.5101 17.5101 18.3601 18.3601 18.9818 18.9818 20.6476 20.6476 20.7185 20.7185 22.0990 22.0990 22.2075 22.2075 k = 0.1622 0.5000 0.1622 ( 1434 PWs) bands (ev): -46.5559 -46.5559 -44.3482 -44.3482 -20.6728 -20.6728 -18.8129 -18.8129 -18.0187 -18.0187 -17.9955 -17.9955 -17.6129 -17.6129 -17.5426 -17.5426 16.3671 16.3671 16.3955 16.3955 17.3408 17.3408 17.5482 17.5482 18.4188 18.4188 18.9767 18.9767 20.5833 20.5833 20.6790 20.6790 22.0866 22.0866 22.1951 22.1951 k = 0.1554 0.5000 0.1554 ( 1442 PWs) bands (ev): -46.5567 -46.5567 -44.3487 -44.3487 -20.6698 -20.6698 -18.8082 -18.8082 -18.0141 -18.0141 -17.9906 -17.9906 -17.6178 -17.6178 -17.5445 -17.5445 16.3495 16.3495 16.3993 16.3993 17.3252 17.3252 17.5881 17.5881 18.4797 18.4797 18.9721 18.9721 20.5178 20.5178 20.6403 20.6403 22.0700 22.0700 22.1778 22.1778 k = 0.1486 0.5000 0.1486 ( 1446 PWs) bands (ev): -46.5574 -46.5574 -44.3492 -44.3492 -20.6669 -20.6669 -18.8034 -18.8034 -18.0094 -18.0094 -17.9854 -17.9854 -17.6232 -17.6232 -17.5467 -17.5467 16.3108 16.3108 16.4262 16.4262 17.3103 17.3103 17.6296 17.6296 18.5429 18.5429 18.9683 18.9683 20.4515 20.4515 20.6025 20.6025 22.0490 22.0490 22.1553 22.1553 k = 0.1419 0.5000 0.1419 ( 1446 PWs) bands (ev): -46.5582 -46.5582 -44.3497 -44.3497 -20.6639 -20.6639 -18.7984 -18.7984 -18.0046 -18.0046 -17.9800 -17.9800 -17.6290 -17.6290 -17.5490 -17.5490 16.2724 16.2724 16.4547 16.4547 17.2962 17.2962 17.6725 17.6725 18.6082 18.6082 18.9654 18.9654 20.3844 20.3844 20.5656 20.5656 22.0230 22.0230 22.1270 22.1270 k = 0.1351 0.5000 0.1351 ( 1442 PWs) bands (ev): -46.5588 -46.5588 -44.3501 -44.3501 -20.6609 -20.6609 -18.7933 -18.7933 -17.9997 -17.9997 -17.9743 -17.9743 -17.6352 -17.6352 -17.5516 -17.5516 16.2350 16.2350 16.4840 16.4840 17.2828 17.2828 17.7169 17.7169 18.6756 18.6756 18.9634 18.9634 20.3165 20.3165 20.5297 20.5297 21.9917 21.9917 22.0926 22.0926 k = 0.1284 0.5000 0.1284 ( 1442 PWs) bands (ev): -46.5595 -46.5595 -44.3506 -44.3506 -20.6580 -20.6580 -18.7883 -18.7883 -17.9949 -17.9949 -17.9684 -17.9684 -17.6418 -17.6418 -17.5543 -17.5543 16.1988 16.1988 16.5138 16.5138 17.2703 17.2703 17.7626 17.7626 18.7448 18.7448 18.9624 18.9624 20.2481 20.2481 20.4948 20.4948 21.9547 21.9547 22.0516 22.0516 k = 0.1216 0.5000 0.1216 ( 1442 PWs) bands (ev): -46.5602 -46.5602 -44.3510 -44.3510 -20.6551 -20.6551 -18.7832 -18.7832 -17.9902 -17.9902 -17.9624 -17.9624 -17.6488 -17.6488 -17.5572 -17.5572 16.1640 16.1640 16.5440 16.5440 17.2585 17.2585 17.8095 17.8095 18.8159 18.8159 18.9624 18.9624 20.1792 20.1792 20.4612 20.4612 21.9122 21.9122 22.0040 22.0040 k = 0.1149 0.5000 0.1149 ( 1434 PWs) bands (ev): -46.5608 -46.5608 -44.3515 -44.3515 -20.6523 -20.6523 -18.7781 -18.7781 -17.9854 -17.9854 -17.9560 -17.9560 -17.6562 -17.6562 -17.5602 -17.5602 16.1307 16.1307 16.5742 16.5742 17.2476 17.2476 17.8576 17.8576 18.8889 18.8889 18.9637 18.9637 20.1099 20.1099 20.4288 20.4288 21.8644 21.8644 21.9500 21.9500 k = 0.1081 0.5000 0.1081 ( 1434 PWs) bands (ev): -46.5614 -46.5614 -44.3519 -44.3519 -20.6496 -20.6496 -18.7731 -18.7731 -17.9808 -17.9808 -17.9494 -17.9494 -17.6639 -17.6639 -17.5633 -17.5633 16.0988 16.0988 16.6043 16.6043 17.2375 17.2375 17.9070 17.9070 18.9634 18.9634 18.9661 18.9661 20.0403 20.0403 20.3977 20.3977 21.8116 21.8116 21.8898 21.8898 k = 0.1014 0.5000 0.1014 ( 1434 PWs) bands (ev): -46.5619 -46.5619 -44.3522 -44.3522 -20.6470 -20.6470 -18.7683 -18.7683 -17.9762 -17.9762 -17.9427 -17.9427 -17.6719 -17.6719 -17.5665 -17.5665 16.0685 16.0685 16.6340 16.6340 17.2281 17.2281 17.9574 17.9574 18.9697 18.9697 19.0396 19.0396 19.9705 19.9705 20.3680 20.3680 21.7547 21.7547 21.8239 21.8239 k = 0.0946 0.5000 0.0946 ( 1434 PWs) bands (ev): -46.5625 -46.5625 -44.3526 -44.3526 -20.6446 -20.6446 -18.7636 -18.7636 -17.9718 -17.9718 -17.9357 -17.9357 -17.6802 -17.6802 -17.5697 -17.5697 16.0400 16.0400 16.6632 16.6632 17.2195 17.2195 18.0090 18.0090 18.9744 18.9744 19.1171 19.1171 19.9007 19.9007 20.3398 20.3398 21.6943 21.6943 21.7533 21.7533 k = 0.0878 0.5000 0.0878 ( 1430 PWs) bands (ev): -46.5630 -46.5630 -44.3529 -44.3529 -20.6422 -20.6422 -18.7590 -18.7590 -17.9675 -17.9675 -17.9285 -17.9285 -17.6888 -17.6888 -17.5729 -17.5729 16.0131 16.0131 16.6916 16.6916 17.2116 17.2116 18.0617 18.0617 18.9803 18.9803 19.1960 19.1960 19.8311 19.8311 20.3131 20.3131 21.6311 21.6311 21.6789 21.6789 k = 0.0811 0.5000 0.0811 ( 1438 PWs) bands (ev): -46.5634 -46.5634 -44.3533 -44.3533 -20.6400 -20.6400 -18.7547 -18.7547 -17.9635 -17.9635 -17.9211 -17.9211 -17.6976 -17.6976 -17.5761 -17.5761 15.9881 15.9881 16.7188 16.7188 17.2044 17.2044 18.1152 18.1152 18.9871 18.9871 19.2757 19.2757 19.7619 19.7619 20.2882 20.2882 21.5644 21.5644 21.6027 21.6027 k = 0.0743 0.5000 0.0743 ( 1438 PWs) bands (ev): -46.5639 -46.5639 -44.3536 -44.3536 -20.6379 -20.6379 -18.7506 -18.7506 -17.9596 -17.9596 -17.9136 -17.9136 -17.7066 -17.7066 -17.5792 -17.5792 15.9649 15.9649 16.7449 16.7449 17.1979 17.1979 18.1697 18.1697 18.9949 18.9949 19.3560 19.3560 19.6937 19.6937 20.2649 20.2649 21.4926 21.4926 21.5288 21.5288 k = 0.0676 0.5000 0.0676 ( 1432 PWs) bands (ev): -46.5642 -46.5642 -44.3538 -44.3538 -20.6359 -20.6359 -18.7466 -18.7466 -17.9558 -17.9558 -17.9057 -17.9057 -17.7157 -17.7157 -17.5821 -17.5821 15.9435 15.9435 16.7696 16.7696 17.1921 17.1921 18.2250 18.2250 19.0035 19.0035 19.4351 19.4351 19.6283 19.6283 20.2436 20.2436 21.4135 21.4135 21.4612 21.4612 k = 0.0608 0.5000 0.0608 ( 1432 PWs) bands (ev): -46.5646 -46.5646 -44.3541 -44.3541 -20.6341 -20.6341 -18.7430 -18.7430 -17.9524 -17.9524 -17.8978 -17.8978 -17.7249 -17.7249 -17.5850 -17.5850 15.9241 15.9241 16.7926 16.7926 17.1869 17.1869 18.2809 18.2809 19.0124 19.0124 19.4981 19.4981 19.5803 19.5803 20.2240 20.2240 21.3290 21.3290 21.3992 21.3992 k = 0.0541 0.5000 0.0541 ( 1432 PWs) bands (ev): -46.5649 -46.5649 -44.3543 -44.3543 -20.6325 -20.6325 -18.7397 -18.7397 -17.9492 -17.9492 -17.8897 -17.8897 -17.7342 -17.7342 -17.5876 -17.5876 15.9067 15.9067 16.8137 16.8137 17.1823 17.1823 18.3372 18.3372 19.0214 19.0214 19.4732 19.4732 19.6217 19.6217 20.2064 20.2064 21.2419 21.2419 21.3418 21.3418 k = 0.0473 0.5000 0.0473 ( 1438 PWs) bands (ev): -46.5652 -46.5652 -44.3545 -44.3545 -20.6311 -20.6311 -18.7368 -18.7368 -17.9464 -17.9464 -17.8816 -17.8816 -17.7437 -17.7437 -17.5901 -17.5901 15.8912 15.8912 16.8328 16.8328 17.1783 17.1783 18.3937 18.3937 19.0301 19.0301 19.4130 19.4130 19.6996 19.6996 20.1907 20.1907 21.1539 21.1539 21.2892 21.2892 k = 0.0405 0.5000 0.0405 ( 1434 PWs) bands (ev): -46.5655 -46.5655 -44.3547 -44.3547 -20.6298 -20.6298 -18.7341 -18.7341 -17.9438 -17.9438 -17.8732 -17.8732 -17.7529 -17.7529 -17.5923 -17.5923 15.8777 15.8777 16.8497 16.8497 17.1749 17.1749 18.4500 18.4500 19.0379 19.0379 19.3513 19.3513 19.7806 19.7806 20.1774 20.1774 21.0664 21.0664 21.2418 21.2418 k = 0.0338 0.5000 0.0338 ( 1434 PWs) bands (ev): -46.5657 -46.5657 -44.3548 -44.3548 -20.6287 -20.6287 -18.7319 -18.7319 -17.9415 -17.9415 -17.8649 -17.8649 -17.7621 -17.7621 -17.5942 -17.5942 15.8663 15.8663 16.8642 16.8642 17.1721 17.1721 18.5054 18.5054 19.0440 19.0440 19.2919 19.2919 19.8607 19.8607 20.1662 20.1662 20.9806 20.9806 21.2002 21.2002 k = 0.0270 0.5000 0.0270 ( 1422 PWs) bands (ev): -46.5658 -46.5658 -44.3549 -44.3549 -20.6277 -20.6277 -18.7298 -18.7298 -17.9396 -17.9396 -17.8566 -17.8566 -17.7710 -17.7710 -17.5958 -17.5958 15.8569 15.8569 16.8764 16.8764 17.1699 17.1699 18.5590 18.5590 19.0471 19.0471 19.2375 19.2375 19.9376 19.9376 20.1578 20.1578 20.8986 20.8986 21.1652 21.1652 k = 0.0203 0.5000 0.0203 ( 1422 PWs) bands (ev): -46.5660 -46.5660 -44.3550 -44.3550 -20.6270 -20.6270 -18.7284 -18.7284 -17.9381 -17.9381 -17.8487 -17.8487 -17.7795 -17.7795 -17.5971 -17.5971 15.8496 15.8496 16.8859 16.8859 17.1681 17.1681 18.6089 18.6089 19.0451 19.0451 19.1915 19.1915 20.0074 20.0074 20.1526 20.1526 20.8231 20.8231 21.1373 21.1373 k = 0.0135 0.5000 0.0135 ( 1422 PWs) bands (ev): -46.5661 -46.5661 -44.3551 -44.3551 -20.6265 -20.6265 -18.7273 -18.7273 -17.9370 -17.9370 -17.8415 -17.8415 -17.7872 -17.7872 -17.5980 -17.5980 15.8444 15.8444 16.8927 16.8927 17.1668 17.1668 18.6518 18.6518 19.0365 19.0365 19.1589 19.1589 20.0635 20.0635 20.1527 20.1527 20.7590 20.7590 21.1169 21.1169 k = 0.0068 0.5000 0.0068 ( 1422 PWs) bands (ev): -46.5661 -46.5661 -44.3551 -44.3551 -20.6262 -20.6262 -18.7267 -18.7267 -17.9364 -17.9364 -17.8360 -17.8360 -17.7929 -17.7929 -17.5985 -17.5985 15.8413 15.8413 16.8968 16.8968 17.1660 17.1660 18.6824 18.6824 19.0242 19.0242 19.1415 19.1415 20.0959 20.0959 20.1606 20.1606 20.7139 20.7139 21.1045 21.1045 k = 0.0000 0.5000-0.0000 ( 1422 PWs) bands (ev): -46.5662 -46.5662 -44.3551 -44.3551 -20.6261 -20.6261 -18.7265 -18.7265 -17.9362 -17.9362 -17.8338 -17.8338 -17.7953 -17.7953 -17.5987 -17.5987 15.8402 15.8402 16.8982 16.8982 17.1658 17.1658 18.6938 18.6938 19.0182 19.0182 19.1365 19.1365 20.1046 20.1046 20.1670 20.1670 20.6973 20.6973 21.1004 21.1004 k = 0.5000 0.5000-0.0000 ( 1452 PWs) bands (ev): -46.5445 -46.5445 -44.3403 -44.3403 -20.7431 -20.7431 -18.9651 -18.9651 -18.1111 -18.1111 -18.0359 -18.0359 -17.4776 -17.4776 -17.4583 -17.4583 15.0116 15.0116 15.4824 15.4824 17.2068 17.2068 17.2539 17.2539 21.4325 21.4325 21.4674 21.4674 21.5688 21.5688 21.6467 21.6467 21.9579 21.9579 21.9655 21.9655 k = 0.5000 0.5000 0.0096 ( 1452 PWs) bands (ev): -46.5444 -46.5444 -44.3403 -44.3403 -20.7431 -20.7431 -18.9650 -18.9650 -18.1111 -18.1111 -18.0360 -18.0360 -17.4779 -17.4779 -17.4585 -17.4585 15.0130 15.0130 15.4846 15.4846 17.2063 17.2063 17.2534 17.2534 21.4246 21.4246 21.4683 21.4683 21.5692 21.5692 21.6384 21.6384 21.9581 21.9581 21.9656 21.9656 k = 0.5000 0.5000 0.0192 ( 1452 PWs) bands (ev): -46.5444 -46.5444 -44.3403 -44.3403 -20.7431 -20.7431 -18.9645 -18.9645 -18.1110 -18.1110 -18.0362 -18.0362 -17.4785 -17.4785 -17.4593 -17.4593 15.0172 15.0172 15.4914 15.4914 17.2049 17.2049 17.2520 17.2520 21.4019 21.4019 21.4703 21.4703 21.5704 21.5704 21.6139 21.6139 21.9586 21.9586 21.9658 21.9658 k = 0.5000 0.5000 0.0288 ( 1440 PWs) bands (ev): -46.5443 -46.5443 -44.3402 -44.3402 -20.7430 -20.7430 -18.9637 -18.9637 -18.1109 -18.1109 -18.0362 -18.0362 -17.4795 -17.4795 -17.4605 -17.4605 15.0243 15.0243 15.5027 15.5027 17.2028 17.2028 17.2498 17.2498 21.3662 21.3662 21.4730 21.4730 21.5722 21.5722 21.5751 21.5751 21.9595 21.9595 21.9661 21.9661 k = 0.5000 0.5000 0.0385 ( 1440 PWs) bands (ev): -46.5441 -46.5441 -44.3401 -44.3401 -20.7429 -20.7429 -18.9626 -18.9626 -18.1108 -18.1108 -18.0367 -18.0367 -17.4811 -17.4811 -17.4622 -17.4622 15.0341 15.0341 15.5184 15.5184 17.1996 17.1996 17.2466 17.2466 21.3186 21.3186 21.4761 21.4761 21.5225 21.5225 21.5754 21.5754 21.9605 21.9605 21.9666 21.9666 k = 0.5000 0.5000 0.0481 ( 1428 PWs) bands (ev): -46.5440 -46.5440 -44.3400 -44.3400 -20.7427 -20.7427 -18.9611 -18.9611 -18.1106 -18.1106 -18.0371 -18.0371 -17.4829 -17.4829 -17.4644 -17.4644 15.0466 15.0466 15.5386 15.5386 17.1958 17.1958 17.2427 17.2427 21.2610 21.2610 21.4597 21.4597 21.4800 21.4800 21.5789 21.5789 21.9617 21.9617 21.9673 21.9673 k = 0.5000 0.5000 0.0577 ( 1428 PWs) bands (ev): -46.5438 -46.5438 -44.3399 -44.3399 -20.7426 -20.7426 -18.9595 -18.9595 -18.1104 -18.1104 -18.0378 -18.0378 -17.4853 -17.4853 -17.4671 -17.4671 15.0619 15.0619 15.5632 15.5632 17.1909 17.1909 17.2378 17.2378 21.1949 21.1949 21.3882 21.3882 21.4845 21.4845 21.5832 21.5832 21.9630 21.9630 21.9679 21.9679 k = 0.5000 0.5000 0.0673 ( 1432 PWs) bands (ev): -46.5435 -46.5435 -44.3397 -44.3397 -20.7425 -20.7425 -18.9576 -18.9576 -18.1102 -18.1102 -18.0386 -18.0386 -17.4881 -17.4881 -17.4704 -17.4704 15.0798 15.0798 15.5921 15.5921 17.1851 17.1851 17.2319 17.2319 21.1220 21.1220 21.3098 21.3098 21.4897 21.4897 21.5883 21.5883 21.9645 21.9645 21.9687 21.9687 k = 0.5000 0.5000 0.0769 ( 1432 PWs) bands (ev): -46.5432 -46.5432 -44.3395 -44.3395 -20.7423 -20.7423 -18.9554 -18.9554 -18.1100 -18.1100 -18.0395 -18.0395 -17.4913 -17.4913 -17.4741 -17.4741 15.1004 15.1004 15.6254 15.6254 17.1786 17.1786 17.2253 17.2253 21.0437 21.0437 21.2262 21.2262 21.4958 21.4958 21.5941 21.5941 21.9661 21.9661 21.9696 21.9696 k = 0.5000 0.5000 0.0865 ( 1424 PWs) bands (ev): -46.5429 -46.5429 -44.3393 -44.3393 -20.7421 -20.7421 -18.9528 -18.9528 -18.1096 -18.1096 -18.0404 -18.0404 -17.4949 -17.4949 -17.4782 -17.4782 15.1236 15.1236 15.6628 15.6628 17.1714 17.1714 17.2179 17.2179 20.9613 20.9613 21.1388 21.1388 21.5026 21.5026 21.6008 21.6008 21.9680 21.9680 21.9708 21.9708 k = 0.5000 0.5000 0.0962 ( 1424 PWs) bands (ev): -46.5426 -46.5426 -44.3391 -44.3391 -20.7419 -20.7419 -18.9501 -18.9501 -18.1093 -18.1093 -18.0414 -18.0414 -17.4989 -17.4989 -17.4829 -17.4829 15.1493 15.1493 15.7045 15.7045 17.1634 17.1634 17.2098 17.2098 20.8758 20.8758 21.0485 21.0485 21.5101 21.5101 21.6081 21.6081 21.9700 21.9700 21.9719 21.9719 k = 0.5000 0.5000 0.1058 ( 1424 PWs) bands (ev): -46.5422 -46.5422 -44.3389 -44.3389 -20.7417 -20.7417 -18.9471 -18.9471 -18.1089 -18.1089 -18.0425 -18.0425 -17.5034 -17.5034 -17.4880 -17.4880 15.1776 15.1776 15.7502 15.7502 17.1547 17.1547 17.2010 17.2010 20.7880 20.7880 20.9564 20.9564 21.5183 21.5183 21.6160 21.6160 21.9721 21.9721 21.9730 21.9730 k = 0.5000 0.5000 0.1154 ( 1428 PWs) bands (ev): -46.5418 -46.5418 -44.3386 -44.3386 -20.7415 -20.7415 -18.9439 -18.9439 -18.1084 -18.1084 -18.0436 -18.0436 -17.5083 -17.5083 -17.4936 -17.4936 15.2082 15.2082 15.7998 15.7998 17.1454 17.1454 17.1914 17.1914 20.6988 20.6988 20.8630 20.8630 21.5272 21.5272 21.6246 21.6246 21.9743 21.9743 21.9743 21.9743 k = 0.5000 0.5000 0.1250 ( 1428 PWs) bands (ev): -46.5414 -46.5414 -44.3383 -44.3383 -20.7413 -20.7413 -18.9404 -18.9404 -18.1078 -18.1078 -18.0448 -18.0448 -17.5136 -17.5136 -17.4995 -17.4995 15.2411 15.2411 15.8534 15.8534 17.1355 17.1355 17.1813 17.1813 20.6086 20.6086 20.7691 20.7691 21.5368 21.5368 21.6338 21.6338 21.9756 21.9756 21.9767 21.9767 k = 0.5000 0.5000 0.1346 ( 1420 PWs) bands (ev): -46.5409 -46.5409 -44.3380 -44.3380 -20.7410 -20.7410 -18.9366 -18.9366 -18.1071 -18.1071 -18.0458 -18.0458 -17.5192 -17.5192 -17.5059 -17.5059 15.2764 15.2764 15.9106 15.9106 17.1251 17.1251 17.1707 17.1707 20.5182 20.5182 20.6750 20.6750 21.5472 21.5472 21.6436 21.6436 21.9771 21.9771 21.9792 21.9792 k = 0.5000 0.5000 0.1442 ( 1428 PWs) bands (ev): -46.5404 -46.5404 -44.3377 -44.3377 -20.7408 -20.7408 -18.9328 -18.9328 -18.1064 -18.1064 -18.0471 -18.0471 -17.5253 -17.5253 -17.5127 -17.5127 15.3137 15.3137 15.9716 15.9716 17.1141 17.1141 17.1595 17.1595 20.4276 20.4276 20.5812 20.5812 21.5581 21.5581 21.6538 21.6538 21.9786 21.9786 21.9818 21.9818 k = 0.5000 0.5000 0.1538 ( 1428 PWs) bands (ev): -46.5399 -46.5399 -44.3373 -44.3373 -20.7406 -20.7406 -18.9287 -18.9287 -18.1055 -18.1055 -18.0483 -18.0483 -17.5317 -17.5317 -17.5199 -17.5199 15.3532 15.3532 16.0360 16.0360 17.1028 17.1028 17.1478 17.1478 20.3374 20.3374 20.4880 20.4880 21.5697 21.5697 21.6647 21.6647 21.9802 21.9802 21.9846 21.9846 k = 0.5000 0.5000 0.1635 ( 1428 PWs) bands (ev): -46.5394 -46.5394 -44.3370 -44.3370 -20.7404 -20.7404 -18.9244 -18.9244 -18.1045 -18.1045 -18.0494 -18.0494 -17.5384 -17.5384 -17.5274 -17.5274 15.3946 15.3946 16.1037 16.1037 17.0911 17.0911 17.1358 17.1358 20.2479 20.2479 20.3957 20.3957 21.5819 21.5819 21.6761 21.6761 21.9818 21.9818 21.9875 21.9875 k = 0.5000 0.5000 0.1731 ( 1428 PWs) bands (ev): -46.5389 -46.5389 -44.3366 -44.3366 -20.7401 -20.7401 -18.9200 -18.9200 -18.1034 -18.1034 -18.0504 -18.0504 -17.5455 -17.5455 -17.5353 -17.5353 15.4379 15.4379 16.1746 16.1746 17.0791 17.0791 17.1234 17.1234 20.1593 20.1593 20.3045 20.3045 21.5947 21.5947 21.6879 21.6879 21.9835 21.9835 21.9904 21.9904 k = 0.5000 0.5000 0.1827 ( 1428 PWs) bands (ev): -46.5383 -46.5383 -44.3363 -44.3363 -20.7399 -20.7399 -18.9154 -18.9154 -18.1021 -18.1021 -18.0514 -18.0514 -17.5530 -17.5530 -17.5436 -17.5436 15.4828 15.4828 16.2484 16.2484 17.0669 17.0669 17.1107 17.1107 20.0719 20.0719 20.2146 20.2146 21.6081 21.6081 21.7001 21.7001 21.9853 21.9853 21.9935 21.9935 k = 0.5000 0.5000 0.1923 ( 1428 PWs) bands (ev): -46.5377 -46.5377 -44.3359 -44.3359 -20.7397 -20.7397 -18.9107 -18.9107 -18.1007 -18.1007 -18.0523 -18.0523 -17.5607 -17.5607 -17.5522 -17.5522 15.5294 15.5294 16.3250 16.3250 17.0545 17.0545 17.0977 17.0977 19.9858 19.9858 20.1262 20.1262 21.6221 21.6221 21.7127 21.7127 21.9871 21.9871 21.9967 21.9967 k = 0.5000 0.5000 0.2019 ( 1436 PWs) bands (ev): -46.5371 -46.5371 -44.3355 -44.3355 -20.7395 -20.7395 -18.9059 -18.9059 -18.0992 -18.0992 -18.0533 -18.0533 -17.5688 -17.5688 -17.5611 -17.5611 15.5774 15.5774 16.4042 16.4042 17.0421 17.0421 17.0846 17.0846 19.9011 19.9011 20.0394 20.0394 21.6363 21.6363 21.7252 21.7252 21.9889 21.9889 21.9999 21.9999 k = 0.5000 0.5000 0.2115 ( 1436 PWs) bands (ev): -46.5365 -46.5365 -44.3351 -44.3351 -20.7393 -20.7393 -18.9010 -18.9010 -18.0974 -18.0974 -18.0539 -18.0539 -17.5772 -17.5772 -17.5703 -17.5703 15.6268 15.6268 16.4856 16.4856 17.0297 17.0297 17.0714 17.0714 19.8181 19.8181 19.9544 19.9544 21.6512 21.6512 21.7384 21.7384 21.9908 21.9908 22.0032 22.0032 k = 0.5000 0.5000 0.2212 ( 1436 PWs) bands (ev): -46.5359 -46.5359 -44.3347 -44.3347 -20.7391 -20.7391 -18.8960 -18.8960 -18.0955 -18.0955 -18.0544 -18.0544 -17.5859 -17.5859 -17.5797 -17.5797 15.6773 15.6773 16.5689 16.5689 17.0176 17.0176 17.0580 17.0580 19.7368 19.7368 19.8712 19.8712 21.6666 21.6666 21.7517 21.7517 21.9927 21.9927 22.0065 22.0065 k = 0.5000 0.5000 0.2308 ( 1436 PWs) bands (ev): -46.5353 -46.5353 -44.3342 -44.3342 -20.7389 -20.7389 -18.8910 -18.8910 -18.0934 -18.0934 -18.0547 -18.0547 -17.5949 -17.5949 -17.5894 -17.5894 15.7289 15.7289 16.6536 16.6536 17.0061 17.0061 17.0447 17.0447 19.6574 19.6574 19.7901 19.7901 21.6823 21.6823 21.7652 21.7652 21.9947 21.9947 22.0099 22.0099 k = 0.5000 0.5000 0.2404 ( 1436 PWs) bands (ev): -46.5347 -46.5347 -44.3338 -44.3338 -20.7387 -20.7387 -18.8859 -18.8859 -18.0910 -18.0910 -18.0548 -18.0548 -17.6041 -17.6041 -17.5994 -17.5994 15.7813 15.7813 16.7389 16.7389 16.9958 16.9958 17.0314 17.0314 19.5800 19.5800 19.7111 19.7111 21.6985 21.6985 21.7789 21.7789 21.9966 21.9966 22.0133 22.0133 k = 0.5000 0.5000 0.2500 ( 1436 PWs) bands (ev): -46.5340 -46.5340 -44.3334 -44.3334 -20.7385 -20.7385 -18.8808 -18.8808 -18.0885 -18.0885 -18.0547 -18.0547 -17.6136 -17.6136 -17.6095 -17.6095 15.8344 15.8344 16.8222 16.8222 16.9890 16.9890 17.0182 17.0182 19.5047 19.5047 19.6342 19.6342 21.7150 21.7150 21.7926 21.7926 21.9986 21.9986 22.0167 22.0167 k = 0.5000 0.5000 0.2596 ( 1436 PWs) bands (ev): -46.5334 -46.5334 -44.3330 -44.3330 -20.7384 -20.7384 -18.8757 -18.8757 -18.0857 -18.0857 -18.0544 -18.0544 -17.6233 -17.6233 -17.6199 -17.6199 15.8880 15.8880 16.8932 16.8932 16.9959 16.9959 17.0052 17.0052 19.4315 19.4315 19.5596 19.5596 21.7317 21.7317 21.8063 21.8063 22.0005 22.0005 22.0201 22.0201 k = 0.5000 0.5000 0.2692 ( 1436 PWs) bands (ev): -46.5328 -46.5328 -44.3326 -44.3326 -20.7382 -20.7382 -18.8706 -18.8706 -18.0827 -18.0827 -18.0538 -18.0538 -17.6332 -17.6332 -17.6304 -17.6304 15.9420 15.9420 16.9233 16.9233 16.9924 16.9924 17.0447 17.0447 19.3606 19.3606 19.4873 19.4873 21.7488 21.7488 21.8200 21.8200 22.0025 22.0025 22.0235 22.0235 k = 0.5000 0.5000 0.2788 ( 1444 PWs) bands (ev): -46.5322 -46.5322 -44.3322 -44.3322 -20.7381 -20.7381 -18.8656 -18.8656 -18.0796 -18.0796 -18.0530 -18.0530 -17.6434 -17.6434 -17.6412 -17.6412 15.9960 15.9960 16.9229 16.9229 16.9796 16.9796 17.1246 17.1246 19.2919 19.2919 19.4173 19.4173 21.7660 21.7660 21.8336 21.8336 22.0044 22.0044 22.0268 22.0268 k = 0.5000 0.5000 0.2885 ( 1436 PWs) bands (ev): -46.5315 -46.5315 -44.3318 -44.3318 -20.7380 -20.7380 -18.8605 -18.8605 -18.0761 -18.0761 -18.0518 -18.0518 -17.6536 -17.6536 -17.6519 -17.6519 16.0500 16.0500 16.9154 16.9154 16.9674 16.9674 17.2125 17.2125 19.2257 19.2257 19.3500 19.3500 21.7835 21.7835 21.8471 21.8471 22.0065 22.0065 22.0301 22.0301 k = 0.5000 0.5000 0.2981 ( 1436 PWs) bands (ev): -46.5309 -46.5309 -44.3314 -44.3314 -20.7379 -20.7379 -18.8556 -18.8556 -18.0724 -18.0724 -18.0503 -18.0503 -17.6641 -17.6641 -17.6629 -17.6629 16.1038 16.1038 16.9059 16.9059 16.9554 16.9554 17.3024 17.3024 19.1620 19.1620 19.2851 19.2851 21.8010 21.8010 21.8604 21.8604 22.0084 22.0084 22.0334 22.0334 k = 0.5000 0.5000 0.3077 ( 1436 PWs) bands (ev): -46.5303 -46.5303 -44.3310 -44.3310 -20.7378 -20.7378 -18.8509 -18.8509 -18.0685 -18.0685 -18.0485 -18.0485 -17.6747 -17.6747 -17.6739 -17.6739 16.1570 16.1570 16.8958 16.8958 16.9438 16.9438 17.3928 17.3928 19.1008 19.1008 19.2227 19.2227 21.8186 21.8186 21.8734 21.8734 22.0103 22.0103 22.0365 22.0365 k = 0.5000 0.5000 0.3173 ( 1436 PWs) bands (ev): -46.5297 -46.5297 -44.3306 -44.3306 -20.7377 -20.7377 -18.8462 -18.8462 -18.0643 -18.0643 -18.0464 -18.0464 -17.6854 -17.6854 -17.6849 -17.6849 16.2096 16.2096 16.8858 16.8858 16.9326 16.9326 17.4827 17.4827 19.0422 19.0422 19.1630 19.1630 21.8362 21.8362 21.8862 21.8862 22.0121 22.0121 22.0395 22.0395 k = 0.5000 0.5000 0.3269 ( 1428 PWs) bands (ev): -46.5292 -46.5292 -44.3302 -44.3302 -20.7376 -20.7376 -18.8416 -18.8416 -18.0598 -18.0598 -18.0439 -18.0439 -17.6961 -17.6961 -17.6960 -17.6960 16.2612 16.2612 16.8760 16.8760 16.9220 16.9220 17.5716 17.5716 18.9864 18.9864 19.1061 19.1061 21.8537 21.8537 21.8987 21.8987 22.0140 22.0140 22.0424 22.0424 k = 0.5000 0.5000 0.3365 ( 1428 PWs) bands (ev): -46.5286 -46.5286 -44.3298 -44.3298 -20.7376 -20.7376 -18.8372 -18.8372 -18.0552 -18.0552 -18.0411 -18.0411 -17.7071 -17.7071 -17.7069 -17.7069 16.3117 16.3117 16.8664 16.8664 16.9117 16.9117 17.6589 17.6589 18.9333 18.9333 19.0519 19.0519 21.8712 21.8712 21.9108 21.9108 22.0157 22.0157 22.0452 22.0452 k = 0.5000 0.5000 0.3462 ( 1432 PWs) bands (ev): -46.5281 -46.5281 -44.3295 -44.3295 -20.7376 -20.7376 -18.8330 -18.8330 -18.0503 -18.0503 -18.0380 -18.0380 -17.7183 -17.7183 -17.7178 -17.7178 16.3609 16.3609 16.8572 16.8572 16.9019 16.9019 17.7442 17.7442 18.8829 18.8829 19.0004 19.0004 21.8883 21.8883 21.9223 21.9223 22.0174 22.0174 22.0478 22.0478 k = 0.5000 0.5000 0.3558 ( 1424 PWs) bands (ev): -46.5276 -46.5276 -44.3291 -44.3291 -20.7375 -20.7375 -18.8289 -18.8289 -18.0452 -18.0452 -18.0344 -18.0344 -17.7293 -17.7293 -17.7287 -17.7287 16.4085 16.4085 16.8486 16.8486 16.8928 16.8928 17.8270 17.8270 18.8356 18.8356 18.9518 18.9518 21.9053 21.9053 21.9337 21.9337 22.0191 22.0191 22.0502 22.0502 k = 0.5000 0.5000 0.3654 ( 1424 PWs) bands (ev): -46.5271 -46.5271 -44.3288 -44.3288 -20.7375 -20.7375 -18.8251 -18.8251 -18.0399 -18.0399 -18.0307 -18.0307 -17.7402 -17.7402 -17.7395 -17.7395 16.4542 16.4542 16.8403 16.8403 16.8841 16.8841 17.9068 17.9068 18.7912 18.7912 18.9061 18.9061 21.9218 21.9218 21.9445 21.9445 22.0206 22.0206 22.0525 22.0525 k = 0.5000 0.5000 0.3750 ( 1424 PWs) bands (ev): -46.5266 -46.5266 -44.3285 -44.3285 -20.7375 -20.7375 -18.8215 -18.8215 -18.0344 -18.0344 -18.0265 -18.0265 -17.7511 -17.7511 -17.7503 -17.7503 16.4979 16.4979 16.8326 16.8326 16.8761 16.8761 17.9831 17.9831 18.7500 18.7500 18.8633 18.8633 21.9379 21.9379 21.9548 21.9548 22.0222 22.0222 22.0545 22.0545 k = 0.5000 0.5000 0.3846 ( 1424 PWs) bands (ev): -46.5262 -46.5262 -44.3282 -44.3282 -20.7375 -20.7375 -18.8181 -18.8181 -18.0287 -18.0287 -18.0222 -18.0222 -17.7618 -17.7618 -17.7610 -17.7610 16.5393 16.5393 16.8254 16.8254 16.8687 16.8687 18.0555 18.0555 18.7120 18.7120 18.8235 18.8235 21.9534 21.9534 21.9646 21.9646 22.0236 22.0236 22.0563 22.0563 k = 0.5000 0.5000 0.3942 ( 1424 PWs) bands (ev): -46.5258 -46.5258 -44.3280 -44.3280 -20.7375 -20.7375 -18.8150 -18.8150 -18.0229 -18.0229 -18.0175 -18.0175 -17.7723 -17.7723 -17.7715 -17.7715 16.5782 16.5782 16.8187 16.8187 16.8619 16.8619 18.1233 18.1233 18.6775 18.6775 18.7867 18.7867 21.9682 21.9682 21.9738 21.9738 22.0250 22.0250 22.0578 22.0578 k = 0.5000 0.5000 0.4038 ( 1424 PWs) bands (ev): -46.5254 -46.5254 -44.3277 -44.3277 -20.7376 -20.7376 -18.8121 -18.8121 -18.0170 -18.0170 -18.0126 -18.0126 -17.7826 -17.7826 -17.7818 -17.7818 16.6143 16.6143 16.8126 16.8126 16.8558 16.8558 18.1859 18.1859 18.6467 18.6467 18.7530 18.7530 21.9821 21.9821 21.9824 21.9824 22.0264 22.0264 22.0591 22.0591 k = 0.5000 0.5000 0.4135 ( 1424 PWs) bands (ev): -46.5251 -46.5251 -44.3275 -44.3275 -20.7376 -20.7376 -18.8094 -18.8094 -18.0110 -18.0110 -18.0075 -18.0075 -17.7925 -17.7925 -17.7918 -17.7918 16.6475 16.6475 16.8071 16.8071 16.8505 16.8505 18.2427 18.2427 18.6199 18.6199 18.7223 18.7223 21.9905 21.9905 21.9950 21.9950 22.0278 22.0278 22.0601 22.0601 k = 0.5000 0.5000 0.4231 ( 1432 PWs) bands (ev): -46.5248 -46.5248 -44.3273 -44.3273 -20.7376 -20.7376 -18.8071 -18.8071 -18.0051 -18.0051 -18.0023 -18.0023 -17.8022 -17.8022 -17.8015 -17.8015 16.6775 16.6775 16.8022 16.8022 16.8460 16.8460 18.2926 18.2926 18.5977 18.5977 18.6948 18.6948 21.9978 21.9978 22.0065 22.0066 22.0293 22.0293 22.0608 22.0608 k = 0.5000 0.5000 0.4327 ( 1432 PWs) bands (ev): -46.5245 -46.5245 -44.3271 -44.3271 -20.7377 -20.7377 -18.8050 -18.8050 -17.9992 -17.9992 -17.9971 -17.9971 -17.8112 -17.8112 -17.8107 -17.8107 16.7040 16.7040 16.7978 16.7978 16.8423 16.8423 18.3347 18.3347 18.5809 18.5809 18.6705 18.6705 22.0046 22.0046 22.0163 22.0163 22.0316 22.0316 22.0612 22.0612 k = 0.5000 0.5000 0.4423 ( 1432 PWs) bands (ev): -46.5243 -46.5243 -44.3269 -44.3269 -20.7377 -20.7377 -18.8032 -18.8032 -17.9935 -17.9935 -17.9920 -17.9920 -17.8197 -17.8197 -17.8193 -17.8193 16.7269 16.7269 16.7940 16.7940 16.8396 16.8396 18.3678 18.3678 18.5704 18.5704 18.6493 18.6493 22.0107 22.0107 22.0230 22.0230 22.0357 22.0357 22.0614 22.0614 k = 0.5000 0.5000 0.4519 ( 1432 PWs) bands (ev): -46.5241 -46.5241 -44.3268 -44.3268 -20.7377 -20.7377 -18.8016 -18.8016 -17.9882 -17.9882 -17.9871 -17.9871 -17.8274 -17.8274 -17.8271 -17.8271 16.7458 16.7458 16.7908 16.7908 16.8380 16.8380 18.3908 18.3908 18.5669 18.5669 18.6313 18.6313 22.0161 22.0161 22.0263 22.0263 22.0417 22.0417 22.0614 22.0614 k = 0.5000 0.5000 0.4615 ( 1432 PWs) bands (ev): -46.5239 -46.5239 -44.3267 -44.3267 -20.7377 -20.7377 -18.8003 -18.8003 -17.9833 -17.9833 -17.9826 -17.9826 -17.8342 -17.8342 -17.8340 -17.8340 16.7607 16.7607 16.7882 16.7882 16.8375 16.8375 18.4044 18.4044 18.5697 18.5697 18.6166 18.6166 22.0208 22.0208 22.0279 22.0279 22.0478 22.0478 22.0612 22.0612 k = 0.5000 0.5000 0.4712 ( 1432 PWs) bands (ev): -46.5238 -46.5238 -44.3266 -44.3266 -20.7377 -20.7377 -18.7993 -18.7993 -17.9792 -17.9792 -17.9788 -17.9788 -17.8399 -17.8399 -17.8398 -17.8398 16.7714 16.7714 16.7862 16.7862 16.8380 16.8380 18.4108 18.4108 18.5762 18.5762 18.6051 18.6051 22.0246 22.0246 22.0288 22.0288 22.0530 22.0530 22.0608 22.0608 k = 0.5000 0.5000 0.4808 ( 1432 PWs) bands (ev): -46.5237 -46.5237 -44.3265 -44.3265 -20.7378 -20.7378 -18.7986 -18.7986 -17.9760 -17.9760 -17.9757 -17.9757 -17.8442 -17.8442 -17.8442 -17.8442 16.7784 16.7784 16.7847 16.7847 16.8391 16.8391 18.4131 18.4131 18.5833 18.5833 18.5969 18.5969 22.0274 22.0274 22.0293 22.0293 22.0569 22.0569 22.0605 22.0605 k = 0.5000 0.5000 0.4904 ( 1456 PWs) bands (ev): -46.5236 -46.5236 -44.3265 -44.3265 -20.7379 -20.7379 -18.7985 -18.7985 -17.9743 -17.9743 -17.9740 -17.9740 -17.8471 -17.8471 -17.8470 -17.8470 16.7822 16.7822 16.7838 16.7838 16.8400 16.8400 18.4133 18.4133 18.5882 18.5882 18.5918 18.5918 22.0291 22.0291 22.0292 22.0292 22.0592 22.0592 22.0599 22.0599 k = 0.5000 0.5000 0.5000 ( 1472 PWs) bands (ev): -46.5236 -46.5236 -44.3265 -44.3265 -20.7380 -20.7380 -18.7985 -18.7985 -17.9737 -17.9737 -17.9737 -17.9737 -17.8481 -17.8481 -17.8481 -17.8481 16.7834 16.7834 16.7834 16.7834 16.8404 16.8404 18.4132 18.4132 18.5899 18.5899 18.5899 18.5899 22.0293 22.0293 22.0293 22.0293 22.0598 22.0598 22.0598 22.0598 Writing output data file VTc.save init_run : 0.18s CPU 0.32s WALL ( 1 calls) electrons : 51.38s CPU 52.79s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 51.38s CPU 52.78s 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 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.03s WALL ( 400 calls) cegterg : 46.33s CPU 47.39s WALL ( 405 calls) Called by sum_band: Called by *egterg: h_psi : 22.68s CPU 23.47s WALL ( 5759 calls) s_psi : 1.25s CPU 1.24s WALL ( 5759 calls) g_psi : 0.07s CPU 0.06s WALL ( 4954 calls) cdiaghg : 21.72s CPU 22.24s WALL ( 5354 calls) cegterg:over : 1.84s CPU 1.71s WALL ( 4954 calls) cegterg:upda : 1.00s CPU 1.10s WALL ( 4954 calls) cegterg:last : 0.74s CPU 0.71s WALL ( 1206 calls) cdiaghg:chol : 0.94s CPU 1.11s WALL ( 5354 calls) cdiaghg:inve : 0.55s CPU 0.56s WALL ( 5354 calls) cdiaghg:para : 1.35s CPU 1.31s WALL ( 10708 calls) Called by h_psi: h_psi:vloc : 19.87s CPU 20.48s WALL ( 5759 calls) h_psi:vnl : 2.80s CPU 2.96s WALL ( 5759 calls) add_vuspsi : 1.69s CPU 1.68s WALL ( 5759 calls) General routines calbec : 1.09s CPU 1.26s WALL ( 5759 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 18.00s CPU 18.69s WALL ( 561944 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.10s CPU 0.10s WALL ( 800 calls) Parallel routines fft_scatter : 10.04s CPU 10.47s WALL ( 561967 calls) PWSCF : 1m 1.58s CPU 1m30.21s WALL This run was terminated on: 21:18:30 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=