Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:16:59 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: ./TaTc.save/ file Tc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P 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 35 18 5 955 358 61 Max 36 19 6 960 377 68 Sum 1281 673 213 34457 13205 2325 bravais-lattice index = 14 lattice parameter (alat) = 5.9942 a.u. unit-cell volume = 215.3754 (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 = 448.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.994211 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 Ta read from file: /users/gautes/Pseudo/Ta.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ce7a4fa75595c0f83f911fa846a48acf 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 1273 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 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 atomic species valence mass pseudopotential Ta 13.00 180.94790 Ta( 1.00) Tc 15.00 98.00000 Tc( 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= 384 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 2) = ( 0.0000000 0.0100000 -0.0000000), wk = 0.0026042 k( 3) = ( 0.0000000 0.0200000 -0.0000000), wk = 0.0026042 k( 4) = ( 0.0000000 0.0300000 -0.0000000), wk = 0.0026042 k( 5) = ( 0.0000000 0.0400000 -0.0000000), wk = 0.0026042 k( 6) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0026042 k( 7) = ( 0.0000000 0.0600000 -0.0000000), wk = 0.0026042 k( 8) = ( 0.0000000 0.0700000 -0.0000000), wk = 0.0026042 k( 9) = ( 0.0000000 0.0800000 -0.0000000), wk = 0.0026042 k( 10) = ( 0.0000000 0.0900000 -0.0000000), wk = 0.0026042 k( 11) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0026042 k( 12) = ( 0.0000000 0.1100000 -0.0000000), wk = 0.0026042 k( 13) = ( 0.0000000 0.1200000 -0.0000000), wk = 0.0026042 k( 14) = ( 0.0000000 0.1300000 -0.0000000), wk = 0.0026042 k( 15) = ( 0.0000000 0.1400000 -0.0000000), wk = 0.0026042 k( 16) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0026042 k( 17) = ( 0.0000000 0.1600000 -0.0000000), wk = 0.0026042 k( 18) = ( 0.0000000 0.1700000 -0.0000000), wk = 0.0026042 k( 19) = ( 0.0000000 0.1800000 -0.0000000), wk = 0.0026042 k( 20) = ( 0.0000000 0.1900000 -0.0000000), wk = 0.0026042 k( 21) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0026042 k( 22) = ( 0.0000000 0.2100000 -0.0000000), wk = 0.0026042 k( 23) = ( 0.0000000 0.2200000 -0.0000000), wk = 0.0026042 k( 24) = ( 0.0000000 0.2300000 -0.0000000), wk = 0.0026042 k( 25) = ( 0.0000000 0.2400000 -0.0000000), wk = 0.0026042 k( 26) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0026042 k( 27) = ( 0.0000000 0.2600000 -0.0000000), wk = 0.0026042 k( 28) = ( 0.0000000 0.2700000 -0.0000000), wk = 0.0026042 k( 29) = ( 0.0000000 0.2800000 -0.0000000), wk = 0.0026042 k( 30) = ( 0.0000000 0.2900000 -0.0000000), wk = 0.0026042 k( 31) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0026042 k( 32) = ( 0.0000000 0.3100000 -0.0000000), wk = 0.0026042 k( 33) = ( 0.0000000 0.3200000 -0.0000000), wk = 0.0026042 k( 34) = ( 0.0000000 0.3300000 -0.0000000), wk = 0.0026042 k( 35) = ( 0.0000000 0.3400000 -0.0000000), wk = 0.0026042 k( 36) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0026042 k( 37) = ( 0.0000000 0.3600000 -0.0000000), wk = 0.0026042 k( 38) = ( 0.0000000 0.3700000 -0.0000000), wk = 0.0026042 k( 39) = ( 0.0000000 0.3800000 -0.0000000), wk = 0.0026042 k( 40) = ( 0.0000000 0.3900000 -0.0000000), wk = 0.0026042 k( 41) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0026042 k( 42) = ( 0.0000000 0.4100000 -0.0000000), wk = 0.0026042 k( 43) = ( 0.0000000 0.4200000 -0.0000000), wk = 0.0026042 k( 44) = ( 0.0000000 0.4300000 -0.0000000), wk = 0.0026042 k( 45) = ( 0.0000000 0.4400000 -0.0000000), wk = 0.0026042 k( 46) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0026042 k( 47) = ( 0.0000000 0.4600000 -0.0000000), wk = 0.0026042 k( 48) = ( 0.0000000 0.4700000 -0.0000000), wk = 0.0026042 k( 49) = ( 0.0000000 0.4800000 -0.0000000), wk = 0.0026042 k( 50) = ( 0.0000000 0.4900000 -0.0000000), wk = 0.0026042 k( 51) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026042 k( 52) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026042 k( 53) = ( 0.0100000 0.5000000 -0.0000000), wk = 0.0026042 k( 54) = ( 0.0200000 0.5000000 -0.0000000), wk = 0.0026042 k( 55) = ( 0.0300000 0.5000000 -0.0000000), wk = 0.0026042 k( 56) = ( 0.0400000 0.5000000 -0.0000000), wk = 0.0026042 k( 57) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0026042 k( 58) = ( 0.0600000 0.5000000 -0.0000000), wk = 0.0026042 k( 59) = ( 0.0700000 0.5000000 -0.0000000), wk = 0.0026042 k( 60) = ( 0.0800000 0.5000000 -0.0000000), wk = 0.0026042 k( 61) = ( 0.0900000 0.5000000 -0.0000000), wk = 0.0026042 k( 62) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0026042 k( 63) = ( 0.1100000 0.5000000 -0.0000000), wk = 0.0026042 k( 64) = ( 0.1200000 0.5000000 -0.0000000), wk = 0.0026042 k( 65) = ( 0.1300000 0.5000000 -0.0000000), wk = 0.0026042 k( 66) = ( 0.1400000 0.5000000 -0.0000000), wk = 0.0026042 k( 67) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0026042 k( 68) = ( 0.1600000 0.5000000 -0.0000000), wk = 0.0026042 k( 69) = ( 0.1700000 0.5000000 -0.0000000), wk = 0.0026042 k( 70) = ( 0.1800000 0.5000000 -0.0000000), wk = 0.0026042 k( 71) = ( 0.1900000 0.5000000 -0.0000000), wk = 0.0026042 k( 72) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0026042 k( 73) = ( 0.2100000 0.5000000 -0.0000000), wk = 0.0026042 k( 74) = ( 0.2200000 0.5000000 -0.0000000), wk = 0.0026042 k( 75) = ( 0.2300000 0.5000000 -0.0000000), wk = 0.0026042 k( 76) = ( 0.2400000 0.5000000 -0.0000000), wk = 0.0026042 k( 77) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0026042 k( 78) = ( 0.2600000 0.5000000 -0.0000000), wk = 0.0026042 k( 79) = ( 0.2700000 0.5000000 -0.0000000), wk = 0.0026042 k( 80) = ( 0.2800000 0.5000000 -0.0000000), wk = 0.0026042 k( 81) = ( 0.2900000 0.5000000 -0.0000000), wk = 0.0026042 k( 82) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0026042 k( 83) = ( 0.3100000 0.5000000 -0.0000000), wk = 0.0026042 k( 84) = ( 0.3200000 0.5000000 -0.0000000), wk = 0.0026042 k( 85) = ( 0.3300000 0.5000000 -0.0000000), wk = 0.0026042 k( 86) = ( 0.3400000 0.5000000 -0.0000000), wk = 0.0026042 k( 87) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0026042 k( 88) = ( 0.3600000 0.5000000 -0.0000000), wk = 0.0026042 k( 89) = ( 0.3700000 0.5000000 -0.0000000), wk = 0.0026042 k( 90) = ( 0.3800000 0.5000000 -0.0000000), wk = 0.0026042 k( 91) = ( 0.3900000 0.5000000 -0.0000000), wk = 0.0026042 k( 92) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0026042 k( 93) = ( 0.4100000 0.5000000 -0.0000000), wk = 0.0026042 k( 94) = ( 0.4200000 0.5000000 -0.0000000), wk = 0.0026042 k( 95) = ( 0.4300000 0.5000000 -0.0000000), wk = 0.0026042 k( 96) = ( 0.4400000 0.5000000 -0.0000000), wk = 0.0026042 k( 97) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0026042 k( 98) = ( 0.4600000 0.5000000 -0.0000000), wk = 0.0026042 k( 99) = ( 0.4700000 0.5000000 -0.0000000), wk = 0.0026042 k( 100) = ( 0.4800000 0.5000000 -0.0000000), wk = 0.0026042 k( 101) = ( 0.4900000 0.5000000 -0.0000000), wk = 0.0026042 k( 102) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026042 k( 103) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026042 k( 104) = ( 0.4929577 0.4929577 -0.0000000), wk = 0.0026042 k( 105) = ( 0.4859155 0.4859155 -0.0000000), wk = 0.0026042 k( 106) = ( 0.4788732 0.4788732 -0.0000000), wk = 0.0026042 k( 107) = ( 0.4718310 0.4718310 -0.0000000), wk = 0.0026042 k( 108) = ( 0.4647887 0.4647887 -0.0000000), wk = 0.0026042 k( 109) = ( 0.4577465 0.4577465 -0.0000000), wk = 0.0026042 k( 110) = ( 0.4507042 0.4507042 -0.0000000), wk = 0.0026042 k( 111) = ( 0.4436620 0.4436620 -0.0000000), wk = 0.0026042 k( 112) = ( 0.4366197 0.4366197 -0.0000000), wk = 0.0026042 k( 113) = ( 0.4295775 0.4295775 -0.0000000), wk = 0.0026042 k( 114) = ( 0.4225352 0.4225352 -0.0000000), wk = 0.0026042 k( 115) = ( 0.4154930 0.4154930 -0.0000000), wk = 0.0026042 k( 116) = ( 0.4084507 0.4084507 -0.0000000), wk = 0.0026042 k( 117) = ( 0.4014085 0.4014084 -0.0000000), wk = 0.0026042 k( 118) = ( 0.3943662 0.3943662 -0.0000000), wk = 0.0026042 k( 119) = ( 0.3873239 0.3873239 -0.0000000), wk = 0.0026042 k( 120) = ( 0.3802817 0.3802817 -0.0000000), wk = 0.0026042 k( 121) = ( 0.3732394 0.3732394 -0.0000000), wk = 0.0026042 k( 122) = ( 0.3661972 0.3661972 -0.0000000), wk = 0.0026042 k( 123) = ( 0.3591549 0.3591549 -0.0000000), wk = 0.0026042 k( 124) = ( 0.3521127 0.3521127 -0.0000000), wk = 0.0026042 k( 125) = ( 0.3450704 0.3450704 -0.0000000), wk = 0.0026042 k( 126) = ( 0.3380282 0.3380282 -0.0000000), wk = 0.0026042 k( 127) = ( 0.3309859 0.3309859 -0.0000000), wk = 0.0026042 k( 128) = ( 0.3239437 0.3239437 -0.0000000), wk = 0.0026042 k( 129) = ( 0.3169014 0.3169014 -0.0000000), wk = 0.0026042 k( 130) = ( 0.3098592 0.3098591 -0.0000000), wk = 0.0026042 k( 131) = ( 0.3028169 0.3028169 -0.0000000), wk = 0.0026042 k( 132) = ( 0.2957746 0.2957746 -0.0000000), wk = 0.0026042 k( 133) = ( 0.2887324 0.2887324 -0.0000000), wk = 0.0026042 k( 134) = ( 0.2816901 0.2816901 -0.0000000), wk = 0.0026042 k( 135) = ( 0.2746479 0.2746479 -0.0000000), wk = 0.0026042 k( 136) = ( 0.2676056 0.2676056 -0.0000000), wk = 0.0026042 k( 137) = ( 0.2605634 0.2605634 -0.0000000), wk = 0.0026042 k( 138) = ( 0.2535211 0.2535211 -0.0000000), wk = 0.0026042 k( 139) = ( 0.2464789 0.2464789 -0.0000000), wk = 0.0026042 k( 140) = ( 0.2394366 0.2394366 -0.0000000), wk = 0.0026042 k( 141) = ( 0.2323944 0.2323944 -0.0000000), wk = 0.0026042 k( 142) = ( 0.2253521 0.2253521 -0.0000000), wk = 0.0026042 k( 143) = ( 0.2183099 0.2183099 -0.0000000), wk = 0.0026042 k( 144) = ( 0.2112676 0.2112676 -0.0000000), wk = 0.0026042 k( 145) = ( 0.2042253 0.2042253 -0.0000000), wk = 0.0026042 k( 146) = ( 0.1971831 0.1971831 -0.0000000), wk = 0.0026042 k( 147) = ( 0.1901409 0.1901408 -0.0000000), wk = 0.0026042 k( 148) = ( 0.1830986 0.1830986 -0.0000000), wk = 0.0026042 k( 149) = ( 0.1760563 0.1760563 -0.0000000), wk = 0.0026042 k( 150) = ( 0.1690141 0.1690141 -0.0000000), wk = 0.0026042 k( 151) = ( 0.1619718 0.1619718 -0.0000000), wk = 0.0026042 k( 152) = ( 0.1549296 0.1549296 -0.0000000), wk = 0.0026042 k( 153) = ( 0.1478873 0.1478873 -0.0000000), wk = 0.0026042 k( 154) = ( 0.1408451 0.1408451 -0.0000000), wk = 0.0026042 k( 155) = ( 0.1338028 0.1338028 -0.0000000), wk = 0.0026042 k( 156) = ( 0.1267606 0.1267606 -0.0000000), wk = 0.0026042 k( 157) = ( 0.1197183 0.1197183 -0.0000000), wk = 0.0026042 k( 158) = ( 0.1126761 0.1126761 -0.0000000), wk = 0.0026042 k( 159) = ( 0.1056338 0.1056338 -0.0000000), wk = 0.0026042 k( 160) = ( 0.0985916 0.0985915 -0.0000000), wk = 0.0026042 k( 161) = ( 0.0915493 0.0915493 -0.0000000), wk = 0.0026042 k( 162) = ( 0.0845070 0.0845070 -0.0000000), wk = 0.0026042 k( 163) = ( 0.0774648 0.0774648 -0.0000000), wk = 0.0026042 k( 164) = ( 0.0704225 0.0704225 -0.0000000), wk = 0.0026042 k( 165) = ( 0.0633803 0.0633803 -0.0000000), wk = 0.0026042 k( 166) = ( 0.0563380 0.0563380 -0.0000000), wk = 0.0026042 k( 167) = ( 0.0492958 0.0492958 -0.0000000), wk = 0.0026042 k( 168) = ( 0.0422535 0.0422535 -0.0000000), wk = 0.0026042 k( 169) = ( 0.0352113 0.0352113 -0.0000000), wk = 0.0026042 k( 170) = ( 0.0281690 0.0281690 -0.0000000), wk = 0.0026042 k( 171) = ( 0.0211268 0.0211268 -0.0000000), wk = 0.0026042 k( 172) = ( 0.0140845 0.0140845 -0.0000000), wk = 0.0026042 k( 173) = ( 0.0070422 0.0070422 -0.0000000), wk = 0.0026042 k( 174) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 175) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 176) = ( 0.0058140 0.0058139 0.0058139), wk = 0.0026042 k( 177) = ( 0.0116279 0.0116279 0.0116279), wk = 0.0026042 k( 178) = ( 0.0174419 0.0174419 0.0174419), wk = 0.0026042 k( 179) = ( 0.0232558 0.0232558 0.0232558), wk = 0.0026042 k( 180) = ( 0.0290698 0.0290698 0.0290698), wk = 0.0026042 k( 181) = ( 0.0348837 0.0348837 0.0348837), wk = 0.0026042 k( 182) = ( 0.0406977 0.0406977 0.0406977), wk = 0.0026042 k( 183) = ( 0.0465116 0.0465116 0.0465116), wk = 0.0026042 k( 184) = ( 0.0523256 0.0523256 0.0523256), wk = 0.0026042 k( 185) = ( 0.0581395 0.0581395 0.0581395), wk = 0.0026042 k( 186) = ( 0.0639535 0.0639535 0.0639535), wk = 0.0026042 k( 187) = ( 0.0697674 0.0697674 0.0697674), wk = 0.0026042 k( 188) = ( 0.0755814 0.0755814 0.0755814), wk = 0.0026042 k( 189) = ( 0.0813954 0.0813953 0.0813953), wk = 0.0026042 k( 190) = ( 0.0872093 0.0872093 0.0872093), wk = 0.0026042 k( 191) = ( 0.0930233 0.0930233 0.0930233), wk = 0.0026042 k( 192) = ( 0.0988372 0.0988372 0.0988372), wk = 0.0026042 k( 193) = ( 0.1046512 0.1046512 0.1046512), wk = 0.0026042 k( 194) = ( 0.1104651 0.1104651 0.1104651), wk = 0.0026042 k( 195) = ( 0.1162791 0.1162791 0.1162791), wk = 0.0026042 k( 196) = ( 0.1220930 0.1220930 0.1220930), wk = 0.0026042 k( 197) = ( 0.1279070 0.1279070 0.1279070), wk = 0.0026042 k( 198) = ( 0.1337209 0.1337209 0.1337209), wk = 0.0026042 k( 199) = ( 0.1395349 0.1395349 0.1395349), wk = 0.0026042 k( 200) = ( 0.1453488 0.1453488 0.1453488), wk = 0.0026042 k( 201) = ( 0.1511628 0.1511628 0.1511628), wk = 0.0026042 k( 202) = ( 0.1569767 0.1569767 0.1569767), wk = 0.0026042 k( 203) = ( 0.1627907 0.1627907 0.1627907), wk = 0.0026042 k( 204) = ( 0.1686046 0.1686046 0.1686046), wk = 0.0026042 k( 205) = ( 0.1744186 0.1744186 0.1744186), wk = 0.0026042 k( 206) = ( 0.1802326 0.1802326 0.1802326), wk = 0.0026042 k( 207) = ( 0.1860465 0.1860465 0.1860465), wk = 0.0026042 k( 208) = ( 0.1918605 0.1918605 0.1918605), wk = 0.0026042 k( 209) = ( 0.1976744 0.1976744 0.1976744), wk = 0.0026042 k( 210) = ( 0.2034884 0.2034884 0.2034884), wk = 0.0026042 k( 211) = ( 0.2093023 0.2093023 0.2093023), wk = 0.0026042 k( 212) = ( 0.2151163 0.2151163 0.2151163), wk = 0.0026042 k( 213) = ( 0.2209302 0.2209302 0.2209302), wk = 0.0026042 k( 214) = ( 0.2267442 0.2267442 0.2267442), wk = 0.0026042 k( 215) = ( 0.2325581 0.2325581 0.2325581), wk = 0.0026042 k( 216) = ( 0.2383721 0.2383721 0.2383721), wk = 0.0026042 k( 217) = ( 0.2441860 0.2441860 0.2441860), wk = 0.0026042 k( 218) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026042 k( 219) = ( 0.2558140 0.2558140 0.2558139), wk = 0.0026042 k( 220) = ( 0.2616279 0.2616279 0.2616279), wk = 0.0026042 k( 221) = ( 0.2674419 0.2674419 0.2674419), wk = 0.0026042 k( 222) = ( 0.2732558 0.2732558 0.2732558), wk = 0.0026042 k( 223) = ( 0.2790698 0.2790698 0.2790698), wk = 0.0026042 k( 224) = ( 0.2848837 0.2848837 0.2848837), wk = 0.0026042 k( 225) = ( 0.2906977 0.2906977 0.2906977), wk = 0.0026042 k( 226) = ( 0.2965116 0.2965116 0.2965116), wk = 0.0026042 k( 227) = ( 0.3023256 0.3023256 0.3023256), wk = 0.0026042 k( 228) = ( 0.3081395 0.3081395 0.3081395), wk = 0.0026042 k( 229) = ( 0.3139535 0.3139535 0.3139535), wk = 0.0026042 k( 230) = ( 0.3197674 0.3197674 0.3197674), wk = 0.0026042 k( 231) = ( 0.3255814 0.3255814 0.3255814), wk = 0.0026042 k( 232) = ( 0.3313953 0.3313953 0.3313953), wk = 0.0026042 k( 233) = ( 0.3372093 0.3372093 0.3372093), wk = 0.0026042 k( 234) = ( 0.3430233 0.3430233 0.3430233), wk = 0.0026042 k( 235) = ( 0.3488372 0.3488372 0.3488372), wk = 0.0026042 k( 236) = ( 0.3546512 0.3546512 0.3546512), wk = 0.0026042 k( 237) = ( 0.3604651 0.3604651 0.3604651), wk = 0.0026042 k( 238) = ( 0.3662791 0.3662791 0.3662791), wk = 0.0026042 k( 239) = ( 0.3720930 0.3720930 0.3720930), wk = 0.0026042 k( 240) = ( 0.3779070 0.3779070 0.3779070), wk = 0.0026042 k( 241) = ( 0.3837209 0.3837209 0.3837209), wk = 0.0026042 k( 242) = ( 0.3895349 0.3895349 0.3895349), wk = 0.0026042 k( 243) = ( 0.3953488 0.3953488 0.3953488), wk = 0.0026042 k( 244) = ( 0.4011628 0.4011628 0.4011628), wk = 0.0026042 k( 245) = ( 0.4069767 0.4069767 0.4069767), wk = 0.0026042 k( 246) = ( 0.4127907 0.4127907 0.4127907), wk = 0.0026042 k( 247) = ( 0.4186047 0.4186046 0.4186046), wk = 0.0026042 k( 248) = ( 0.4244186 0.4244186 0.4244186), wk = 0.0026042 k( 249) = ( 0.4302326 0.4302326 0.4302326), wk = 0.0026042 k( 250) = ( 0.4360465 0.4360465 0.4360465), wk = 0.0026042 k( 251) = ( 0.4418605 0.4418605 0.4418605), wk = 0.0026042 k( 252) = ( 0.4476744 0.4476744 0.4476744), wk = 0.0026042 k( 253) = ( 0.4534884 0.4534884 0.4534884), wk = 0.0026042 k( 254) = ( 0.4593023 0.4593023 0.4593023), wk = 0.0026042 k( 255) = ( 0.4651163 0.4651163 0.4651163), wk = 0.0026042 k( 256) = ( 0.4709302 0.4709302 0.4709302), wk = 0.0026042 k( 257) = ( 0.4767442 0.4767442 0.4767442), wk = 0.0026042 k( 258) = ( 0.4825581 0.4825581 0.4825581), wk = 0.0026042 k( 259) = ( 0.4883721 0.4883721 0.4883721), wk = 0.0026042 k( 260) = ( 0.4941860 0.4941860 0.4941860), wk = 0.0026042 k( 261) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 k( 262) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 k( 263) = ( 0.4929577 0.5000000 0.4929577), wk = 0.0026042 k( 264) = ( 0.4859155 0.5000000 0.4859155), wk = 0.0026042 k( 265) = ( 0.4788732 0.5000000 0.4788732), wk = 0.0026042 k( 266) = ( 0.4718310 0.5000000 0.4718310), wk = 0.0026042 k( 267) = ( 0.4647887 0.5000000 0.4647887), wk = 0.0026042 k( 268) = ( 0.4577465 0.5000000 0.4577465), wk = 0.0026042 k( 269) = ( 0.4507042 0.5000000 0.4507042), wk = 0.0026042 k( 270) = ( 0.4436620 0.5000000 0.4436620), wk = 0.0026042 k( 271) = ( 0.4366197 0.5000000 0.4366197), wk = 0.0026042 k( 272) = ( 0.4295775 0.5000000 0.4295775), wk = 0.0026042 k( 273) = ( 0.4225352 0.5000000 0.4225352), wk = 0.0026042 k( 274) = ( 0.4154930 0.5000000 0.4154930), wk = 0.0026042 k( 275) = ( 0.4084507 0.5000000 0.4084507), wk = 0.0026042 k( 276) = ( 0.4014085 0.5000000 0.4014084), wk = 0.0026042 k( 277) = ( 0.3943662 0.5000000 0.3943662), wk = 0.0026042 k( 278) = ( 0.3873239 0.5000000 0.3873239), wk = 0.0026042 k( 279) = ( 0.3802817 0.5000000 0.3802817), wk = 0.0026042 k( 280) = ( 0.3732394 0.5000000 0.3732394), wk = 0.0026042 k( 281) = ( 0.3661972 0.5000000 0.3661972), wk = 0.0026042 k( 282) = ( 0.3591549 0.5000000 0.3591549), wk = 0.0026042 k( 283) = ( 0.3521127 0.5000000 0.3521127), wk = 0.0026042 k( 284) = ( 0.3450704 0.5000000 0.3450704), wk = 0.0026042 k( 285) = ( 0.3380282 0.5000000 0.3380282), wk = 0.0026042 k( 286) = ( 0.3309859 0.5000000 0.3309859), wk = 0.0026042 k( 287) = ( 0.3239437 0.5000000 0.3239437), wk = 0.0026042 k( 288) = ( 0.3169014 0.5000000 0.3169014), wk = 0.0026042 k( 289) = ( 0.3098592 0.5000000 0.3098591), wk = 0.0026042 k( 290) = ( 0.3028169 0.5000000 0.3028169), wk = 0.0026042 k( 291) = ( 0.2957746 0.5000000 0.2957746), wk = 0.0026042 k( 292) = ( 0.2887324 0.5000000 0.2887324), wk = 0.0026042 k( 293) = ( 0.2816901 0.5000000 0.2816901), wk = 0.0026042 k( 294) = ( 0.2746479 0.5000000 0.2746479), wk = 0.0026042 k( 295) = ( 0.2676056 0.5000000 0.2676056), wk = 0.0026042 k( 296) = ( 0.2605634 0.5000000 0.2605634), wk = 0.0026042 k( 297) = ( 0.2535211 0.5000000 0.2535211), wk = 0.0026042 k( 298) = ( 0.2464789 0.5000000 0.2464789), wk = 0.0026042 k( 299) = ( 0.2394366 0.5000000 0.2394366), wk = 0.0026042 k( 300) = ( 0.2323944 0.5000000 0.2323944), wk = 0.0026042 k( 301) = ( 0.2253521 0.5000000 0.2253521), wk = 0.0026042 k( 302) = ( 0.2183099 0.5000000 0.2183099), wk = 0.0026042 k( 303) = ( 0.2112676 0.5000000 0.2112676), wk = 0.0026042 k( 304) = ( 0.2042253 0.5000000 0.2042253), wk = 0.0026042 k( 305) = ( 0.1971831 0.5000000 0.1971831), wk = 0.0026042 k( 306) = ( 0.1901409 0.5000000 0.1901408), wk = 0.0026042 k( 307) = ( 0.1830986 0.5000000 0.1830986), wk = 0.0026042 k( 308) = ( 0.1760563 0.5000000 0.1760563), wk = 0.0026042 k( 309) = ( 0.1690141 0.5000000 0.1690141), wk = 0.0026042 k( 310) = ( 0.1619718 0.5000000 0.1619718), wk = 0.0026042 k( 311) = ( 0.1549296 0.5000000 0.1549296), wk = 0.0026042 k( 312) = ( 0.1478873 0.5000000 0.1478873), wk = 0.0026042 k( 313) = ( 0.1408451 0.5000000 0.1408451), wk = 0.0026042 k( 314) = ( 0.1338028 0.5000000 0.1338028), wk = 0.0026042 k( 315) = ( 0.1267606 0.5000000 0.1267606), wk = 0.0026042 k( 316) = ( 0.1197183 0.5000000 0.1197183), wk = 0.0026042 k( 317) = ( 0.1126761 0.5000000 0.1126761), wk = 0.0026042 k( 318) = ( 0.1056338 0.5000000 0.1056338), wk = 0.0026042 k( 319) = ( 0.0985916 0.5000000 0.0985915), wk = 0.0026042 k( 320) = ( 0.0915493 0.5000000 0.0915493), wk = 0.0026042 k( 321) = ( 0.0845070 0.5000000 0.0845070), wk = 0.0026042 k( 322) = ( 0.0774648 0.5000000 0.0774648), wk = 0.0026042 k( 323) = ( 0.0704225 0.5000000 0.0704225), wk = 0.0026042 k( 324) = ( 0.0633803 0.5000000 0.0633803), wk = 0.0026042 k( 325) = ( 0.0563380 0.5000000 0.0563380), wk = 0.0026042 k( 326) = ( 0.0492958 0.5000000 0.0492958), wk = 0.0026042 k( 327) = ( 0.0422535 0.5000000 0.0422535), wk = 0.0026042 k( 328) = ( 0.0352113 0.5000000 0.0352113), wk = 0.0026042 k( 329) = ( 0.0281690 0.5000000 0.0281690), wk = 0.0026042 k( 330) = ( 0.0211268 0.5000000 0.0211268), wk = 0.0026042 k( 331) = ( 0.0140845 0.5000000 0.0140845), wk = 0.0026042 k( 332) = ( 0.0070422 0.5000000 0.0070422), wk = 0.0026042 k( 333) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026042 k( 334) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026042 k( 335) = ( 0.5000000 0.5000000 0.0100000), wk = 0.0026042 k( 336) = ( 0.5000000 0.5000000 0.0200000), wk = 0.0026042 k( 337) = ( 0.5000000 0.5000000 0.0300000), wk = 0.0026042 k( 338) = ( 0.5000000 0.5000000 0.0400000), wk = 0.0026042 k( 339) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0026042 k( 340) = ( 0.5000000 0.5000000 0.0600000), wk = 0.0026042 k( 341) = ( 0.5000000 0.5000000 0.0700000), wk = 0.0026042 k( 342) = ( 0.5000000 0.5000000 0.0800000), wk = 0.0026042 k( 343) = ( 0.5000000 0.5000000 0.0900000), wk = 0.0026042 k( 344) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0026042 k( 345) = ( 0.5000000 0.5000000 0.1100000), wk = 0.0026042 k( 346) = ( 0.5000000 0.5000000 0.1200000), wk = 0.0026042 k( 347) = ( 0.5000000 0.5000000 0.1300000), wk = 0.0026042 k( 348) = ( 0.5000000 0.5000000 0.1400000), wk = 0.0026042 k( 349) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0026042 k( 350) = ( 0.5000000 0.5000000 0.1600000), wk = 0.0026042 k( 351) = ( 0.5000000 0.5000000 0.1700000), wk = 0.0026042 k( 352) = ( 0.5000000 0.5000000 0.1800000), wk = 0.0026042 k( 353) = ( 0.5000000 0.5000000 0.1900000), wk = 0.0026042 k( 354) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0026042 k( 355) = ( 0.5000000 0.5000000 0.2100000), wk = 0.0026042 k( 356) = ( 0.5000000 0.5000000 0.2200000), wk = 0.0026042 k( 357) = ( 0.5000000 0.5000000 0.2300000), wk = 0.0026042 k( 358) = ( 0.5000000 0.5000000 0.2400000), wk = 0.0026042 k( 359) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0026042 k( 360) = ( 0.5000000 0.5000000 0.2600000), wk = 0.0026042 k( 361) = ( 0.5000000 0.5000000 0.2700000), wk = 0.0026042 k( 362) = ( 0.5000000 0.5000000 0.2800000), wk = 0.0026042 k( 363) = ( 0.5000000 0.5000000 0.2900000), wk = 0.0026042 k( 364) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0026042 k( 365) = ( 0.5000000 0.5000000 0.3100000), wk = 0.0026042 k( 366) = ( 0.5000000 0.5000000 0.3200000), wk = 0.0026042 k( 367) = ( 0.5000000 0.5000000 0.3300000), wk = 0.0026042 k( 368) = ( 0.5000000 0.5000000 0.3400000), wk = 0.0026042 k( 369) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0026042 k( 370) = ( 0.5000000 0.5000000 0.3600000), wk = 0.0026042 k( 371) = ( 0.5000000 0.5000000 0.3700000), wk = 0.0026042 k( 372) = ( 0.5000000 0.5000000 0.3800000), wk = 0.0026042 k( 373) = ( 0.5000000 0.5000000 0.3900000), wk = 0.0026042 k( 374) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0026042 k( 375) = ( 0.5000000 0.5000000 0.4100000), wk = 0.0026042 k( 376) = ( 0.5000000 0.5000000 0.4200000), wk = 0.0026042 k( 377) = ( 0.5000000 0.5000000 0.4300000), wk = 0.0026042 k( 378) = ( 0.5000000 0.5000000 0.4400000), wk = 0.0026042 k( 379) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0026042 k( 380) = ( 0.5000000 0.5000000 0.4600000), wk = 0.0026042 k( 381) = ( 0.5000000 0.5000000 0.4700000), wk = 0.0026042 k( 382) = ( 0.5000000 0.5000000 0.4800000), wk = 0.0026042 k( 383) = ( 0.5000000 0.5000000 0.4900000), wk = 0.0026042 k( 384) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 2) = ( 0.0000000 0.0100000 0.0000000), wk = 0.0026042 k( 3) = ( 0.0000000 0.0200000 0.0000000), wk = 0.0026042 k( 4) = ( 0.0000000 0.0300000 0.0000000), wk = 0.0026042 k( 5) = ( 0.0000000 0.0400000 0.0000000), wk = 0.0026042 k( 6) = ( 0.0000000 0.0500000 0.0000000), wk = 0.0026042 k( 7) = ( 0.0000000 0.0600000 0.0000000), wk = 0.0026042 k( 8) = ( 0.0000000 0.0700000 0.0000000), wk = 0.0026042 k( 9) = ( 0.0000000 0.0800000 0.0000000), wk = 0.0026042 k( 10) = ( 0.0000000 0.0900000 0.0000000), wk = 0.0026042 k( 11) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0026042 k( 12) = ( 0.0000000 0.1100000 0.0000000), wk = 0.0026042 k( 13) = ( 0.0000000 0.1200000 0.0000000), wk = 0.0026042 k( 14) = ( 0.0000000 0.1300000 0.0000000), wk = 0.0026042 k( 15) = ( 0.0000000 0.1400000 0.0000000), wk = 0.0026042 k( 16) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0026042 k( 17) = ( 0.0000000 0.1600000 0.0000000), wk = 0.0026042 k( 18) = ( 0.0000000 0.1700000 0.0000000), wk = 0.0026042 k( 19) = ( 0.0000000 0.1800000 0.0000000), wk = 0.0026042 k( 20) = ( 0.0000000 0.1900000 0.0000000), wk = 0.0026042 k( 21) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0026042 k( 22) = ( 0.0000000 0.2100000 0.0000000), wk = 0.0026042 k( 23) = ( 0.0000000 0.2200000 0.0000000), wk = 0.0026042 k( 24) = ( 0.0000000 0.2300000 0.0000000), wk = 0.0026042 k( 25) = ( 0.0000000 0.2400000 0.0000000), wk = 0.0026042 k( 26) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0026042 k( 27) = ( 0.0000000 0.2600000 0.0000000), wk = 0.0026042 k( 28) = ( 0.0000000 0.2700000 0.0000000), wk = 0.0026042 k( 29) = ( 0.0000000 0.2800000 0.0000000), wk = 0.0026042 k( 30) = ( 0.0000000 0.2900000 0.0000000), wk = 0.0026042 k( 31) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0026042 k( 32) = ( 0.0000000 0.3100000 0.0000000), wk = 0.0026042 k( 33) = ( 0.0000000 0.3200000 0.0000000), wk = 0.0026042 k( 34) = ( 0.0000000 0.3300000 0.0000000), wk = 0.0026042 k( 35) = ( 0.0000000 0.3400000 0.0000000), wk = 0.0026042 k( 36) = ( 0.0000000 0.3500000 0.0000000), wk = 0.0026042 k( 37) = ( 0.0000000 0.3600000 0.0000000), wk = 0.0026042 k( 38) = ( 0.0000000 0.3700000 0.0000000), wk = 0.0026042 k( 39) = ( 0.0000000 0.3800000 0.0000000), wk = 0.0026042 k( 40) = ( 0.0000000 0.3900000 0.0000000), wk = 0.0026042 k( 41) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0026042 k( 42) = ( 0.0000000 0.4100000 0.0000000), wk = 0.0026042 k( 43) = ( 0.0000000 0.4200000 0.0000000), wk = 0.0026042 k( 44) = ( 0.0000000 0.4300000 0.0000000), wk = 0.0026042 k( 45) = ( 0.0000000 0.4400000 0.0000000), wk = 0.0026042 k( 46) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0026042 k( 47) = ( 0.0000000 0.4600000 0.0000000), wk = 0.0026042 k( 48) = ( 0.0000000 0.4700000 0.0000000), wk = 0.0026042 k( 49) = ( 0.0000000 0.4800000 0.0000000), wk = 0.0026042 k( 50) = ( 0.0000000 0.4900000 0.0000000), wk = 0.0026042 k( 51) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026042 k( 52) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026042 k( 53) = ( 0.0100000 0.5000000 0.0000000), wk = 0.0026042 k( 54) = ( 0.0200000 0.5000000 0.0000000), wk = 0.0026042 k( 55) = ( 0.0300000 0.5000000 0.0000000), wk = 0.0026042 k( 56) = ( 0.0400000 0.5000000 0.0000000), wk = 0.0026042 k( 57) = ( 0.0500000 0.5000000 0.0000000), wk = 0.0026042 k( 58) = ( 0.0600000 0.5000000 0.0000000), wk = 0.0026042 k( 59) = ( 0.0700000 0.5000000 0.0000000), wk = 0.0026042 k( 60) = ( 0.0800000 0.5000000 0.0000000), wk = 0.0026042 k( 61) = ( 0.0900000 0.5000000 0.0000000), wk = 0.0026042 k( 62) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0026042 k( 63) = ( 0.1100000 0.5000000 0.0000000), wk = 0.0026042 k( 64) = ( 0.1200000 0.5000000 0.0000000), wk = 0.0026042 k( 65) = ( 0.1300000 0.5000000 0.0000000), wk = 0.0026042 k( 66) = ( 0.1400000 0.5000000 0.0000000), wk = 0.0026042 k( 67) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0026042 k( 68) = ( 0.1600000 0.5000000 0.0000000), wk = 0.0026042 k( 69) = ( 0.1700000 0.5000000 0.0000000), wk = 0.0026042 k( 70) = ( 0.1800000 0.5000000 0.0000000), wk = 0.0026042 k( 71) = ( 0.1900000 0.5000000 0.0000000), wk = 0.0026042 k( 72) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0026042 k( 73) = ( 0.2100000 0.5000000 0.0000000), wk = 0.0026042 k( 74) = ( 0.2200000 0.5000000 0.0000000), wk = 0.0026042 k( 75) = ( 0.2300000 0.5000000 0.0000000), wk = 0.0026042 k( 76) = ( 0.2400000 0.5000000 0.0000000), wk = 0.0026042 k( 77) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0026042 k( 78) = ( 0.2600000 0.5000000 0.0000000), wk = 0.0026042 k( 79) = ( 0.2700000 0.5000000 0.0000000), wk = 0.0026042 k( 80) = ( 0.2800000 0.5000000 0.0000000), wk = 0.0026042 k( 81) = ( 0.2900000 0.5000000 -0.0000000), wk = 0.0026042 k( 82) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0026042 k( 83) = ( 0.3100000 0.5000000 0.0000000), wk = 0.0026042 k( 84) = ( 0.3200000 0.5000000 0.0000000), wk = 0.0026042 k( 85) = ( 0.3300000 0.5000000 -0.0000000), wk = 0.0026042 k( 86) = ( 0.3400000 0.5000000 0.0000000), wk = 0.0026042 k( 87) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0026042 k( 88) = ( 0.3600000 0.5000000 0.0000000), wk = 0.0026042 k( 89) = ( 0.3700000 0.5000000 0.0000000), wk = 0.0026042 k( 90) = ( 0.3800000 0.5000000 0.0000000), wk = 0.0026042 k( 91) = ( 0.3900000 0.5000000 0.0000000), wk = 0.0026042 k( 92) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0026042 k( 93) = ( 0.4100000 0.5000000 0.0000000), wk = 0.0026042 k( 94) = ( 0.4200000 0.5000000 0.0000000), wk = 0.0026042 k( 95) = ( 0.4300000 0.5000000 0.0000000), wk = 0.0026042 k( 96) = ( 0.4400000 0.5000000 0.0000000), wk = 0.0026042 k( 97) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0026042 k( 98) = ( 0.4600000 0.5000000 0.0000000), wk = 0.0026042 k( 99) = ( 0.4700000 0.5000000 0.0000000), wk = 0.0026042 k( 100) = ( 0.4800000 0.5000000 0.0000000), wk = 0.0026042 k( 101) = ( 0.4900000 0.5000000 0.0000000), wk = 0.0026042 k( 102) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026042 k( 103) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026042 k( 104) = ( 0.4929577 0.4929577 0.0000000), wk = 0.0026042 k( 105) = ( 0.4859155 0.4859155 0.0000000), wk = 0.0026042 k( 106) = ( 0.4788732 0.4788732 0.0000000), wk = 0.0026042 k( 107) = ( 0.4718310 0.4718310 0.0000000), wk = 0.0026042 k( 108) = ( 0.4647887 0.4647887 0.0000000), wk = 0.0026042 k( 109) = ( 0.4577465 0.4577465 0.0000000), wk = 0.0026042 k( 110) = ( 0.4507042 0.4507042 0.0000000), wk = 0.0026042 k( 111) = ( 0.4436620 0.4436620 0.0000000), wk = 0.0026042 k( 112) = ( 0.4366197 0.4366197 0.0000000), wk = 0.0026042 k( 113) = ( 0.4295775 0.4295775 0.0000000), wk = 0.0026042 k( 114) = ( 0.4225352 0.4225352 0.0000000), wk = 0.0026042 k( 115) = ( 0.4154930 0.4154930 0.0000000), wk = 0.0026042 k( 116) = ( 0.4084507 0.4084507 0.0000000), wk = 0.0026042 k( 117) = ( 0.4014085 0.4014085 0.0000000), wk = 0.0026042 k( 118) = ( 0.3943662 0.3943662 0.0000000), wk = 0.0026042 k( 119) = ( 0.3873239 0.3873239 0.0000000), wk = 0.0026042 k( 120) = ( 0.3802817 0.3802817 0.0000000), wk = 0.0026042 k( 121) = ( 0.3732394 0.3732394 0.0000000), wk = 0.0026042 k( 122) = ( 0.3661972 0.3661972 0.0000000), wk = 0.0026042 k( 123) = ( 0.3591549 0.3591549 -0.0000000), wk = 0.0026042 k( 124) = ( 0.3521127 0.3521127 0.0000000), wk = 0.0026042 k( 125) = ( 0.3450704 0.3450704 0.0000000), wk = 0.0026042 k( 126) = ( 0.3380282 0.3380282 0.0000000), wk = 0.0026042 k( 127) = ( 0.3309859 0.3309859 0.0000000), wk = 0.0026042 k( 128) = ( 0.3239437 0.3239437 0.0000000), wk = 0.0026042 k( 129) = ( 0.3169014 0.3169014 -0.0000000), wk = 0.0026042 k( 130) = ( 0.3098592 0.3098592 -0.0000000), wk = 0.0026042 k( 131) = ( 0.3028169 0.3028169 -0.0000000), wk = 0.0026042 k( 132) = ( 0.2957746 0.2957746 0.0000000), wk = 0.0026042 k( 133) = ( 0.2887324 0.2887324 0.0000000), wk = 0.0026042 k( 134) = ( 0.2816901 0.2816901 0.0000000), wk = 0.0026042 k( 135) = ( 0.2746479 0.2746479 0.0000000), wk = 0.0026042 k( 136) = ( 0.2676056 0.2676056 0.0000000), wk = 0.0026042 k( 137) = ( 0.2605634 0.2605634 0.0000000), wk = 0.0026042 k( 138) = ( 0.2535211 0.2535211 0.0000000), wk = 0.0026042 k( 139) = ( 0.2464789 0.2464789 0.0000000), wk = 0.0026042 k( 140) = ( 0.2394366 0.2394366 0.0000000), wk = 0.0026042 k( 141) = ( 0.2323944 0.2323944 0.0000000), wk = 0.0026042 k( 142) = ( 0.2253521 0.2253521 0.0000000), wk = 0.0026042 k( 143) = ( 0.2183099 0.2183099 0.0000000), wk = 0.0026042 k( 144) = ( 0.2112676 0.2112676 0.0000000), wk = 0.0026042 k( 145) = ( 0.2042253 0.2042253 0.0000000), wk = 0.0026042 k( 146) = ( 0.1971831 0.1971831 0.0000000), wk = 0.0026042 k( 147) = ( 0.1901409 0.1901409 0.0000000), wk = 0.0026042 k( 148) = ( 0.1830986 0.1830986 0.0000000), wk = 0.0026042 k( 149) = ( 0.1760563 0.1760563 0.0000000), wk = 0.0026042 k( 150) = ( 0.1690141 0.1690141 0.0000000), wk = 0.0026042 k( 151) = ( 0.1619718 0.1619718 0.0000000), wk = 0.0026042 k( 152) = ( 0.1549296 0.1549296 -0.0000000), wk = 0.0026042 k( 153) = ( 0.1478873 0.1478873 -0.0000000), wk = 0.0026042 k( 154) = ( 0.1408451 0.1408451 0.0000000), wk = 0.0026042 k( 155) = ( 0.1338028 0.1338028 0.0000000), wk = 0.0026042 k( 156) = ( 0.1267606 0.1267606 0.0000000), wk = 0.0026042 k( 157) = ( 0.1197183 0.1197183 0.0000000), wk = 0.0026042 k( 158) = ( 0.1126761 0.1126761 0.0000000), wk = 0.0026042 k( 159) = ( 0.1056338 0.1056338 0.0000000), wk = 0.0026042 k( 160) = ( 0.0985916 0.0985916 0.0000000), wk = 0.0026042 k( 161) = ( 0.0915493 0.0915493 0.0000000), wk = 0.0026042 k( 162) = ( 0.0845070 0.0845070 0.0000000), wk = 0.0026042 k( 163) = ( 0.0774648 0.0774648 -0.0000000), wk = 0.0026042 k( 164) = ( 0.0704225 0.0704225 -0.0000000), wk = 0.0026042 k( 165) = ( 0.0633803 0.0633803 0.0000000), wk = 0.0026042 k( 166) = ( 0.0563380 0.0563380 0.0000000), wk = 0.0026042 k( 167) = ( 0.0492958 0.0492958 0.0000000), wk = 0.0026042 k( 168) = ( 0.0422535 0.0422535 0.0000000), wk = 0.0026042 k( 169) = ( 0.0352113 0.0352113 -0.0000000), wk = 0.0026042 k( 170) = ( 0.0281690 0.0281690 0.0000000), wk = 0.0026042 k( 171) = ( 0.0211268 0.0211268 0.0000000), wk = 0.0026042 k( 172) = ( 0.0140845 0.0140845 0.0000000), wk = 0.0026042 k( 173) = ( 0.0070422 0.0070422 -0.0000000), wk = 0.0026042 k( 174) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 175) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 176) = ( 0.0058140 0.0058140 0.0058140), wk = 0.0026042 k( 177) = ( 0.0116279 0.0116279 0.0116279), wk = 0.0026042 k( 178) = ( 0.0174419 0.0174419 0.0174419), wk = 0.0026042 k( 179) = ( 0.0232558 0.0232558 0.0232558), wk = 0.0026042 k( 180) = ( 0.0290698 0.0290698 0.0290698), wk = 0.0026042 k( 181) = ( 0.0348837 0.0348837 0.0348837), wk = 0.0026042 k( 182) = ( 0.0406977 0.0406977 0.0406977), wk = 0.0026042 k( 183) = ( 0.0465116 0.0465116 0.0465116), wk = 0.0026042 k( 184) = ( 0.0523256 0.0523256 0.0523256), wk = 0.0026042 k( 185) = ( 0.0581395 0.0581395 0.0581395), wk = 0.0026042 k( 186) = ( 0.0639535 0.0639535 0.0639535), wk = 0.0026042 k( 187) = ( 0.0697674 0.0697674 0.0697674), wk = 0.0026042 k( 188) = ( 0.0755814 0.0755814 0.0755814), wk = 0.0026042 k( 189) = ( 0.0813954 0.0813954 0.0813954), wk = 0.0026042 k( 190) = ( 0.0872093 0.0872093 0.0872093), wk = 0.0026042 k( 191) = ( 0.0930233 0.0930233 0.0930233), wk = 0.0026042 k( 192) = ( 0.0988372 0.0988372 0.0988372), wk = 0.0026042 k( 193) = ( 0.1046512 0.1046512 0.1046512), wk = 0.0026042 k( 194) = ( 0.1104651 0.1104651 0.1104651), wk = 0.0026042 k( 195) = ( 0.1162791 0.1162791 0.1162791), wk = 0.0026042 k( 196) = ( 0.1220930 0.1220930 0.1220930), wk = 0.0026042 k( 197) = ( 0.1279070 0.1279070 0.1279070), wk = 0.0026042 k( 198) = ( 0.1337209 0.1337209 0.1337209), wk = 0.0026042 k( 199) = ( 0.1395349 0.1395349 0.1395349), wk = 0.0026042 k( 200) = ( 0.1453488 0.1453488 0.1453488), wk = 0.0026042 k( 201) = ( 0.1511628 0.1511628 0.1511628), wk = 0.0026042 k( 202) = ( 0.1569767 0.1569767 0.1569767), wk = 0.0026042 k( 203) = ( 0.1627907 0.1627907 0.1627907), wk = 0.0026042 k( 204) = ( 0.1686046 0.1686046 0.1686046), wk = 0.0026042 k( 205) = ( 0.1744186 0.1744186 0.1744186), wk = 0.0026042 k( 206) = ( 0.1802326 0.1802326 0.1802326), wk = 0.0026042 k( 207) = ( 0.1860465 0.1860465 0.1860465), wk = 0.0026042 k( 208) = ( 0.1918605 0.1918605 0.1918605), wk = 0.0026042 k( 209) = ( 0.1976744 0.1976744 0.1976744), wk = 0.0026042 k( 210) = ( 0.2034884 0.2034884 0.2034884), wk = 0.0026042 k( 211) = ( 0.2093023 0.2093023 0.2093023), wk = 0.0026042 k( 212) = ( 0.2151163 0.2151163 0.2151163), wk = 0.0026042 k( 213) = ( 0.2209302 0.2209302 0.2209302), wk = 0.0026042 k( 214) = ( 0.2267442 0.2267442 0.2267442), wk = 0.0026042 k( 215) = ( 0.2325581 0.2325581 0.2325581), wk = 0.0026042 k( 216) = ( 0.2383721 0.2383721 0.2383721), wk = 0.0026042 k( 217) = ( 0.2441860 0.2441860 0.2441860), wk = 0.0026042 k( 218) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026042 k( 219) = ( 0.2558140 0.2558140 0.2558140), wk = 0.0026042 k( 220) = ( 0.2616279 0.2616279 0.2616279), wk = 0.0026042 k( 221) = ( 0.2674419 0.2674419 0.2674419), wk = 0.0026042 k( 222) = ( 0.2732558 0.2732558 0.2732558), wk = 0.0026042 k( 223) = ( 0.2790698 0.2790698 0.2790698), wk = 0.0026042 k( 224) = ( 0.2848837 0.2848837 0.2848837), wk = 0.0026042 k( 225) = ( 0.2906977 0.2906977 0.2906977), wk = 0.0026042 k( 226) = ( 0.2965116 0.2965116 0.2965116), wk = 0.0026042 k( 227) = ( 0.3023256 0.3023256 0.3023256), wk = 0.0026042 k( 228) = ( 0.3081395 0.3081395 0.3081395), wk = 0.0026042 k( 229) = ( 0.3139535 0.3139535 0.3139535), wk = 0.0026042 k( 230) = ( 0.3197674 0.3197674 0.3197674), wk = 0.0026042 k( 231) = ( 0.3255814 0.3255814 0.3255814), wk = 0.0026042 k( 232) = ( 0.3313953 0.3313953 0.3313953), wk = 0.0026042 k( 233) = ( 0.3372093 0.3372093 0.3372093), wk = 0.0026042 k( 234) = ( 0.3430233 0.3430233 0.3430233), wk = 0.0026042 k( 235) = ( 0.3488372 0.3488372 0.3488372), wk = 0.0026042 k( 236) = ( 0.3546512 0.3546512 0.3546512), wk = 0.0026042 k( 237) = ( 0.3604651 0.3604651 0.3604651), wk = 0.0026042 k( 238) = ( 0.3662791 0.3662791 0.3662791), wk = 0.0026042 k( 239) = ( 0.3720930 0.3720930 0.3720930), wk = 0.0026042 k( 240) = ( 0.3779070 0.3779070 0.3779070), wk = 0.0026042 k( 241) = ( 0.3837209 0.3837209 0.3837209), wk = 0.0026042 k( 242) = ( 0.3895349 0.3895349 0.3895349), wk = 0.0026042 k( 243) = ( 0.3953488 0.3953488 0.3953488), wk = 0.0026042 k( 244) = ( 0.4011628 0.4011628 0.4011628), wk = 0.0026042 k( 245) = ( 0.4069767 0.4069767 0.4069767), wk = 0.0026042 k( 246) = ( 0.4127907 0.4127907 0.4127907), wk = 0.0026042 k( 247) = ( 0.4186047 0.4186047 0.4186047), wk = 0.0026042 k( 248) = ( 0.4244186 0.4244186 0.4244186), wk = 0.0026042 k( 249) = ( 0.4302326 0.4302326 0.4302326), wk = 0.0026042 k( 250) = ( 0.4360465 0.4360465 0.4360465), wk = 0.0026042 k( 251) = ( 0.4418605 0.4418605 0.4418605), wk = 0.0026042 k( 252) = ( 0.4476744 0.4476744 0.4476744), wk = 0.0026042 k( 253) = ( 0.4534884 0.4534884 0.4534884), wk = 0.0026042 k( 254) = ( 0.4593023 0.4593023 0.4593023), wk = 0.0026042 k( 255) = ( 0.4651163 0.4651163 0.4651163), wk = 0.0026042 k( 256) = ( 0.4709302 0.4709302 0.4709302), wk = 0.0026042 k( 257) = ( 0.4767442 0.4767442 0.4767442), wk = 0.0026042 k( 258) = ( 0.4825581 0.4825581 0.4825581), wk = 0.0026042 k( 259) = ( 0.4883721 0.4883721 0.4883721), wk = 0.0026042 k( 260) = ( 0.4941860 0.4941860 0.4941860), wk = 0.0026042 k( 261) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 k( 262) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 k( 263) = ( 0.4929577 0.5000000 0.4929577), wk = 0.0026042 k( 264) = ( 0.4859155 0.5000000 0.4859155), wk = 0.0026042 k( 265) = ( 0.4788732 0.5000000 0.4788732), wk = 0.0026042 k( 266) = ( 0.4718310 0.5000000 0.4718310), wk = 0.0026042 k( 267) = ( 0.4647887 0.5000000 0.4647887), wk = 0.0026042 k( 268) = ( 0.4577465 0.5000000 0.4577465), wk = 0.0026042 k( 269) = ( 0.4507042 0.5000000 0.4507042), wk = 0.0026042 k( 270) = ( 0.4436620 0.5000000 0.4436620), wk = 0.0026042 k( 271) = ( 0.4366197 0.5000000 0.4366197), wk = 0.0026042 k( 272) = ( 0.4295775 0.5000000 0.4295775), wk = 0.0026042 k( 273) = ( 0.4225352 0.5000000 0.4225352), wk = 0.0026042 k( 274) = ( 0.4154930 0.5000000 0.4154930), wk = 0.0026042 k( 275) = ( 0.4084507 0.5000000 0.4084507), wk = 0.0026042 k( 276) = ( 0.4014085 0.5000000 0.4014085), wk = 0.0026042 k( 277) = ( 0.3943662 0.5000000 0.3943662), wk = 0.0026042 k( 278) = ( 0.3873239 0.5000000 0.3873239), wk = 0.0026042 k( 279) = ( 0.3802817 0.5000000 0.3802817), wk = 0.0026042 k( 280) = ( 0.3732394 0.5000000 0.3732394), wk = 0.0026042 k( 281) = ( 0.3661972 0.5000000 0.3661972), wk = 0.0026042 k( 282) = ( 0.3591549 0.5000000 0.3591549), wk = 0.0026042 k( 283) = ( 0.3521127 0.5000000 0.3521127), wk = 0.0026042 k( 284) = ( 0.3450704 0.5000000 0.3450704), wk = 0.0026042 k( 285) = ( 0.3380282 0.5000000 0.3380282), wk = 0.0026042 k( 286) = ( 0.3309859 0.5000000 0.3309859), wk = 0.0026042 k( 287) = ( 0.3239437 0.5000000 0.3239437), wk = 0.0026042 k( 288) = ( 0.3169014 0.5000000 0.3169014), wk = 0.0026042 k( 289) = ( 0.3098592 0.5000000 0.3098592), wk = 0.0026042 k( 290) = ( 0.3028169 0.5000000 0.3028169), wk = 0.0026042 k( 291) = ( 0.2957746 0.5000000 0.2957746), wk = 0.0026042 k( 292) = ( 0.2887324 0.5000000 0.2887324), wk = 0.0026042 k( 293) = ( 0.2816901 0.5000000 0.2816901), wk = 0.0026042 k( 294) = ( 0.2746479 0.5000000 0.2746479), wk = 0.0026042 k( 295) = ( 0.2676056 0.5000000 0.2676056), wk = 0.0026042 k( 296) = ( 0.2605634 0.5000000 0.2605634), wk = 0.0026042 k( 297) = ( 0.2535211 0.5000000 0.2535211), wk = 0.0026042 k( 298) = ( 0.2464789 0.5000000 0.2464789), wk = 0.0026042 k( 299) = ( 0.2394366 0.5000000 0.2394366), wk = 0.0026042 k( 300) = ( 0.2323944 0.5000000 0.2323944), wk = 0.0026042 k( 301) = ( 0.2253521 0.5000000 0.2253521), wk = 0.0026042 k( 302) = ( 0.2183099 0.5000000 0.2183099), wk = 0.0026042 k( 303) = ( 0.2112676 0.5000000 0.2112676), wk = 0.0026042 k( 304) = ( 0.2042253 0.5000000 0.2042253), wk = 0.0026042 k( 305) = ( 0.1971831 0.5000000 0.1971831), wk = 0.0026042 k( 306) = ( 0.1901409 0.5000000 0.1901409), wk = 0.0026042 k( 307) = ( 0.1830986 0.5000000 0.1830986), wk = 0.0026042 k( 308) = ( 0.1760563 0.5000000 0.1760563), wk = 0.0026042 k( 309) = ( 0.1690141 0.5000000 0.1690141), wk = 0.0026042 k( 310) = ( 0.1619718 0.5000000 0.1619718), wk = 0.0026042 k( 311) = ( 0.1549296 0.5000000 0.1549296), wk = 0.0026042 k( 312) = ( 0.1478873 0.5000000 0.1478873), wk = 0.0026042 k( 313) = ( 0.1408451 0.5000000 0.1408451), wk = 0.0026042 k( 314) = ( 0.1338028 0.5000000 0.1338028), wk = 0.0026042 k( 315) = ( 0.1267606 0.5000000 0.1267606), wk = 0.0026042 k( 316) = ( 0.1197183 0.5000000 0.1197183), wk = 0.0026042 k( 317) = ( 0.1126761 0.5000000 0.1126761), wk = 0.0026042 k( 318) = ( 0.1056338 0.5000000 0.1056338), wk = 0.0026042 k( 319) = ( 0.0985916 0.5000000 0.0985916), wk = 0.0026042 k( 320) = ( 0.0915493 0.5000000 0.0915493), wk = 0.0026042 k( 321) = ( 0.0845070 0.5000000 0.0845070), wk = 0.0026042 k( 322) = ( 0.0774648 0.5000000 0.0774648), wk = 0.0026042 k( 323) = ( 0.0704225 0.5000000 0.0704225), wk = 0.0026042 k( 324) = ( 0.0633803 0.5000000 0.0633803), wk = 0.0026042 k( 325) = ( 0.0563380 0.5000000 0.0563380), wk = 0.0026042 k( 326) = ( 0.0492958 0.5000000 0.0492958), wk = 0.0026042 k( 327) = ( 0.0422535 0.5000000 0.0422535), wk = 0.0026042 k( 328) = ( 0.0352113 0.5000000 0.0352113), wk = 0.0026042 k( 329) = ( 0.0281690 0.5000000 0.0281690), wk = 0.0026042 k( 330) = ( 0.0211268 0.5000000 0.0211268), wk = 0.0026042 k( 331) = ( 0.0140845 0.5000000 0.0140845), wk = 0.0026042 k( 332) = ( 0.0070422 0.5000000 0.0070422), wk = 0.0026042 k( 333) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026042 k( 334) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026042 k( 335) = ( 0.5000000 0.5000000 0.0100000), wk = 0.0026042 k( 336) = ( 0.5000000 0.5000000 0.0200000), wk = 0.0026042 k( 337) = ( 0.5000000 0.5000000 0.0300000), wk = 0.0026042 k( 338) = ( 0.5000000 0.5000000 0.0400000), wk = 0.0026042 k( 339) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0026042 k( 340) = ( 0.5000000 0.5000000 0.0600000), wk = 0.0026042 k( 341) = ( 0.5000000 0.5000000 0.0700000), wk = 0.0026042 k( 342) = ( 0.5000000 0.5000000 0.0800000), wk = 0.0026042 k( 343) = ( 0.5000000 0.5000000 0.0900000), wk = 0.0026042 k( 344) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0026042 k( 345) = ( 0.5000000 0.5000000 0.1100000), wk = 0.0026042 k( 346) = ( 0.5000000 0.5000000 0.1200000), wk = 0.0026042 k( 347) = ( 0.5000000 0.5000000 0.1300000), wk = 0.0026042 k( 348) = ( 0.5000000 0.5000000 0.1400000), wk = 0.0026042 k( 349) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0026042 k( 350) = ( 0.5000000 0.5000000 0.1600000), wk = 0.0026042 k( 351) = ( 0.5000000 0.5000000 0.1700000), wk = 0.0026042 k( 352) = ( 0.5000000 0.5000000 0.1800000), wk = 0.0026042 k( 353) = ( 0.5000000 0.5000000 0.1900000), wk = 0.0026042 k( 354) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0026042 k( 355) = ( 0.5000000 0.5000000 0.2100000), wk = 0.0026042 k( 356) = ( 0.5000000 0.5000000 0.2200000), wk = 0.0026042 k( 357) = ( 0.5000000 0.5000000 0.2300000), wk = 0.0026042 k( 358) = ( 0.5000000 0.5000000 0.2400000), wk = 0.0026042 k( 359) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0026042 k( 360) = ( 0.5000000 0.5000000 0.2600000), wk = 0.0026042 k( 361) = ( 0.5000000 0.5000000 0.2700000), wk = 0.0026042 k( 362) = ( 0.5000000 0.5000000 0.2800000), wk = 0.0026042 k( 363) = ( 0.5000000 0.5000000 0.2900000), wk = 0.0026042 k( 364) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0026042 k( 365) = ( 0.5000000 0.5000000 0.3100000), wk = 0.0026042 k( 366) = ( 0.5000000 0.5000000 0.3200000), wk = 0.0026042 k( 367) = ( 0.5000000 0.5000000 0.3300000), wk = 0.0026042 k( 368) = ( 0.5000000 0.5000000 0.3400000), wk = 0.0026042 k( 369) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0026042 k( 370) = ( 0.5000000 0.5000000 0.3600000), wk = 0.0026042 k( 371) = ( 0.5000000 0.5000000 0.3700000), wk = 0.0026042 k( 372) = ( 0.5000000 0.5000000 0.3800000), wk = 0.0026042 k( 373) = ( 0.5000000 0.5000000 0.3900000), wk = 0.0026042 k( 374) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0026042 k( 375) = ( 0.5000000 0.5000000 0.4100000), wk = 0.0026042 k( 376) = ( 0.5000000 0.5000000 0.4200000), wk = 0.0026042 k( 377) = ( 0.5000000 0.5000000 0.4300000), wk = 0.0026042 k( 378) = ( 0.5000000 0.5000000 0.4400000), wk = 0.0026042 k( 379) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0026042 k( 380) = ( 0.5000000 0.5000000 0.4600000), wk = 0.0026042 k( 381) = ( 0.5000000 0.5000000 0.4700000), wk = 0.0026042 k( 382) = ( 0.5000000 0.5000000 0.4800000), wk = 0.0026042 k( 383) = ( 0.5000000 0.5000000 0.4900000), wk = 0.0026042 k( 384) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 Dense grid: 34457 G-vectors FFT dimensions: ( 45, 45, 45) Smooth grid: 13205 G-vectors FFT dimensions: ( 30, 30, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.05 Mb ( 98, 36) NL pseudopotentials 0.05 Mb ( 49, 68) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 957) G-vector shells 0.00 Mb ( 260) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.22 Mb ( 98, 144) Each subspace H/S matrix 0.02 Mb ( 36, 36) Each matrix 0.07 Mb ( 68, 2, 36) The potential is recalculated from file : ./TaTc.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 7.4 secs Computing kpt #: 2 total cpu time spent up to now is 7.5 secs Computing kpt #: 3 total cpu time spent up to now is 7.7 secs Computing kpt #: 4 total cpu time spent up to now is 7.8 secs Computing kpt #: 5 total cpu time spent up to now is 7.9 secs Computing kpt #: 6 total cpu time spent up to now is 8.0 secs Computing kpt #: 7 total cpu time spent up to now is 8.2 secs Computing kpt #: 8 total cpu time spent up to now is 8.3 secs Computing kpt #: 9 total cpu time spent up to now is 8.4 secs Computing kpt #: 10 total cpu time spent up to now is 8.5 secs Computing kpt #: 11 total cpu time spent up to now is 8.7 secs Computing kpt #: 12 total cpu time spent up to now is 8.8 secs Computing kpt #: 13 total cpu time spent up to now is 8.9 secs Computing kpt #: 14 total cpu time spent up to now is 9.0 secs Computing kpt #: 15 total cpu time spent up to now is 9.2 secs Computing kpt #: 16 total cpu time spent up to now is 9.3 secs Computing kpt #: 17 total cpu time spent up to now is 9.4 secs Computing kpt #: 18 total cpu time spent up to now is 9.5 secs Computing kpt #: 19 total cpu time spent up to now is 9.6 secs Computing kpt #: 20 total cpu time spent up to now is 9.8 secs Computing kpt #: 21 total cpu time spent up to now is 9.9 secs Computing kpt #: 22 total cpu time spent up to now is 10.0 secs Computing kpt #: 23 total cpu time spent up to now is 10.1 secs Computing kpt #: 24 total cpu time spent up to now is 10.2 secs Computing kpt #: 25 total cpu time spent up to now is 10.3 secs Computing kpt #: 26 total cpu time spent up to now is 10.4 secs Computing kpt #: 27 total cpu time spent up to now is 10.6 secs Computing kpt #: 28 total cpu time spent up to now is 10.7 secs Computing kpt #: 29 total cpu time spent up to now is 10.8 secs Computing kpt #: 30 total cpu time spent up to now is 10.9 secs Computing kpt #: 31 total cpu time spent up to now is 11.0 secs Computing kpt #: 32 total cpu time spent up to now is 11.1 secs Computing kpt #: 33 total cpu time spent up to now is 11.2 secs Computing kpt #: 34 total cpu time spent up to now is 11.4 secs Computing kpt #: 35 total cpu time spent up to now is 11.5 secs Computing kpt #: 36 total cpu time spent up to now is 11.6 secs Computing kpt #: 37 total cpu time spent up to now is 11.7 secs Computing kpt #: 38 total cpu time spent up to now is 11.8 secs Computing kpt #: 39 total cpu time spent up to now is 11.9 secs Computing kpt #: 40 total cpu time spent up to now is 12.0 secs Computing kpt #: 41 total cpu time spent up to now is 12.2 secs Computing kpt #: 42 total cpu time spent up to now is 12.3 secs Computing kpt #: 43 total cpu time spent up to now is 12.4 secs Computing kpt #: 44 total cpu time spent up to now is 12.5 secs Computing kpt #: 45 total cpu time spent up to now is 12.6 secs Computing kpt #: 46 total cpu time spent up to now is 12.7 secs Computing kpt #: 47 total cpu time spent up to now is 12.8 secs Computing kpt #: 48 total cpu time spent up to now is 12.9 secs Computing kpt #: 49 total cpu time spent up to now is 13.1 secs Computing kpt #: 50 total cpu time spent up to now is 13.2 secs Computing kpt #: 51 total cpu time spent up to now is 13.3 secs Computing kpt #: 52 total cpu time spent up to now is 13.4 secs Computing kpt #: 53 total cpu time spent up to now is 13.5 secs Computing kpt #: 54 total cpu time spent up to now is 13.6 secs Computing kpt #: 55 total cpu time spent up to now is 13.7 secs Computing kpt #: 56 total cpu time spent up to now is 13.8 secs Computing kpt #: 57 total cpu time spent up to now is 14.0 secs Computing kpt #: 58 total cpu time spent up to now is 14.1 secs Computing kpt #: 59 total cpu time spent up to now is 14.2 secs Computing kpt #: 60 total cpu time spent up to now is 14.3 secs Computing kpt #: 61 total cpu time spent up to now is 14.4 secs Computing kpt #: 62 total cpu time spent up to now is 14.5 secs Computing kpt #: 63 total cpu time spent up to now is 14.6 secs Computing kpt #: 64 total cpu time spent up to now is 14.8 secs Computing kpt #: 65 total cpu time spent up to now is 14.9 secs Computing kpt #: 66 total cpu time spent up to now is 15.0 secs Computing kpt #: 67 total cpu time spent up to now is 15.1 secs Computing kpt #: 68 total cpu time spent up to now is 15.2 secs Computing kpt #: 69 total cpu time spent up to now is 15.3 secs Computing kpt #: 70 total cpu time spent up to now is 15.4 secs Computing kpt #: 71 total cpu time spent up to now is 15.5 secs Computing kpt #: 72 total cpu time spent up to now is 15.7 secs Computing kpt #: 73 total cpu time spent up to now is 15.8 secs Computing kpt #: 74 total cpu time spent up to now is 15.9 secs Computing kpt #: 75 total cpu time spent up to now is 16.0 secs Computing kpt #: 76 total cpu time spent up to now is 16.1 secs Computing kpt #: 77 total cpu time spent up to now is 16.2 secs Computing kpt #: 78 total cpu time spent up to now is 16.3 secs Computing kpt #: 79 total cpu time spent up to now is 16.5 secs Computing kpt #: 80 total cpu time spent up to now is 16.6 secs Computing kpt #: 81 total cpu time spent up to now is 16.7 secs Computing kpt #: 82 total cpu time spent up to now is 16.8 secs Computing kpt #: 83 total cpu time spent up to now is 16.9 secs Computing kpt #: 84 total cpu time spent up to now is 17.1 secs Computing kpt #: 85 total cpu time spent up to now is 17.2 secs Computing kpt #: 86 total cpu time spent up to now is 17.3 secs Computing kpt #: 87 total cpu time spent up to now is 17.5 secs Computing kpt #: 88 total cpu time spent up to now is 17.7 secs Computing kpt #: 89 total cpu time spent up to now is 17.9 secs Computing kpt #: 90 total cpu time spent up to now is 18.1 secs Computing kpt #: 91 total cpu time spent up to now is 18.2 secs Computing kpt #: 92 total cpu time spent up to now is 18.3 secs Computing kpt #: 93 total cpu time spent up to now is 18.5 secs Computing kpt #: 94 total cpu time spent up to now is 18.6 secs Computing kpt #: 95 total cpu time spent up to now is 18.7 secs Computing kpt #: 96 total cpu time spent up to now is 18.8 secs Computing kpt #: 97 total cpu time spent up to now is 19.0 secs Computing kpt #: 98 total cpu time spent up to now is 19.1 secs Computing kpt #: 99 total cpu time spent up to now is 19.2 secs Computing kpt #: 100 total cpu time spent up to now is 19.3 secs Computing kpt #: 101 total cpu time spent up to now is 19.4 secs Computing kpt #: 102 total cpu time spent up to now is 19.5 secs Computing kpt #: 103 total cpu time spent up to now is 19.6 secs Computing kpt #: 104 total cpu time spent up to now is 19.7 secs Computing kpt #: 105 total cpu time spent up to now is 19.9 secs Computing kpt #: 106 total cpu time spent up to now is 20.0 secs Computing kpt #: 107 total cpu time spent up to now is 20.1 secs Computing kpt #: 108 total cpu time spent up to now is 20.2 secs Computing kpt #: 109 total cpu time spent up to now is 20.3 secs Computing kpt #: 110 total cpu time spent up to now is 20.4 secs Computing kpt #: 111 total cpu time spent up to now is 20.6 secs Computing kpt #: 112 total cpu time spent up to now is 20.8 secs Computing kpt #: 113 total cpu time spent up to now is 21.0 secs Computing kpt #: 114 total cpu time spent up to now is 21.2 secs Computing kpt #: 115 total cpu time spent up to now is 21.4 secs Computing kpt #: 116 total cpu time spent up to now is 21.5 secs Computing kpt #: 117 total cpu time spent up to now is 21.7 secs Computing kpt #: 118 total cpu time spent up to now is 21.8 secs Computing kpt #: 119 total cpu time spent up to now is 21.9 secs Computing kpt #: 120 total cpu time spent up to now is 22.0 secs Computing kpt #: 121 total cpu time spent up to now is 22.1 secs Computing kpt #: 122 total cpu time spent up to now is 22.2 secs Computing kpt #: 123 total cpu time spent up to now is 22.4 secs Computing kpt #: 124 total cpu time spent up to now is 22.5 secs Computing kpt #: 125 total cpu time spent up to now is 22.6 secs Computing kpt #: 126 total cpu time spent up to now is 22.7 secs Computing kpt #: 127 total cpu time spent up to now is 22.8 secs Computing kpt #: 128 total cpu time spent up to now is 22.9 secs Computing kpt #: 129 total cpu time spent up to now is 23.0 secs Computing kpt #: 130 total cpu time spent up to now is 23.1 secs Computing kpt #: 131 total cpu time spent up to now is 23.3 secs Computing kpt #: 132 total cpu time spent up to now is 23.4 secs Computing kpt #: 133 total cpu time spent up to now is 23.5 secs Computing kpt #: 134 total cpu time spent up to now is 23.6 secs Computing kpt #: 135 total cpu time spent up to now is 23.7 secs Computing kpt #: 136 total cpu time spent up to now is 23.8 secs Computing kpt #: 137 total cpu time spent up to now is 23.9 secs Computing kpt #: 138 total cpu time spent up to now is 24.0 secs Computing kpt #: 139 total cpu time spent up to now is 24.1 secs Computing kpt #: 140 total cpu time spent up to now is 24.3 secs Computing kpt #: 141 total cpu time spent up to now is 24.4 secs Computing kpt #: 142 total cpu time spent up to now is 24.5 secs Computing kpt #: 143 total cpu time spent up to now is 24.6 secs Computing kpt #: 144 total cpu time spent up to now is 24.7 secs Computing kpt #: 145 total cpu time spent up to now is 24.8 secs Computing kpt #: 146 total cpu time spent up to now is 24.9 secs Computing kpt #: 147 total cpu time spent up to now is 25.0 secs Computing kpt #: 148 total cpu time spent up to now is 25.1 secs Computing kpt #: 149 total cpu time spent up to now is 25.2 secs Computing kpt #: 150 total cpu time spent up to now is 25.4 secs Computing kpt #: 151 total cpu time spent up to now is 25.5 secs Computing kpt #: 152 total cpu time spent up to now is 25.6 secs Computing kpt #: 153 total cpu time spent up to now is 25.7 secs Computing kpt #: 154 total cpu time spent up to now is 25.8 secs Computing kpt #: 155 total cpu time spent up to now is 25.9 secs Computing kpt #: 156 total cpu time spent up to now is 26.0 secs Computing kpt #: 157 total cpu time spent up to now is 26.2 secs Computing kpt #: 158 total cpu time spent up to now is 26.3 secs Computing kpt #: 159 total cpu time spent up to now is 26.4 secs Computing kpt #: 160 total cpu time spent up to now is 26.5 secs Computing kpt #: 161 total cpu time spent up to now is 26.7 secs Computing kpt #: 162 total cpu time spent up to now is 26.8 secs Computing kpt #: 163 total cpu time spent up to now is 26.9 secs Computing kpt #: 164 total cpu time spent up to now is 27.0 secs Computing kpt #: 165 total cpu time spent up to now is 27.2 secs Computing kpt #: 166 total cpu time spent up to now is 27.3 secs Computing kpt #: 167 total cpu time spent up to now is 27.4 secs Computing kpt #: 168 total cpu time spent up to now is 27.5 secs Computing kpt #: 169 total cpu time spent up to now is 27.7 secs Computing kpt #: 170 total cpu time spent up to now is 27.8 secs Computing kpt #: 171 total cpu time spent up to now is 27.9 secs Computing kpt #: 172 total cpu time spent up to now is 28.0 secs Computing kpt #: 173 total cpu time spent up to now is 28.1 secs Computing kpt #: 174 total cpu time spent up to now is 28.3 secs Computing kpt #: 175 total cpu time spent up to now is 28.4 secs Computing kpt #: 176 total cpu time spent up to now is 28.5 secs Computing kpt #: 177 total cpu time spent up to now is 28.6 secs Computing kpt #: 178 total cpu time spent up to now is 28.8 secs Computing kpt #: 179 total cpu time spent up to now is 28.9 secs Computing kpt #: 180 total cpu time spent up to now is 29.0 secs Computing kpt #: 181 total cpu time spent up to now is 29.1 secs Computing kpt #: 182 total cpu time spent up to now is 29.3 secs Computing kpt #: 183 total cpu time spent up to now is 29.4 secs Computing kpt #: 184 total cpu time spent up to now is 29.5 secs Computing kpt #: 185 total cpu time spent up to now is 29.6 secs Computing kpt #: 186 total cpu time spent up to now is 29.8 secs Computing kpt #: 187 total cpu time spent up to now is 29.9 secs Computing kpt #: 188 total cpu time spent up to now is 30.0 secs Computing kpt #: 189 total cpu time spent up to now is 30.1 secs Computing kpt #: 190 total cpu time spent up to now is 30.3 secs Computing kpt #: 191 total cpu time spent up to now is 30.4 secs Computing kpt #: 192 total cpu time spent up to now is 30.5 secs Computing kpt #: 193 total cpu time spent up to now is 30.6 secs Computing kpt #: 194 total cpu time spent up to now is 30.7 secs Computing kpt #: 195 total cpu time spent up to now is 30.9 secs Computing kpt #: 196 total cpu time spent up to now is 31.0 secs Computing kpt #: 197 total cpu time spent up to now is 31.1 secs Computing kpt #: 198 total cpu time spent up to now is 31.2 secs Computing kpt #: 199 total cpu time spent up to now is 31.3 secs Computing kpt #: 200 total cpu time spent up to now is 31.5 secs Computing kpt #: 201 total cpu time spent up to now is 31.6 secs Computing kpt #: 202 total cpu time spent up to now is 31.7 secs Computing kpt #: 203 total cpu time spent up to now is 31.9 secs Computing kpt #: 204 total cpu time spent up to now is 32.1 secs Computing kpt #: 205 total cpu time spent up to now is 32.2 secs Computing kpt #: 206 total cpu time spent up to now is 32.4 secs Computing kpt #: 207 total cpu time spent up to now is 32.5 secs Computing kpt #: 208 total cpu time spent up to now is 32.7 secs Computing kpt #: 209 total cpu time spent up to now is 32.8 secs Computing kpt #: 210 total cpu time spent up to now is 32.9 secs Computing kpt #: 211 total cpu time spent up to now is 33.1 secs Computing kpt #: 212 total cpu time spent up to now is 33.2 secs Computing kpt #: 213 total cpu time spent up to now is 33.3 secs Computing kpt #: 214 total cpu time spent up to now is 33.5 secs Computing kpt #: 215 total cpu time spent up to now is 33.6 secs Computing kpt #: 216 total cpu time spent up to now is 33.8 secs Computing kpt #: 217 total cpu time spent up to now is 33.9 secs Computing kpt #: 218 total cpu time spent up to now is 34.0 secs Computing kpt #: 219 total cpu time spent up to now is 34.1 secs Computing kpt #: 220 total cpu time spent up to now is 34.2 secs Computing kpt #: 221 total cpu time spent up to now is 34.3 secs Computing kpt #: 222 total cpu time spent up to now is 34.5 secs Computing kpt #: 223 total cpu time spent up to now is 34.6 secs Computing kpt #: 224 total cpu time spent up to now is 34.7 secs Computing kpt #: 225 total cpu time spent up to now is 34.8 secs Computing kpt #: 226 total cpu time spent up to now is 34.9 secs Computing kpt #: 227 total cpu time spent up to now is 35.0 secs Computing kpt #: 228 total cpu time spent up to now is 35.1 secs Computing kpt #: 229 total cpu time spent up to now is 35.2 secs Computing kpt #: 230 total cpu time spent up to now is 35.3 secs Computing kpt #: 231 total cpu time spent up to now is 35.5 secs Computing kpt #: 232 total cpu time spent up to now is 35.6 secs Computing kpt #: 233 total cpu time spent up to now is 35.7 secs Computing kpt #: 234 total cpu time spent up to now is 35.8 secs Computing kpt #: 235 total cpu time spent up to now is 35.9 secs Computing kpt #: 236 total cpu time spent up to now is 36.0 secs Computing kpt #: 237 total cpu time spent up to now is 36.1 secs Computing kpt #: 238 total cpu time spent up to now is 36.2 secs Computing kpt #: 239 total cpu time spent up to now is 36.3 secs Computing kpt #: 240 total cpu time spent up to now is 36.4 secs Computing kpt #: 241 total cpu time spent up to now is 36.5 secs Computing kpt #: 242 total cpu time spent up to now is 36.7 secs Computing kpt #: 243 total cpu time spent up to now is 36.8 secs Computing kpt #: 244 total cpu time spent up to now is 36.9 secs Computing kpt #: 245 total cpu time spent up to now is 37.0 secs Computing kpt #: 246 total cpu time spent up to now is 37.1 secs Computing kpt #: 247 total cpu time spent up to now is 37.2 secs Computing kpt #: 248 total cpu time spent up to now is 37.3 secs Computing kpt #: 249 total cpu time spent up to now is 37.4 secs Computing kpt #: 250 total cpu time spent up to now is 37.5 secs Computing kpt #: 251 total cpu time spent up to now is 37.7 secs Computing kpt #: 252 total cpu time spent up to now is 37.8 secs Computing kpt #: 253 total cpu time spent up to now is 37.9 secs Computing kpt #: 254 total cpu time spent up to now is 38.0 secs Computing kpt #: 255 total cpu time spent up to now is 38.1 secs Computing kpt #: 256 total cpu time spent up to now is 38.2 secs Computing kpt #: 257 total cpu time spent up to now is 38.3 secs Computing kpt #: 258 total cpu time spent up to now is 38.4 secs Computing kpt #: 259 total cpu time spent up to now is 38.5 secs Computing kpt #: 260 total cpu time spent up to now is 38.6 secs Computing kpt #: 261 total cpu time spent up to now is 38.7 secs Computing kpt #: 262 total cpu time spent up to now is 38.8 secs Computing kpt #: 263 total cpu time spent up to now is 38.9 secs Computing kpt #: 264 total cpu time spent up to now is 39.0 secs Computing kpt #: 265 total cpu time spent up to now is 39.1 secs Computing kpt #: 266 total cpu time spent up to now is 39.2 secs Computing kpt #: 267 total cpu time spent up to now is 39.3 secs Computing kpt #: 268 total cpu time spent up to now is 39.4 secs Computing kpt #: 269 total cpu time spent up to now is 39.5 secs Computing kpt #: 270 total cpu time spent up to now is 39.6 secs Computing kpt #: 271 total cpu time spent up to now is 39.8 secs Computing kpt #: 272 total cpu time spent up to now is 39.9 secs Computing kpt #: 273 total cpu time spent up to now is 40.0 secs Computing kpt #: 274 total cpu time spent up to now is 40.1 secs Computing kpt #: 275 total cpu time spent up to now is 40.2 secs Computing kpt #: 276 total cpu time spent up to now is 40.3 secs Computing kpt #: 277 total cpu time spent up to now is 40.5 secs Computing kpt #: 278 total cpu time spent up to now is 40.6 secs Computing kpt #: 279 total cpu time spent up to now is 40.7 secs Computing kpt #: 280 total cpu time spent up to now is 40.8 secs Computing kpt #: 281 total cpu time spent up to now is 40.9 secs Computing kpt #: 282 total cpu time spent up to now is 41.0 secs Computing kpt #: 283 total cpu time spent up to now is 41.1 secs Computing kpt #: 284 total cpu time spent up to now is 41.3 secs Computing kpt #: 285 total cpu time spent up to now is 41.4 secs Computing kpt #: 286 total cpu time spent up to now is 41.5 secs Computing kpt #: 287 total cpu time spent up to now is 41.6 secs Computing kpt #: 288 total cpu time spent up to now is 41.7 secs Computing kpt #: 289 total cpu time spent up to now is 41.8 secs Computing kpt #: 290 total cpu time spent up to now is 41.9 secs Computing kpt #: 291 total cpu time spent up to now is 42.1 secs Computing kpt #: 292 total cpu time spent up to now is 42.2 secs Computing kpt #: 293 total cpu time spent up to now is 42.3 secs Computing kpt #: 294 total cpu time spent up to now is 42.4 secs Computing kpt #: 295 total cpu time spent up to now is 42.5 secs Computing kpt #: 296 total cpu time spent up to now is 42.6 secs Computing kpt #: 297 total cpu time spent up to now is 42.7 secs Computing kpt #: 298 total cpu time spent up to now is 42.9 secs Computing kpt #: 299 total cpu time spent up to now is 43.0 secs Computing kpt #: 300 total cpu time spent up to now is 43.1 secs Computing kpt #: 301 total cpu time spent up to now is 43.2 secs Computing kpt #: 302 total cpu time spent up to now is 43.4 secs Computing kpt #: 303 total cpu time spent up to now is 43.5 secs Computing kpt #: 304 total cpu time spent up to now is 43.6 secs Computing kpt #: 305 total cpu time spent up to now is 43.7 secs Computing kpt #: 306 total cpu time spent up to now is 43.9 secs Computing kpt #: 307 total cpu time spent up to now is 44.0 secs Computing kpt #: 308 total cpu time spent up to now is 44.1 secs Computing kpt #: 309 total cpu time spent up to now is 44.3 secs Computing kpt #: 310 total cpu time spent up to now is 44.4 secs Computing kpt #: 311 total cpu time spent up to now is 44.6 secs Computing kpt #: 312 total cpu time spent up to now is 45.2 secs Computing kpt #: 313 total cpu time spent up to now is 45.4 secs Computing kpt #: 314 total cpu time spent up to now is 45.5 secs Computing kpt #: 315 total cpu time spent up to now is 45.7 secs Computing kpt #: 316 total cpu time spent up to now is 45.8 secs Computing kpt #: 317 total cpu time spent up to now is 45.9 secs Computing kpt #: 318 total cpu time spent up to now is 46.1 secs Computing kpt #: 319 total cpu time spent up to now is 46.2 secs Computing kpt #: 320 total cpu time spent up to now is 46.3 secs Computing kpt #: 321 total cpu time spent up to now is 46.4 secs Computing kpt #: 322 total cpu time spent up to now is 46.6 secs Computing kpt #: 323 total cpu time spent up to now is 46.7 secs Computing kpt #: 324 total cpu time spent up to now is 46.8 secs Computing kpt #: 325 total cpu time spent up to now is 46.9 secs Computing kpt #: 326 total cpu time spent up to now is 47.0 secs Computing kpt #: 327 total cpu time spent up to now is 47.1 secs Computing kpt #: 328 total cpu time spent up to now is 47.2 secs Computing kpt #: 329 total cpu time spent up to now is 47.3 secs Computing kpt #: 330 total cpu time spent up to now is 47.5 secs Computing kpt #: 331 total cpu time spent up to now is 47.6 secs Computing kpt #: 332 total cpu time spent up to now is 47.7 secs Computing kpt #: 333 total cpu time spent up to now is 47.8 secs Computing kpt #: 334 total cpu time spent up to now is 47.9 secs Computing kpt #: 335 total cpu time spent up to now is 48.0 secs Computing kpt #: 336 total cpu time spent up to now is 48.1 secs Computing kpt #: 337 total cpu time spent up to now is 48.2 secs Computing kpt #: 338 total cpu time spent up to now is 48.4 secs Computing kpt #: 339 total cpu time spent up to now is 48.5 secs Computing kpt #: 340 total cpu time spent up to now is 48.6 secs Computing kpt #: 341 total cpu time spent up to now is 48.7 secs Computing kpt #: 342 total cpu time spent up to now is 48.8 secs Computing kpt #: 343 total cpu time spent up to now is 48.9 secs Computing kpt #: 344 total cpu time spent up to now is 49.1 secs Computing kpt #: 345 total cpu time spent up to now is 49.2 secs Computing kpt #: 346 total cpu time spent up to now is 49.3 secs Computing kpt #: 347 total cpu time spent up to now is 49.4 secs Computing kpt #: 348 total cpu time spent up to now is 49.5 secs Computing kpt #: 349 total cpu time spent up to now is 49.7 secs Computing kpt #: 350 total cpu time spent up to now is 49.8 secs Computing kpt #: 351 total cpu time spent up to now is 49.9 secs Computing kpt #: 352 total cpu time spent up to now is 50.0 secs Computing kpt #: 353 total cpu time spent up to now is 50.1 secs Computing kpt #: 354 total cpu time spent up to now is 50.2 secs Computing kpt #: 355 total cpu time spent up to now is 50.3 secs Computing kpt #: 356 total cpu time spent up to now is 50.5 secs Computing kpt #: 357 total cpu time spent up to now is 50.6 secs Computing kpt #: 358 total cpu time spent up to now is 50.7 secs Computing kpt #: 359 total cpu time spent up to now is 50.8 secs Computing kpt #: 360 total cpu time spent up to now is 50.9 secs Computing kpt #: 361 total cpu time spent up to now is 51.0 secs Computing kpt #: 362 total cpu time spent up to now is 51.1 secs Computing kpt #: 363 total cpu time spent up to now is 51.2 secs Computing kpt #: 364 total cpu time spent up to now is 51.3 secs Computing kpt #: 365 total cpu time spent up to now is 51.5 secs Computing kpt #: 366 total cpu time spent up to now is 51.6 secs Computing kpt #: 367 total cpu time spent up to now is 51.7 secs Computing kpt #: 368 total cpu time spent up to now is 51.8 secs Computing kpt #: 369 total cpu time spent up to now is 51.9 secs Computing kpt #: 370 total cpu time spent up to now is 52.0 secs Computing kpt #: 371 total cpu time spent up to now is 52.2 secs Computing kpt #: 372 total cpu time spent up to now is 52.3 secs Computing kpt #: 373 total cpu time spent up to now is 52.4 secs Computing kpt #: 374 total cpu time spent up to now is 52.5 secs Computing kpt #: 375 total cpu time spent up to now is 52.6 secs Computing kpt #: 376 total cpu time spent up to now is 52.7 secs Computing kpt #: 377 total cpu time spent up to now is 52.9 secs Computing kpt #: 378 total cpu time spent up to now is 53.0 secs Computing kpt #: 379 total cpu time spent up to now is 53.1 secs Computing kpt #: 380 total cpu time spent up to now is 53.2 secs Computing kpt #: 381 total cpu time spent up to now is 53.3 secs Computing kpt #: 382 total cpu time spent up to now is 53.4 secs Computing kpt #: 383 total cpu time spent up to now is 53.5 secs Computing kpt #: 384 total cpu time spent up to now is 53.6 secs ethr = 3.57E-08, avg # of iterations = 10.4 total cpu time spent up to now is 53.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): -46.7523 -46.7523 -45.5090 -45.5090 -19.8752 -19.8752 -19.2207 -19.2207 -16.6647 -16.6647 -16.6647 -16.6647 -10.7261 -10.7261 -10.7261 -10.7261 12.9214 12.9214 15.8397 15.8397 15.8397 15.8397 19.7765 19.7765 19.7765 19.7765 20.0146 20.0146 23.2319 23.2319 23.2319 23.2319 26.0581 26.0581 26.0581 26.0581 k = 0.0000 0.0100-0.0000 ( 1647 PWs) bands (ev): -46.7522 -46.7522 -45.5090 -45.5090 -19.8751 -19.8751 -19.2209 -19.2209 -16.6648 -16.6648 -16.6647 -16.6647 -10.7264 -10.7264 -10.7262 -10.7262 12.9237 12.9237 15.8409 15.8409 15.8416 15.8416 19.7762 19.7762 19.7770 19.7770 20.0147 20.0147 23.2288 23.2288 23.2330 23.2330 26.0462 26.0462 26.0538 26.0538 k = 0.0000 0.0200-0.0000 ( 1647 PWs) bands (ev): -46.7522 -46.7522 -45.5090 -45.5090 -19.8748 -19.8748 -19.2215 -19.2215 -16.6651 -16.6651 -16.6645 -16.6645 -10.7274 -10.7274 -10.7262 -10.7262 12.9307 12.9307 15.8444 15.8444 15.8472 15.8472 19.7754 19.7754 19.7785 19.7785 20.0151 20.0151 23.2193 23.2193 23.2361 23.2361 26.0113 26.0113 26.0409 26.0409 k = 0.0000 0.0300-0.0000 ( 1659 PWs) bands (ev): -46.7520 -46.7520 -45.5091 -45.5091 -19.8742 -19.8742 -19.2227 -19.2227 -16.6656 -16.6656 -16.6643 -16.6643 -10.7290 -10.7290 -10.7263 -10.7263 12.9422 12.9422 15.8502 15.8502 15.8565 15.8565 19.7739 19.7739 19.7809 19.7809 20.0158 20.0158 23.2036 23.2036 23.2412 23.2412 25.9552 25.9552 26.0187 26.0187 k = 0.0000 0.0400-0.0000 ( 1667 PWs) bands (ev): -46.7518 -46.7518 -45.5092 -45.5092 -19.8734 -19.8734 -19.2242 -19.2242 -16.6662 -16.6662 -16.6641 -16.6641 -10.7312 -10.7312 -10.7265 -10.7265 12.9584 12.9584 15.8584 15.8584 15.8695 15.8695 19.7718 19.7718 19.7842 19.7842 20.0168 20.0168 23.1817 23.1817 23.2485 23.2485 25.8807 25.8807 25.9861 25.9861 k = 0.0000 0.0500-0.0000 ( 1663 PWs) bands (ev): -46.7515 -46.7515 -45.5092 -45.5092 -19.8723 -19.8723 -19.2261 -19.2261 -16.6669 -16.6669 -16.6637 -16.6637 -10.7340 -10.7340 -10.7267 -10.7267 12.9791 12.9791 15.8690 15.8690 15.8862 15.8862 19.7693 19.7693 19.7883 19.7883 20.0184 20.0184 23.1537 23.1537 23.2578 23.2578 25.7905 25.7905 25.9419 25.9419 k = 0.0000 0.0600-0.0000 ( 1663 PWs) bands (ev): -46.7512 -46.7512 -45.5093 -45.5093 -19.8710 -19.8710 -19.2285 -19.2285 -16.6678 -16.6678 -16.6633 -16.6633 -10.7374 -10.7374 -10.7270 -10.7270 13.0043 13.0043 15.8818 15.8818 15.9064 15.9064 19.7663 19.7663 19.7930 19.7930 20.0205 20.0205 23.1197 23.1197 23.2692 23.2692 25.6879 25.6879 25.8848 25.8848 k = 0.0000 0.0700-0.0000 ( 1663 PWs) bands (ev): -46.7509 -46.7509 -45.5094 -45.5094 -19.8695 -19.8695 -19.2312 -19.2312 -16.6689 -16.6689 -16.6627 -16.6627 -10.7413 -10.7413 -10.7273 -10.7273 13.0341 13.0341 15.8970 15.8970 15.9302 15.9302 19.7628 19.7628 19.7983 19.7983 20.0235 20.0235 23.0799 23.0799 23.2825 23.2825 25.5752 25.5752 25.8142 25.8142 k = 0.0000 0.0800-0.0000 ( 1675 PWs) bands (ev): -46.7504 -46.7504 -45.5095 -45.5095 -19.8678 -19.8678 -19.2344 -19.2344 -16.6701 -16.6701 -16.6622 -16.6622 -10.7459 -10.7459 -10.7276 -10.7276 13.0683 13.0683 15.9145 15.9145 15.9574 15.9574 19.7589 19.7589 19.8038 19.8038 20.0275 20.0275 23.0344 23.0344 23.2976 23.2976 25.4548 25.4548 25.7303 25.7303 k = 0.0000 0.0900-0.0000 ( 1667 PWs) bands (ev): -46.7499 -46.7499 -45.5096 -45.5096 -19.8658 -19.8658 -19.2379 -19.2379 -16.6715 -16.6715 -16.6615 -16.6615 -10.7509 -10.7509 -10.7280 -10.7280 13.1069 13.1069 15.9344 15.9344 15.9879 15.9879 19.7546 19.7546 19.8095 19.8095 20.0328 20.0328 22.9835 22.9835 23.3146 23.3146 25.3288 25.3288 25.6346 25.6346 k = 0.0000 0.1000-0.0000 ( 1667 PWs) bands (ev): -46.7494 -46.7494 -45.5098 -45.5098 -19.8637 -19.8637 -19.2418 -19.2418 -16.6730 -16.6730 -16.6607 -16.6607 -10.7565 -10.7565 -10.7284 -10.7284 13.1498 13.1498 15.9566 15.9566 16.0217 16.0217 19.7501 19.7501 19.8152 19.8152 20.0396 20.0396 22.9273 22.9273 23.3333 23.3333 25.1985 25.1985 25.5288 25.5288 k = 0.0000 0.1100-0.0000 ( 1667 PWs) bands (ev): -46.7488 -46.7488 -45.5099 -45.5099 -19.8613 -19.8613 -19.2461 -19.2461 -16.6746 -16.6746 -16.6599 -16.6599 -10.7626 -10.7626 -10.7289 -10.7289 13.1970 13.1970 15.9810 15.9810 16.0586 16.0586 19.7452 19.7452 19.8205 19.8205 20.0482 20.0482 22.8661 22.8661 23.3536 23.3536 25.0653 25.0653 25.4151 25.4151 k = 0.0000 0.1200-0.0000 ( 1667 PWs) bands (ev): -46.7482 -46.7482 -45.5101 -45.5101 -19.8586 -19.8586 -19.2508 -19.2508 -16.6764 -16.6764 -16.6590 -16.6590 -10.7692 -10.7692 -10.7294 -10.7294 13.2484 13.2484 16.0078 16.0078 16.0985 16.0985 19.7402 19.7402 19.8255 19.8255 20.0586 20.0586 22.8000 22.8000 23.3755 23.3755 24.9303 24.9303 25.2952 25.2952 k = 0.0000 0.1300-0.0000 ( 1667 PWs) bands (ev): -46.7475 -46.7475 -45.5103 -45.5103 -19.8558 -19.8558 -19.2558 -19.2558 -16.6783 -16.6783 -16.6580 -16.6580 -10.7762 -10.7762 -10.7299 -10.7299 13.3039 13.3039 16.0368 16.0368 16.1411 16.1411 19.7350 19.7350 19.8298 19.8298 20.0712 20.0712 22.7294 22.7294 23.3986 23.3986 24.7942 24.7942 25.1709 25.1709 k = 0.0000 0.1400-0.0000 ( 1663 PWs) bands (ev): -46.7468 -46.7468 -45.5104 -45.5104 -19.8527 -19.8527 -19.2612 -19.2612 -16.6803 -16.6803 -16.6570 -16.6570 -10.7836 -10.7836 -10.7305 -10.7305 13.3634 13.3634 16.0681 16.0681 16.1865 16.1865 19.7297 19.7297 19.8335 19.8335 20.0860 20.0860 22.6544 22.6544 23.4230 23.4230 24.6580 24.6580 25.0435 25.0435 k = 0.0000 0.1500-0.0000 ( 1663 PWs) bands (ev): -46.7461 -46.7461 -45.5106 -45.5106 -19.8494 -19.8494 -19.2670 -19.2670 -16.6824 -16.6824 -16.6560 -16.6560 -10.7914 -10.7914 -10.7311 -10.7311 13.4269 13.4269 16.1017 16.1017 16.2343 16.2343 19.7245 19.7245 19.8366 19.8366 20.1029 20.1029 22.5754 22.5754 23.4483 23.4483 24.5221 24.5221 24.9138 24.9138 k = 0.0000 0.1600-0.0000 ( 1663 PWs) bands (ev): -46.7453 -46.7453 -45.5108 -45.5108 -19.8459 -19.8459 -19.2731 -19.2731 -16.6846 -16.6846 -16.6549 -16.6549 -10.7996 -10.7996 -10.7317 -10.7317 13.4941 13.4941 16.1376 16.1376 16.2844 16.2844 19.7192 19.7192 19.8391 19.8391 20.1221 20.1221 22.4925 22.4925 23.4741 23.4741 24.3873 24.3873 24.7830 24.7830 k = 0.0000 0.1700-0.0000 ( 1667 PWs) bands (ev): -46.7445 -46.7445 -45.5111 -45.5111 -19.8421 -19.8421 -19.2796 -19.2796 -16.6869 -16.6869 -16.6537 -16.6537 -10.8080 -10.8080 -10.7324 -10.7324 13.5651 13.5651 16.1757 16.1757 16.3365 16.3365 19.7141 19.7141 19.8411 19.8411 20.1434 20.1434 22.4059 22.4059 23.5001 23.5001 24.2541 24.2541 24.6515 24.6515 k = 0.0000 0.1800-0.0000 ( 1667 PWs) bands (ev): -46.7436 -46.7436 -45.5113 -45.5113 -19.8381 -19.8381 -19.2864 -19.2864 -16.6893 -16.6893 -16.6525 -16.6525 -10.8168 -10.8168 -10.7331 -10.7331 13.6398 13.6398 16.2160 16.2160 16.3904 16.3904 19.7093 19.7093 19.8428 19.8428 20.1667 20.1667 22.3162 22.3162 23.5256 23.5256 24.1234 24.1234 24.5201 24.5201 k = 0.0000 0.1900-0.0000 ( 1667 PWs) bands (ev): -46.7428 -46.7428 -45.5115 -45.5115 -19.8339 -19.8339 -19.2935 -19.2935 -16.6917 -16.6917 -16.6513 -16.6513 -10.8258 -10.8258 -10.7338 -10.7338 13.7178 13.7178 16.2585 16.2585 16.4459 16.4459 19.7046 19.7046 19.8442 19.8442 20.1919 20.1919 22.2234 22.2234 23.5490 23.5490 23.9967 23.9967 24.3891 24.3891 k = 0.0000 0.2000-0.0000 ( 1671 PWs) bands (ev): -46.7419 -46.7419 -45.5118 -45.5118 -19.8294 -19.8294 -19.3010 -19.3010 -16.6942 -16.6942 -16.6500 -16.6500 -10.8350 -10.8350 -10.7345 -10.7345 13.7993 13.7993 16.3031 16.3031 16.5027 16.5027 19.7003 19.7003 19.8455 19.8455 20.2188 20.2188 22.1279 22.1279 23.5667 23.5667 23.8777 23.8777 24.2591 24.2591 k = 0.0000 0.2100-0.0000 ( 1667 PWs) bands (ev): -46.7410 -46.7410 -45.5120 -45.5120 -19.8247 -19.8247 -19.3086 -19.3086 -16.6967 -16.6967 -16.6487 -16.6487 -10.8443 -10.8443 -10.7352 -10.7352 13.8839 13.8839 16.3500 16.3500 16.5604 16.5604 19.6964 19.6964 19.8469 19.8469 20.2474 20.2474 22.0299 22.0299 23.5669 23.5669 23.7780 23.7780 24.1303 24.1303 k = 0.0000 0.2200-0.0000 ( 1667 PWs) bands (ev): -46.7400 -46.7400 -45.5122 -45.5122 -19.8198 -19.8198 -19.3166 -19.3166 -16.6993 -16.6993 -16.6474 -16.6474 -10.8538 -10.8538 -10.7359 -10.7359 13.9717 13.9717 16.3990 16.3990 16.6188 16.6188 19.6930 19.6930 19.8484 19.8484 20.2775 20.2775 21.9296 21.9296 23.5213 23.5213 23.7257 23.7257 24.0030 24.0030 k = 0.0000 0.2300-0.0000 ( 1667 PWs) bands (ev): -46.7391 -46.7391 -45.5125 -45.5125 -19.8147 -19.8147 -19.3249 -19.3249 -16.7019 -16.7019 -16.6461 -16.6461 -10.8634 -10.8634 -10.7367 -10.7367 14.0623 14.0623 16.4501 16.4501 16.6776 16.6776 19.6901 19.6901 19.8502 19.8502 20.3089 20.3089 21.8273 21.8273 23.4291 23.4291 23.7216 23.7216 23.8776 23.8776 k = 0.0000 0.2400-0.0000 ( 1671 PWs) bands (ev): -46.7381 -46.7381 -45.5127 -45.5127 -19.8094 -19.8094 -19.3334 -19.3334 -16.7045 -16.7045 -16.6447 -16.6447 -10.8730 -10.8730 -10.7375 -10.7375 14.1557 14.1557 16.5033 16.5033 16.7363 16.7363 19.6878 19.6878 19.8524 19.8524 20.3414 20.3414 21.7233 21.7233 23.3203 23.3203 23.7353 23.7353 23.7541 23.7541 k = 0.0000 0.2500-0.0000 ( 1671 PWs) bands (ev): -46.7372 -46.7372 -45.5130 -45.5130 -19.8038 -19.8038 -19.3421 -19.3421 -16.7071 -16.7071 -16.6434 -16.6434 -10.8827 -10.8827 -10.7382 -10.7382 14.2516 14.2516 16.5586 16.5586 16.7946 16.7946 19.6862 19.6862 19.8550 19.8550 20.3750 20.3750 21.6180 21.6180 23.2077 23.2077 23.6330 23.6330 23.7536 23.7536 k = 0.0000 0.2600-0.0000 ( 1667 PWs) bands (ev): -46.7362 -46.7362 -45.5133 -45.5133 -19.7980 -19.7980 -19.3510 -19.3510 -16.7097 -16.7097 -16.6420 -16.6420 -10.8923 -10.8923 -10.7390 -10.7390 14.3500 14.3500 16.6159 16.6159 16.8521 16.8521 19.6852 19.6852 19.8582 19.8582 20.4093 20.4093 21.5116 21.5116 23.0955 23.0955 23.5142 23.5142 23.7722 23.7722 k = 0.0000 0.2700-0.0000 ( 1659 PWs) bands (ev): -46.7353 -46.7353 -45.5135 -45.5135 -19.7919 -19.7919 -19.3602 -19.3602 -16.7122 -16.7122 -16.6406 -16.6406 -10.9019 -10.9019 -10.7397 -10.7397 14.4506 14.4506 16.6752 16.6752 16.9085 16.9085 19.6850 19.6850 19.8620 19.8620 20.4441 20.4441 21.4045 21.4045 22.9850 22.9850 23.3982 23.3982 23.7892 23.7892 k = 0.0000 0.2800-0.0000 ( 1659 PWs) bands (ev): -46.7343 -46.7343 -45.5138 -45.5138 -19.7856 -19.7856 -19.3696 -19.3696 -16.7147 -16.7147 -16.6393 -16.6393 -10.9113 -10.9113 -10.7405 -10.7405 14.5532 14.5532 16.7365 16.7365 16.9632 16.9632 19.6855 19.6855 19.8663 19.8663 20.4789 20.4789 21.2972 21.2972 22.8768 22.8768 23.2848 23.2848 23.8036 23.8036 k = 0.0000 0.2900-0.0000 ( 1659 PWs) bands (ev): -46.7334 -46.7334 -45.5140 -45.5140 -19.7792 -19.7792 -19.3792 -19.3792 -16.7172 -16.7172 -16.6380 -16.6380 -10.9207 -10.9207 -10.7412 -10.7412 14.6576 14.6576 16.7996 16.7996 17.0158 17.0158 19.6867 19.6867 19.8713 19.8713 20.5132 20.5132 21.1904 21.1904 22.7715 22.7715 23.1744 23.1744 23.8146 23.8146 k = 0.0000 0.3000-0.0000 ( 1667 PWs) bands (ev): -46.7325 -46.7325 -45.5143 -45.5143 -19.7725 -19.7725 -19.3890 -19.3890 -16.7197 -16.7197 -16.6367 -16.6367 -10.9298 -10.9298 -10.7420 -10.7420 14.7635 14.7635 16.8646 16.8646 17.0660 17.0660 19.6888 19.6888 19.8769 19.8769 20.5459 20.5459 21.0854 21.0854 22.6692 22.6692 23.0671 23.0671 23.8217 23.8217 k = 0.0000 0.3100-0.0000 ( 1659 PWs) bands (ev): -46.7316 -46.7316 -45.5145 -45.5145 -19.7655 -19.7655 -19.3989 -19.3989 -16.7221 -16.7221 -16.6354 -16.6354 -10.9388 -10.9388 -10.7427 -10.7427 14.8708 14.8708 16.9314 16.9314 17.1131 17.1131 19.6916 19.6916 19.8832 19.8832 20.5745 20.5745 20.9846 20.9846 22.5701 22.5701 22.9631 22.9631 23.8244 23.8244 k = 0.0000 0.3200-0.0000 ( 1663 PWs) bands (ev): -46.7307 -46.7307 -45.5147 -45.5147 -19.7584 -19.7584 -19.4090 -19.4090 -16.7245 -16.7245 -16.6341 -16.6341 -10.9475 -10.9475 -10.7434 -10.7434 14.9792 14.9792 16.9998 16.9998 17.1568 17.1568 19.6953 19.6953 19.8900 19.8900 20.5928 20.5928 20.8943 20.8943 22.4745 22.4745 22.8624 22.8624 23.8224 23.8224 k = 0.0000 0.3300-0.0000 ( 1662 PWs) bands (ev): -46.7298 -46.7298 -45.5150 -45.5150 -19.7511 -19.7511 -19.4192 -19.4192 -16.7267 -16.7267 -16.6329 -16.6329 -10.9560 -10.9560 -10.7441 -10.7441 15.0884 15.0884 17.0700 17.0700 17.1966 17.1966 19.6997 19.6997 19.8974 19.8974 20.5861 20.5861 20.8295 20.8295 22.3825 22.3825 22.7654 22.7654 23.8156 23.8156 k = 0.0000 0.3400-0.0000 ( 1662 PWs) bands (ev): -46.7290 -46.7290 -45.5152 -45.5152 -19.7435 -19.7435 -19.4295 -19.4295 -16.7289 -16.7289 -16.6318 -16.6318 -10.9641 -10.9641 -10.7448 -10.7448 15.1982 15.1982 17.1416 17.1416 17.2320 17.2320 19.7049 19.7049 19.9050 19.9050 20.5373 20.5373 20.8072 20.8072 22.2943 22.2943 22.6721 22.6721 23.8040 23.8040 k = 0.0000 0.3500-0.0000 ( 1666 PWs) bands (ev): -46.7282 -46.7282 -45.5154 -45.5154 -19.7358 -19.7358 -19.4398 -19.4398 -16.7310 -16.7310 -16.6307 -16.6307 -10.9719 -10.9719 -10.7454 -10.7454 15.3081 15.3081 17.2147 17.2147 17.2627 17.2627 19.7108 19.7108 19.9126 19.9126 20.4563 20.4563 20.8179 20.8179 22.2100 22.2100 22.5826 22.5826 23.7880 23.7880 k = 0.0000 0.3600-0.0000 ( 1654 PWs) bands (ev): -46.7274 -46.7274 -45.5156 -45.5156 -19.7279 -19.7279 -19.4502 -19.4502 -16.7330 -16.7330 -16.6296 -16.6296 -10.9794 -10.9794 -10.7460 -10.7460 15.4180 15.4180 17.2882 17.2882 17.2890 17.2890 19.7174 19.7174 19.9197 19.9197 20.3625 20.3625 20.8429 20.8429 22.1297 22.1297 22.4973 22.4973 23.7680 23.7680 k = 0.0000 0.3700-0.0000 ( 1654 PWs) bands (ev): -46.7267 -46.7267 -45.5158 -45.5158 -19.7197 -19.7197 -19.4608 -19.4608 -16.7349 -16.7349 -16.6285 -16.6285 -10.9864 -10.9864 -10.7466 -10.7466 15.5273 15.5273 17.3083 17.3083 17.3645 17.3645 19.7244 19.7244 19.9250 19.9250 20.2658 20.2658 20.8731 20.8731 22.0537 22.0537 22.4162 22.4162 23.7447 23.7447 k = 0.0000 0.3800-0.0000 ( 1646 PWs) bands (ev): -46.7260 -46.7260 -45.5160 -45.5160 -19.7113 -19.7113 -19.4714 -19.4714 -16.7366 -16.7366 -16.6276 -16.6276 -10.9931 -10.9931 -10.7471 -10.7471 15.6358 15.6358 17.3225 17.3225 17.4409 17.4409 19.7319 19.7319 19.9256 19.9256 20.1725 20.1725 20.9052 20.9052 21.9822 21.9822 22.3397 22.3397 23.7188 23.7188 k = 0.0000 0.3900-0.0000 ( 1654 PWs) bands (ev): -46.7254 -46.7254 -45.5162 -45.5162 -19.7029 -19.7029 -19.4820 -19.4820 -16.7383 -16.7383 -16.6267 -16.6267 -10.9993 -10.9993 -10.7476 -10.7476 15.7430 15.7430 17.3307 17.3307 17.5179 17.5179 19.7397 19.7397 19.9130 19.9130 20.0927 20.0927 20.9375 20.9375 21.9152 21.9152 22.2678 22.2678 23.6911 23.6911 k = 0.0000 0.4000-0.0000 ( 1654 PWs) bands (ev): -46.7248 -46.7248 -45.5163 -45.5163 -19.6942 -19.6942 -19.4927 -19.4927 -16.7398 -16.7398 -16.6258 -16.6258 -11.0050 -11.0050 -10.7481 -10.7481 15.8483 15.8483 17.3328 17.3328 17.5951 17.5951 19.7477 19.7477 19.8706 19.8706 20.0440 20.0440 20.9691 20.9691 21.8531 21.8531 22.2009 22.2009 23.6626 23.6626 k = 0.0000 0.4100-0.0000 ( 1654 PWs) bands (ev): -46.7243 -46.7243 -45.5165 -45.5165 -19.6853 -19.6853 -19.5034 -19.5034 -16.7412 -16.7412 -16.6251 -16.6251 -11.0103 -11.0103 -10.7485 -10.7485 15.9512 15.9512 17.3288 17.3288 17.6723 17.6723 19.7558 19.7558 19.7973 19.7973 20.0280 20.0280 20.9994 20.9994 21.7959 21.7959 22.1392 22.1392 23.6341 23.6341 k = 0.0000 0.4200-0.0000 ( 1654 PWs) bands (ev): -46.7238 -46.7238 -45.5166 -45.5166 -19.6762 -19.6762 -19.5141 -19.5141 -16.7425 -16.7425 -16.6244 -16.6244 -11.0150 -11.0150 -10.7489 -10.7489 16.0511 16.0511 17.3188 17.3188 17.7487 17.7487 19.7113 19.7113 19.7637 19.7637 20.0273 20.0273 21.0279 21.0279 21.7440 21.7440 22.0829 22.0829 23.6064 23.6064 k = 0.0000 0.4300-0.0000 ( 1654 PWs) bands (ev): -46.7233 -46.7233 -45.5167 -45.5167 -19.6670 -19.6670 -19.5248 -19.5248 -16.7436 -16.7436 -16.6238 -16.6238 -11.0193 -11.0193 -10.7493 -10.7493 16.1471 16.1471 17.3032 17.3032 17.8236 17.8236 19.6232 19.6232 19.7713 19.7713 20.0318 20.0318 21.0541 21.0541 21.6975 21.6975 22.0324 22.0324 23.5803 23.5803 k = 0.0000 0.4400-0.0000 ( 1654 PWs) bands (ev): -46.7229 -46.7229 -45.5168 -45.5168 -19.6577 -19.6577 -19.5353 -19.5353 -16.7446 -16.7446 -16.6232 -16.6232 -11.0230 -11.0230 -10.7496 -10.7496 16.2383 16.2383 17.2826 17.2826 17.8960 17.8960 19.5375 19.5375 19.7784 19.7784 20.0381 20.0381 21.0777 21.0777 21.6566 21.6566 21.9878 21.9878 23.5564 23.5564 k = 0.0000 0.4500-0.0000 ( 1654 PWs) bands (ev): -46.7226 -46.7226 -45.5169 -45.5169 -19.6482 -19.6482 -19.5460 -19.5460 -16.7454 -16.7454 -16.6228 -16.6228 -11.0261 -11.0261 -10.7499 -10.7499 16.3232 16.3232 17.2579 17.2579 17.9643 17.9643 19.4569 19.4569 19.7848 19.7848 20.0447 20.0447 21.0984 21.0984 21.6216 21.6216 21.9496 21.9496 23.5353 23.5353 k = 0.0000 0.4600-0.0000 ( 1654 PWs) bands (ev): -46.7223 -46.7223 -45.5170 -45.5170 -19.6386 -19.6386 -19.5565 -19.5565 -16.7461 -16.7461 -16.6224 -16.6224 -11.0287 -11.0287 -10.7501 -10.7501 16.4000 16.4000 17.2307 17.2307 18.0267 18.0267 19.3842 19.3842 19.7903 19.7903 20.0509 20.0509 21.1157 21.1157 21.5926 21.5926 21.9178 21.9178 23.5175 23.5175 k = 0.0000 0.4700-0.0000 ( 1654 PWs) bands (ev): -46.7221 -46.7221 -45.5171 -45.5171 -19.6288 -19.6288 -19.5670 -19.5670 -16.7467 -16.7467 -16.6221 -16.6221 -11.0307 -11.0307 -10.7502 -10.7502 16.4663 16.4663 17.2032 17.2032 18.0805 18.0805 19.3220 19.3220 19.7948 19.7948 20.0560 20.0560 21.1295 21.1295 21.5698 21.5698 21.8929 21.8929 23.5033 23.5033 k = 0.0000 0.4800-0.0000 ( 1654 PWs) bands (ev): -46.7220 -46.7220 -45.5171 -45.5171 -19.6189 -19.6189 -19.5773 -19.5773 -16.7471 -16.7471 -16.6219 -16.6219 -11.0322 -11.0322 -10.7504 -10.7504 16.5186 16.5186 17.1788 17.1788 18.1227 18.1227 19.2738 19.2738 19.7982 19.7982 20.0599 20.0599 21.1396 21.1396 21.5535 21.5535 21.8749 21.8749 23.4929 23.4929 k = 0.0000 0.4900-0.0000 ( 1654 PWs) bands (ev): -46.7219 -46.7219 -45.5171 -45.5171 -19.6092 -19.6092 -19.5874 -19.5874 -16.7473 -16.7473 -16.6217 -16.6217 -11.0331 -11.0331 -10.7504 -10.7504 16.5527 16.5527 17.1615 17.1615 18.1499 18.1499 19.2430 19.2430 19.8002 19.8002 20.0624 20.0624 21.1456 21.1456 21.5436 21.5436 21.8640 21.8640 23.4867 23.4867 k = 0.0000 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7219 -46.7219 -45.5171 -45.5171 -19.6021 -19.6021 -19.5946 -19.5946 -16.7474 -16.7474 -16.6217 -16.6217 -11.0334 -11.0334 -10.7505 -10.7505 16.5646 16.5646 17.1551 17.1551 18.1593 18.1593 19.2324 19.2324 19.8009 19.8009 20.0632 20.0632 21.1477 21.1477 21.5403 21.5403 21.8604 21.8604 23.4845 23.4845 k = 0.0000 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7219 -46.7219 -45.5171 -45.5171 -19.6021 -19.6021 -19.5946 -19.5946 -16.7474 -16.7474 -16.6217 -16.6217 -11.0334 -11.0334 -10.7505 -10.7505 16.5646 16.5646 17.1551 17.1551 18.1593 18.1593 19.2324 19.2324 19.8009 19.8009 20.0632 20.0632 21.1477 21.1477 21.5403 21.5403 21.8604 21.8604 23.4845 23.4845 k = 0.0100 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7218 -46.7218 -45.5171 -45.5171 -19.6021 -19.6021 -19.5947 -19.5947 -16.7473 -16.7473 -16.6218 -16.6218 -11.0333 -11.0333 -10.7506 -10.7506 16.5647 16.5647 17.1553 17.1553 18.1590 18.1590 19.2258 19.2258 19.8046 19.8046 20.0666 20.0666 21.1187 21.1187 21.5603 21.5603 21.8724 21.8724 23.4857 23.4857 k = 0.0200 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7218 -46.7218 -45.5171 -45.5171 -19.6023 -19.6023 -19.5950 -19.5950 -16.7473 -16.7473 -16.6220 -16.6220 -11.0332 -11.0332 -10.7510 -10.7510 16.5648 16.5648 17.1556 17.1556 18.1584 18.1584 19.2073 19.2073 19.8128 19.8128 20.0783 20.0783 21.0470 21.0470 21.6031 21.6031 21.9101 21.9101 23.4891 23.4891 k = 0.0300 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7217 -46.7217 -45.5170 -45.5170 -19.6026 -19.6026 -19.5955 -19.5955 -16.7472 -16.7472 -16.6224 -16.6224 -11.0330 -11.0330 -10.7516 -10.7516 16.5648 16.5648 17.1560 17.1560 18.1576 18.1576 19.1803 19.1803 19.8192 19.8192 20.1017 20.1017 20.9547 20.9547 21.6455 21.6455 21.9750 21.9750 23.4948 23.4948 k = 0.0400 0.5000-0.0000 ( 1650 PWs) bands (ev): -46.7216 -46.7216 -45.5170 -45.5170 -19.6030 -19.6030 -19.5961 -19.5961 -16.7471 -16.7471 -16.6230 -16.6230 -11.0327 -11.0327 -10.7524 -10.7524 16.5646 16.5646 17.1560 17.1560 18.1571 18.1571 19.1484 19.1484 19.8174 19.8174 20.1395 20.1395 20.8535 20.8535 21.6796 21.6796 22.0630 22.0630 23.5029 23.5029 k = 0.0500 0.5000-0.0000 ( 1650 PWs) bands (ev): -46.7215 -46.7215 -45.5168 -45.5168 -19.6035 -19.6035 -19.5970 -19.5970 -16.7470 -16.7470 -16.6237 -16.6237 -11.0323 -11.0323 -10.7535 -10.7535 16.5639 16.5639 17.1554 17.1554 18.1575 18.1575 19.1150 19.1150 19.8051 19.8051 20.1908 20.1908 20.7490 20.7490 21.7071 21.7071 22.1671 22.1671 23.5132 23.5132 k = 0.0600 0.5000-0.0000 ( 1650 PWs) bands (ev): -46.7214 -46.7214 -45.5167 -45.5167 -19.6041 -19.6041 -19.5980 -19.5980 -16.7468 -16.7468 -16.6246 -16.6246 -11.0318 -11.0318 -10.7548 -10.7548 16.5624 16.5624 17.1536 17.1536 18.1594 18.1594 19.0826 19.0826 19.7826 19.7826 20.2518 20.2518 20.6451 20.6451 21.7315 21.7315 22.2813 22.2813 23.5259 23.5259 k = 0.0700 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7212 -46.7212 -45.5166 -45.5166 -19.6048 -19.6048 -19.5992 -19.5992 -16.7466 -16.7466 -16.6256 -16.6256 -11.0313 -11.0313 -10.7563 -10.7563 16.5599 16.5599 17.1500 17.1500 18.1636 18.1636 19.0533 19.0533 19.7519 19.7519 20.3138 20.3138 20.5490 20.5490 21.7546 21.7546 22.4019 22.4019 23.5409 23.5409 k = 0.0800 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7210 -46.7210 -45.5164 -45.5164 -19.6057 -19.6057 -19.6006 -19.6006 -16.7464 -16.7464 -16.6268 -16.6268 -11.0307 -11.0307 -10.7580 -10.7580 16.5559 16.5559 17.1440 17.1440 18.1710 18.1710 19.0284 19.0284 19.7143 19.7143 20.3405 20.3405 20.4953 20.4953 21.7778 21.7778 22.5268 22.5268 23.5581 23.5581 k = 0.0900 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7208 -46.7208 -45.5162 -45.5162 -19.6066 -19.6066 -19.6021 -19.6021 -16.7461 -16.7461 -16.6281 -16.6281 -11.0301 -11.0301 -10.7599 -10.7599 16.5501 16.5501 17.1351 17.1351 18.1824 18.1824 19.0093 19.0093 19.6713 19.6713 20.2779 20.2779 20.5369 20.5369 21.8014 21.8014 22.6545 22.6545 23.5773 23.5773 k = 0.1000 0.5000-0.0000 ( 1658 PWs) bands (ev): -46.7205 -46.7205 -45.5160 -45.5160 -19.6078 -19.6078 -19.6038 -19.6038 -16.7459 -16.7459 -16.6295 -16.6295 -11.0295 -11.0295 -10.7620 -10.7620 16.5421 16.5421 17.1228 17.1228 18.1985 18.1985 18.9969 18.9969 19.6236 19.6236 20.1825 20.1825 20.6166 20.6166 21.8257 21.8257 22.7843 22.7843 23.5985 23.5985 k = 0.1100 0.5000-0.0000 ( 1650 PWs) bands (ev): -46.7203 -46.7203 -45.5158 -45.5158 -19.6090 -19.6090 -19.6055 -19.6055 -16.7456 -16.7456 -16.6310 -16.6310 -11.0288 -11.0288 -10.7642 -10.7642 16.5317 16.5317 17.1066 17.1066 18.2201 18.2201 18.9919 18.9919 19.5723 19.5723 20.0816 20.0816 20.7061 20.7061 21.8507 21.8507 22.9156 22.9156 23.6214 23.6214 k = 0.1200 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7200 -46.7200 -45.5155 -45.5155 -19.6104 -19.6104 -19.6073 -19.6073 -16.7453 -16.7453 -16.6327 -16.6327 -11.0281 -11.0281 -10.7666 -10.7666 16.5185 16.5185 17.0865 17.0865 18.2475 18.2475 18.9950 18.9950 19.5178 19.5178 19.9804 19.9804 20.8003 20.8003 21.8763 21.8763 23.0480 23.0480 23.6458 23.6458 k = 0.1300 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7197 -46.7197 -45.5153 -45.5153 -19.6121 -19.6121 -19.6091 -19.6091 -16.7449 -16.7449 -16.6344 -16.6344 -11.0273 -11.0273 -10.7690 -10.7690 16.5024 16.5024 17.0622 17.0622 18.2810 18.2810 19.0066 19.0066 19.4609 19.4609 19.8799 19.8799 20.8974 20.8974 21.9024 21.9024 23.1811 23.1811 23.6714 23.6714 k = 0.1400 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7194 -46.7194 -45.5150 -45.5150 -19.6140 -19.6140 -19.6108 -19.6108 -16.7446 -16.7446 -16.6363 -16.6363 -11.0266 -11.0266 -10.7716 -10.7716 16.4832 16.4832 17.0340 17.0340 18.3209 18.3209 19.0269 19.0269 19.4020 19.4020 19.7810 19.7810 20.9965 20.9965 21.9290 21.9290 23.3144 23.3144 23.6982 23.6982 k = 0.1500 0.5000-0.0000 ( 1644 PWs) bands (ev): -46.7190 -46.7190 -45.5147 -45.5147 -19.6162 -19.6162 -19.6125 -19.6125 -16.7443 -16.7443 -16.6382 -16.6382 -11.0260 -11.0260 -10.7742 -10.7742 16.4610 16.4610 17.0021 17.0021 18.3669 18.3669 19.0560 19.0560 19.3417 19.3417 19.6838 19.6838 21.0971 21.0971 21.9558 21.9558 23.4476 23.4476 23.7260 23.7260 k = 0.1600 0.5000-0.0000 ( 1646 PWs) bands (ev): -46.7186 -46.7186 -45.5144 -45.5144 -19.6186 -19.6186 -19.6141 -19.6141 -16.7439 -16.7439 -16.6402 -16.6402 -11.0253 -11.0253 -10.7769 -10.7769 16.4359 16.4359 16.9668 16.9668 18.4190 18.4190 19.0938 19.0938 19.2806 19.2806 19.5885 19.5885 21.1989 21.1989 21.9829 21.9829 23.5792 23.5792 23.7555 23.7555 k = 0.1700 0.5000-0.0000 ( 1646 PWs) bands (ev): -46.7183 -46.7183 -45.5140 -45.5140 -19.6211 -19.6211 -19.6157 -19.6157 -16.7436 -16.7436 -16.6423 -16.6423 -11.0248 -11.0248 -10.7795 -10.7795 16.4079 16.4079 16.9285 16.9285 18.4769 18.4769 19.1390 19.1390 19.2202 19.2202 19.4954 19.4954 21.3015 21.3015 22.0100 22.0100 23.7031 23.7031 23.7923 23.7923 k = 0.1800 0.5000-0.0000 ( 1636 PWs) bands (ev): -46.7179 -46.7179 -45.5137 -45.5137 -19.6238 -19.6238 -19.6174 -19.6174 -16.7432 -16.7432 -16.6444 -16.6444 -11.0242 -11.0242 -10.7822 -10.7822 16.3774 16.3774 16.8877 16.8877 18.5402 18.5402 19.1501 19.1501 19.2024 19.2024 19.4047 19.4047 21.4047 21.4047 22.0371 22.0371 23.7824 23.7824 23.8730 23.8730 k = 0.1900 0.5000-0.0000 ( 1640 PWs) bands (ev): -46.7175 -46.7175 -45.5134 -45.5134 -19.6266 -19.6266 -19.6191 -19.6191 -16.7429 -16.7429 -16.6466 -16.6466 -11.0238 -11.0238 -10.7849 -10.7849 16.3446 16.3446 16.8447 16.8447 18.6081 18.6081 19.0920 19.0920 19.2617 19.2617 19.3172 19.3172 21.5081 21.5081 22.0641 22.0641 23.8171 23.8171 23.9966 23.9966 k = 0.2000 0.5000-0.0000 ( 1644 PWs) bands (ev): -46.7171 -46.7171 -45.5130 -45.5130 -19.6296 -19.6296 -19.6208 -19.6208 -16.7426 -16.7426 -16.6488 -16.6488 -11.0235 -11.0235 -10.7875 -10.7875 16.3097 16.3097 16.8000 16.8000 18.6792 18.6792 19.0329 19.0329 19.2294 19.2294 19.3347 19.3347 21.6116 21.6116 22.0910 22.0910 23.8432 23.8432 24.1267 24.1267 k = 0.2100 0.5000-0.0000 ( 1640 PWs) bands (ev): -46.7167 -46.7167 -45.5126 -45.5126 -19.6325 -19.6325 -19.6225 -19.6225 -16.7423 -16.7423 -16.6509 -16.6509 -11.0232 -11.0232 -10.7900 -10.7900 16.2732 16.2732 16.7540 16.7540 18.7497 18.7497 18.9787 18.9787 19.1474 19.1474 19.4132 19.4132 21.7149 21.7149 22.1179 22.1179 23.8659 23.8659 24.2575 24.2575 k = 0.2200 0.5000-0.0000 ( 1642 PWs) bands (ev): -46.7162 -46.7162 -45.5123 -45.5123 -19.6356 -19.6356 -19.6243 -19.6243 -16.7420 -16.7420 -16.6532 -16.6532 -11.0231 -11.0231 -10.7924 -10.7924 16.2353 16.2353 16.7071 16.7071 18.8028 18.8028 18.9438 18.9438 19.0708 19.0708 19.4991 19.4991 21.8177 21.8177 22.1447 22.1447 23.8858 23.8858 24.3877 24.3877 k = 0.2300 0.5000-0.0000 ( 1642 PWs) bands (ev): -46.7158 -46.7158 -45.5119 -45.5119 -19.6387 -19.6387 -19.6261 -19.6261 -16.7418 -16.7418 -16.6553 -16.6553 -11.0231 -11.0231 -10.7948 -10.7948 16.1964 16.1964 16.6596 16.6596 18.7978 18.7978 18.9446 18.9446 19.0243 19.0243 19.5917 19.5917 21.9194 21.9194 22.1717 22.1717 23.9027 23.9027 24.5169 24.5169 k = 0.2400 0.5000-0.0000 ( 1638 PWs) bands (ev): -46.7154 -46.7154 -45.5115 -45.5115 -19.6417 -19.6417 -19.6279 -19.6279 -16.7415 -16.7415 -16.6575 -16.6575 -11.0233 -11.0233 -10.7970 -10.7970 16.1569 16.1569 16.6119 16.6119 18.7529 18.7529 18.8940 18.8940 19.0771 19.0771 19.6905 19.6905 22.0192 22.0192 22.1998 22.1998 23.9164 23.9164 24.6447 24.6447 k = 0.2500 0.5000-0.0000 ( 1634 PWs) bands (ev): -46.7149 -46.7149 -45.5111 -45.5111 -19.6449 -19.6449 -19.6296 -19.6296 -16.7413 -16.7413 -16.6596 -16.6596 -11.0235 -11.0235 -10.7990 -10.7990 16.1168 16.1168 16.5642 16.5642 18.6990 18.6990 18.8244 18.8244 19.1659 19.1659 19.7949 19.7949 22.1140 22.1140 22.2314 22.2314 23.9265 23.9265 24.7707 24.7707 k = 0.2600 0.5000-0.0000 ( 1634 PWs) bands (ev): -46.7145 -46.7145 -45.5108 -45.5108 -19.6480 -19.6480 -19.6314 -19.6314 -16.7411 -16.7411 -16.6617 -16.6617 -11.0239 -11.0239 -10.8009 -10.8009 16.0767 16.0767 16.5167 16.5167 18.6434 18.6434 18.7545 18.7545 19.2645 19.2645 19.9044 19.9044 22.1932 22.1932 22.2772 22.2772 23.9327 23.9327 24.8948 24.8948 k = 0.2700 0.5000-0.0000 ( 1642 PWs) bands (ev): -46.7141 -46.7141 -45.5104 -45.5104 -19.6511 -19.6511 -19.6333 -19.6333 -16.7411 -16.7411 -16.6638 -16.6638 -11.0245 -11.0245 -10.8027 -10.8027 16.0367 16.0367 16.4697 16.4697 18.5880 18.5880 18.6864 18.6864 19.3690 19.3690 20.0186 20.0186 22.2416 22.2416 22.3521 22.3521 23.9347 23.9347 25.0164 25.0164 k = 0.2800 0.5000-0.0000 ( 1650 PWs) bands (ev): -46.7136 -46.7136 -45.5100 -45.5100 -19.6543 -19.6543 -19.6351 -19.6351 -16.7410 -16.7410 -16.6658 -16.6658 -11.0252 -11.0252 -10.8043 -10.8043 15.9970 15.9970 16.4235 16.4235 18.5335 18.5335 18.6206 18.6206 19.4778 19.4778 20.1369 20.1369 22.2724 22.2724 22.4426 22.4426 23.9321 23.9321 25.1355 25.1355 k = 0.2900 0.5000-0.0000 ( 1650 PWs) bands (ev): -46.7132 -46.7132 -45.5097 -45.5097 -19.6573 -19.6573 -19.6369 -19.6369 -16.7410 -16.7410 -16.6677 -16.6677 -11.0260 -11.0260 -10.8057 -10.8057 15.9580 15.9580 16.3783 16.3783 18.4805 18.4805 18.5575 18.5575 19.5905 19.5905 20.2588 20.2588 22.2978 22.2978 22.5363 22.5363 23.9246 23.9246 25.2515 25.2515 k = 0.3000 0.5000-0.0000 ( 1650 PWs) bands (ev): -46.7128 -46.7128 -45.5093 -45.5093 -19.6604 -19.6604 -19.6386 -19.6386 -16.7410 -16.7410 -16.6695 -16.6695 -11.0270 -11.0270 -10.8070 -10.8070 15.9198 15.9198 16.3341 16.3341 18.4291 18.4291 18.4970 18.4970 19.7065 19.7065 20.3839 20.3839 22.3209 22.3209 22.6299 22.6299 23.9120 23.9120 25.3640 25.3640 k = 0.3100 0.5000-0.0000 ( 1658 PWs) bands (ev): -46.7124 -46.7124 -45.5090 -45.5090 -19.6633 -19.6633 -19.6404 -19.6404 -16.7411 -16.7411 -16.6712 -16.6712 -11.0280 -11.0280 -10.8080 -10.8080 15.8825 15.8825 16.2913 16.2913 18.3794 18.3794 18.4393 18.4393 19.8256 19.8256 20.5116 20.5116 22.3425 22.3425 22.7222 22.7222 23.8939 23.8939 25.4724 25.4724 k = 0.3200 0.5000-0.0000 ( 1656 PWs) bands (ev): -46.7120 -46.7120 -45.5086 -45.5086 -19.6662 -19.6662 -19.6420 -19.6420 -16.7412 -16.7412 -16.6728 -16.6728 -11.0292 -11.0292 -10.8090 -10.8090 15.8463 15.8463 16.2499 16.2499 18.3317 18.3317 18.3843 18.3843 19.9475 19.9475 20.6413 20.6413 22.3629 22.3629 22.8126 22.8126 23.8703 23.8703 25.5761 25.5761 k = 0.3300 0.5000-0.0000 ( 1656 PWs) bands (ev): -46.7116 -46.7116 -45.5083 -45.5083 -19.6690 -19.6690 -19.6437 -19.6437 -16.7414 -16.7414 -16.6743 -16.6743 -11.0304 -11.0304 -10.8097 -10.8097 15.8114 15.8114 16.2100 16.2100 18.2860 18.2860 18.3322 18.3322 20.0717 20.0717 20.7725 20.7725 22.3823 22.3823 22.9006 22.9006 23.8410 23.8410 25.6742 25.6742 k = 0.3400 0.5000-0.0000 ( 1652 PWs) bands (ev): -46.7112 -46.7112 -45.5080 -45.5080 -19.6717 -19.6717 -19.6452 -19.6452 -16.7416 -16.7416 -16.6757 -16.6757 -11.0317 -11.0317 -10.8104 -10.8104 15.7780 15.7780 16.1719 16.1719 18.2425 18.2425 18.2831 18.2831 20.1981 20.1981 20.9045 20.9045 22.4008 22.4008 22.9860 22.9860 23.8058 23.8058 25.7651 25.7651 k = 0.3500 0.5000-0.0000 ( 1652 PWs) bands (ev): -46.7109 -46.7109 -45.5076 -45.5076 -19.6743 -19.6743 -19.6467 -19.6467 -16.7418 -16.7418 -16.6770 -16.6770 -11.0331 -11.0331 -10.8109 -10.8109 15.7460 15.7460 16.1355 16.1355 18.2011 18.2011 18.2368 18.2368 20.3263 20.3263 21.0366 21.0366 22.4182 22.4182 23.0682 23.0682 23.7647 23.7647 25.8465 25.8465 k = 0.3600 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7105 -46.7105 -45.5073 -45.5073 -19.6768 -19.6768 -19.6481 -19.6481 -16.7421 -16.7421 -16.6781 -16.6781 -11.0344 -11.0344 -10.8113 -10.8113 15.7157 15.7157 16.1011 16.1011 18.1620 18.1620 18.1935 18.1935 20.4561 20.4561 21.1681 21.1681 22.4346 22.4346 23.1469 23.1469 23.7179 23.7179 25.9149 25.9149 k = 0.3700 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7102 -46.7102 -45.5071 -45.5071 -19.6792 -19.6792 -19.6495 -19.6495 -16.7424 -16.7424 -16.6792 -16.6792 -11.0358 -11.0358 -10.8115 -10.8115 15.6872 15.6872 16.0687 16.0687 18.1253 18.1253 18.1532 18.1532 20.5870 20.5870 21.2983 21.2983 22.4500 22.4500 23.2216 23.2216 23.6656 23.6656 25.9651 25.9651 k = 0.3800 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7099 -46.7099 -45.5068 -45.5068 -19.6814 -19.6814 -19.6508 -19.6508 -16.7427 -16.7427 -16.6802 -16.6802 -11.0372 -11.0372 -10.8117 -10.8117 15.6604 15.6604 16.0383 16.0383 18.0909 18.0909 18.1158 18.1158 20.7188 20.7188 21.4263 21.4263 22.4642 22.4642 23.2912 23.2912 23.6084 23.6084 25.9934 25.9934 k = 0.3900 0.5000-0.0000 ( 1642 PWs) bands (ev): -46.7096 -46.7096 -45.5065 -45.5065 -19.6835 -19.6835 -19.6520 -19.6520 -16.7431 -16.7431 -16.6810 -16.6810 -11.0385 -11.0385 -10.8118 -10.8118 15.6355 15.6355 16.0102 16.0102 18.0590 18.0590 18.0816 18.0816 20.8510 20.8510 21.5512 21.5512 22.4774 22.4774 23.3532 23.3532 23.5489 23.5489 26.0008 26.0008 k = 0.4000 0.5000-0.0000 ( 1646 PWs) bands (ev): -46.7093 -46.7093 -45.5063 -45.5063 -19.6854 -19.6854 -19.6531 -19.6531 -16.7434 -16.7434 -16.6818 -16.6818 -11.0398 -11.0398 -10.8119 -10.8119 15.6126 15.6126 15.9842 15.9842 18.0296 18.0296 18.0503 18.0503 20.9833 20.9833 21.6720 21.6720 22.4893 22.4893 23.3939 23.3939 23.5005 23.5005 25.9927 25.9928 k = 0.4100 0.5000-0.0000 ( 1646 PWs) bands (ev): -46.7091 -46.7091 -45.5061 -45.5061 -19.6872 -19.6872 -19.6542 -19.6542 -16.7438 -16.7438 -16.6825 -16.6825 -11.0410 -11.0410 -10.8119 -10.8119 15.5917 15.5917 15.9606 15.9606 18.0027 18.0027 18.0221 18.0221 21.1149 21.1149 21.7877 21.7877 22.5001 22.5001 23.3670 23.3670 23.5096 23.5096 25.9750 25.9750 k = 0.4200 0.5000-0.0000 ( 1646 PWs) bands (ev): -46.7089 -46.7089 -45.5059 -45.5059 -19.6888 -19.6888 -19.6551 -19.6551 -16.7441 -16.7441 -16.6831 -16.6831 -11.0422 -11.0422 -10.8119 -10.8119 15.5728 15.5728 15.9393 15.9393 17.9785 17.9785 17.9970 17.9970 21.2455 21.2455 21.8970 21.8970 22.5095 22.5095 23.2968 23.2968 23.5521 23.5521 25.9517 25.9517 k = 0.4300 0.5000-0.0000 ( 1642 PWs) bands (ev): -46.7087 -46.7087 -45.5057 -45.5057 -19.6903 -19.6903 -19.6559 -19.6559 -16.7444 -16.7444 -16.6836 -16.6836 -11.0432 -11.0432 -10.8118 -10.8118 15.5561 15.5561 15.9204 15.9204 17.9569 17.9569 17.9749 17.9749 21.3741 21.3741 21.9988 21.9988 22.5177 22.5177 23.2156 23.2156 23.5959 23.5959 25.9257 25.9257 k = 0.4400 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7085 -46.7085 -45.5056 -45.5056 -19.6915 -19.6915 -19.6567 -19.6567 -16.7447 -16.7447 -16.6840 -16.6840 -11.0441 -11.0441 -10.8118 -10.8118 15.5416 15.5416 15.9039 15.9039 17.9381 17.9381 17.9558 17.9558 21.4996 21.4996 22.0919 22.0919 22.5246 22.5246 23.1293 23.1293 23.6358 23.6358 25.8989 25.8989 k = 0.4500 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7083 -46.7083 -45.5055 -45.5055 -19.6926 -19.6926 -19.6573 -19.6573 -16.7449 -16.7449 -16.6844 -16.6844 -11.0449 -11.0449 -10.8117 -10.8117 15.5292 15.5292 15.8899 15.8899 17.9221 17.9221 17.9396 17.9396 21.6205 21.6205 22.1747 22.1747 22.5305 22.5305 23.0402 23.0402 23.6703 23.6703 25.8732 25.8732 k = 0.4600 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7082 -46.7082 -45.5054 -45.5054 -19.6935 -19.6935 -19.6578 -19.6578 -16.7452 -16.7452 -16.6847 -16.6847 -11.0456 -11.0456 -10.8116 -10.8116 15.5190 15.5190 15.8784 15.8784 17.9089 17.9089 17.9265 17.9265 21.7346 21.7346 22.2460 22.2460 22.5360 22.5360 22.9504 22.9504 23.6990 23.6990 25.8499 25.8499 k = 0.4700 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7081 -46.7081 -45.5053 -45.5053 -19.6942 -19.6942 -19.6582 -19.6582 -16.7453 -16.7453 -16.6849 -16.6849 -11.0462 -11.0462 -10.8115 -10.8115 15.5111 15.5111 15.8694 15.8694 17.8986 17.8986 17.9162 17.9162 21.8379 21.8379 22.3037 22.3037 22.5425 22.5425 22.8629 22.8629 23.7214 23.7214 25.8304 25.8304 k = 0.4800 0.5000-0.0000 ( 1648 PWs) bands (ev): -46.7081 -46.7081 -45.5052 -45.5052 -19.6947 -19.6947 -19.6585 -19.6585 -16.7455 -16.7455 -16.6851 -16.6851 -11.0465 -11.0465 -10.8115 -10.8115 15.5054 15.5054 15.8630 15.8630 17.8912 17.8912 17.9089 17.9089 21.9244 21.9244 22.3456 22.3456 22.5530 22.5530 22.7823 22.7823 23.7376 23.7376 25.8156 25.8156 k = 0.4900 0.5000-0.0000 ( 1652 PWs) bands (ev): -46.7080 -46.7080 -45.5052 -45.5052 -19.6950 -19.6950 -19.6587 -19.6587 -16.7456 -16.7456 -16.6852 -16.6852 -11.0468 -11.0468 -10.8115 -10.8115 15.5020 15.5020 15.8592 15.8592 17.8868 17.8868 17.9045 17.9045 21.9843 21.9843 22.3698 22.3698 22.5694 22.5694 22.7169 22.7169 23.7473 23.7473 25.8064 25.8064 k = 0.5000 0.5000-0.0000 ( 1652 PWs) bands (ev): -46.7080 -46.7080 -45.5052 -45.5052 -19.6951 -19.6951 -19.6588 -19.6588 -16.7456 -16.7456 -16.6852 -16.6852 -11.0469 -11.0469 -10.8115 -10.8115 15.5008 15.5008 15.8579 15.8579 17.8853 17.8853 17.9031 17.9031 22.0062 22.0062 22.3774 22.3774 22.5813 22.5813 22.6874 22.6874 23.7505 23.7505 25.8032 25.8032 k = 0.5000 0.5000-0.0000 ( 1652 PWs) bands (ev): -46.7080 -46.7080 -45.5052 -45.5052 -19.6951 -19.6951 -19.6588 -19.6588 -16.7456 -16.7456 -16.6852 -16.6852 -11.0469 -11.0469 -10.8115 -10.8115 15.5008 15.5008 15.8579 15.8579 17.8853 17.8853 17.9031 17.9031 22.0062 22.0062 22.3774 22.3774 22.5813 22.5813 22.6874 22.6874 23.7505 23.7505 25.8032 25.8032 k = 0.4930 0.4930-0.0000 ( 1652 PWs) bands (ev): -46.7080 -46.7080 -45.5052 -45.5052 -19.6950 -19.6950 -19.6587 -19.6587 -16.7456 -16.7456 -16.6852 -16.6852 -11.0468 -11.0468 -10.8115 -10.8115 15.5020 15.5020 15.8592 15.8592 17.8868 17.8868 17.9045 17.9045 21.9846 21.9846 22.3689 22.3689 22.5713 22.5713 22.7157 22.7157 23.7473 23.7473 25.8064 25.8064 k = 0.4859 0.4859-0.0000 ( 1648 PWs) bands (ev): -46.7081 -46.7081 -45.5052 -45.5052 -19.6947 -19.6947 -19.6585 -19.6585 -16.7455 -16.7455 -16.6851 -16.6851 -11.0465 -11.0465 -10.8115 -10.8115 15.5053 15.5053 15.8630 15.8630 17.8908 17.8908 17.9093 17.9093 21.9264 21.9264 22.3359 22.3359 22.5692 22.5692 22.7740 22.7740 23.7378 23.7378 25.8157 25.8157 k = 0.4789 0.4789-0.0000 ( 1644 PWs) bands (ev): -46.7081 -46.7081 -45.5053 -45.5053 -19.6942 -19.6942 -19.6581 -19.6581 -16.7453 -16.7453 -16.6849 -16.6849 -11.0461 -11.0461 -10.8115 -10.8115 15.5108 15.5108 15.8694 15.8694 17.8967 17.8967 17.9179 17.9179 21.8434 21.8434 22.2771 22.2771 22.5850 22.5850 22.8414 22.8414 23.7222 23.7222 25.8313 25.8313 k = 0.4718 0.4718-0.0000 ( 1644 PWs) bands (ev): -46.7082 -46.7082 -45.5053 -45.5053 -19.6937 -19.6937 -19.6576 -19.6576 -16.7451 -16.7451 -16.6847 -16.6847 -11.0456 -11.0456 -10.8116 -10.8116 15.5184 15.5184 15.8784 15.8784 17.9038 17.9038 17.9312 17.9312 21.7448 21.7448 22.2017 22.2017 22.6068 22.6068 22.9116 22.9116 23.7009 23.7009 25.8531 25.8531 k = 0.4648 0.4648-0.0000 ( 1642 PWs) bands (ev): -46.7083 -46.7083 -45.5055 -45.5055 -19.6930 -19.6930 -19.6568 -19.6568 -16.7449 -16.7449 -16.6844 -16.6844 -11.0449 -11.0449 -10.8117 -10.8117 15.5279 15.5279 15.8901 15.8901 17.9119 17.9119 17.9492 17.9492 21.6359 21.6359 22.1161 22.1161 22.6262 22.6262 22.9817 22.9817 23.6746 23.6746 25.8810 25.8810 k = 0.4577 0.4577-0.0000 ( 1648 PWs) bands (ev): -46.7085 -46.7085 -45.5056 -45.5056 -19.6925 -19.6925 -19.6558 -19.6558 -16.7447 -16.7447 -16.6841 -16.6841 -11.0440 -11.0440 -10.8118 -10.8118 15.5391 15.5391 15.9045 15.9045 17.9213 17.9213 17.9717 17.9717 21.5201 21.5201 22.0230 22.0230 22.6396 22.6396 23.0493 23.0493 23.6441 23.6441 25.9148 25.9148 k = 0.4507 0.4507-0.0000 ( 1648 PWs) bands (ev): -46.7087 -46.7087 -45.5057 -45.5057 -19.6919 -19.6919 -19.6543 -19.6543 -16.7443 -16.7443 -16.6837 -16.6837 -11.0430 -11.0430 -10.8119 -10.8119 15.5517 15.5517 15.9216 15.9216 17.9319 17.9319 17.9987 17.9987 21.3992 21.3992 21.9238 21.9238 22.6454 22.6454 23.1129 23.1129 23.6104 23.6104 25.9538 25.9538 k = 0.4437 0.4437-0.0000 ( 1648 PWs) bands (ev): -46.7089 -46.7089 -45.5059 -45.5059 -19.6916 -19.6916 -19.6524 -19.6524 -16.7439 -16.7439 -16.6833 -16.6833 -11.0418 -11.0418 -10.8120 -10.8120 15.5656 15.5656 15.9416 15.9416 17.9440 17.9440 18.0299 18.0299 21.2746 21.2746 21.8196 21.8196 22.6429 22.6429 23.1710 23.1710 23.5747 23.5747 25.9966 25.9966 k = 0.4366 0.4366-0.0000 ( 1648 PWs) bands (ev): -46.7091 -46.7091 -45.5061 -45.5061 -19.6915 -19.6915 -19.6499 -19.6499 -16.7435 -16.7435 -16.6828 -16.6828 -11.0405 -11.0405 -10.8121 -10.8121 15.5803 15.5803 15.9644 15.9644 17.9575 17.9575 18.0653 18.0653 21.1473 21.1473 21.7110 21.7110 22.6319 22.6319 23.2220 23.2220 23.5389 23.5389 26.0396 26.0396 k = 0.4296 0.4296-0.0000 ( 1648 PWs) bands (ev): -46.7094 -46.7094 -45.5063 -45.5063 -19.6918 -19.6918 -19.6468 -19.6468 -16.7430 -16.7430 -16.6823 -16.6823 -11.0389 -11.0389 -10.8122 -10.8122 15.5957 15.5957 15.9900 15.9900 17.9726 17.9726 18.1048 18.1048 21.0180 21.0180 21.5987 21.5987 22.6125 22.6125 23.2637 23.2637 23.5054 23.5054 26.0703 26.0703 k = 0.4225 0.4225-0.0000 ( 1644 PWs) bands (ev): -46.7097 -46.7097 -45.5065 -45.5065 -19.6923 -19.6923 -19.6432 -19.6432 -16.7425 -16.7425 -16.6817 -16.6817 -11.0372 -11.0372 -10.8122 -10.8122 15.6112 15.6112 16.0186 16.0186 17.9890 17.9890 18.1485 18.1485 20.8872 20.8872 21.4833 21.4833 22.5848 22.5848 23.2925 23.2925 23.4787 23.4787 26.0563 26.0563 k = 0.4155 0.4155-0.0000 ( 1644 PWs) bands (ev): -46.7100 -46.7100 -45.5067 -45.5067 -19.6931 -19.6931 -19.6390 -19.6390 -16.7419 -16.7419 -16.6810 -16.6810 -11.0354 -11.0354 -10.8123 -10.8123 15.6267 15.6267 16.0500 16.0500 18.0070 18.0070 18.1961 18.1961 20.7553 20.7553 21.3655 21.3655 22.5493 22.5493 23.3026 23.3026 23.4650 23.4650 25.9871 25.9871 k = 0.4085 0.4085-0.0000 ( 1648 PWs) bands (ev): -46.7103 -46.7103 -45.5070 -45.5070 -19.6942 -19.6942 -19.6343 -19.6343 -16.7413 -16.7413 -16.6803 -16.6803 -11.0333 -11.0333 -10.8123 -10.8123 15.6416 15.6416 16.0842 16.0842 18.0263 18.0263 18.2477 18.2477 20.6227 20.6227 21.2460 21.2460 22.5064 22.5064 23.2922 23.2922 23.4667 23.4667 25.8911 25.8911 k = 0.4014 0.4014-0.0000 ( 1648 PWs) bands (ev): -46.7107 -46.7107 -45.5072 -45.5072 -19.6956 -19.6956 -19.6291 -19.6291 -16.7406 -16.7406 -16.6796 -16.6796 -11.0311 -11.0311 -10.8122 -10.8122 15.6558 15.6558 16.1210 16.1210 18.0472 18.0472 18.3031 18.3031 20.4898 20.4898 21.1253 21.1253 22.4570 22.4570 23.2681 23.2681 23.4777 23.4777 25.7831 25.7831 k = 0.3944 0.3944-0.0000 ( 1648 PWs) bands (ev): -46.7111 -46.7111 -45.5075 -45.5075 -19.6973 -19.6973 -19.6233 -19.6233 -16.7399 -16.7399 -16.6788 -16.6788 -11.0287 -11.0287 -10.8122 -10.8122 15.6687 15.6687 16.1603 16.1603 18.0694 18.0694 18.3624 18.3624 20.3568 20.3568 21.0042 21.0042 22.4020 22.4020 23.2377 23.2377 23.4910 23.4910 25.6677 25.6677 k = 0.3873 0.3873-0.0000 ( 1644 PWs) bands (ev): -46.7116 -46.7116 -45.5077 -45.5077 -19.6992 -19.6992 -19.6171 -19.6171 -16.7391 -16.7391 -16.6780 -16.6780 -11.0260 -11.0260 -10.8120 -10.8120 15.6802 15.6802 16.2018 16.2018 18.0930 18.0930 18.4255 18.4255 20.2239 20.2239 20.8834 20.8834 22.3426 22.3426 23.2048 23.2048 23.5031 23.5031 25.5472 25.5472 k = 0.3803 0.3803-0.0000 ( 1644 PWs) bands (ev): -46.7121 -46.7121 -45.5080 -45.5080 -19.7014 -19.7014 -19.6104 -19.6104 -16.7383 -16.7383 -16.6772 -16.6772 -11.0232 -11.0232 -10.8118 -10.8118 15.6898 15.6898 16.2451 16.2451 18.1180 18.1180 18.4922 18.4922 20.0913 20.0913 20.7636 20.7636 22.2799 22.2799 23.1711 23.1711 23.5126 23.5126 25.4227 25.4227 k = 0.3732 0.3732-0.0000 ( 1640 PWs) bands (ev): -46.7126 -46.7126 -45.5083 -45.5083 -19.7037 -19.7037 -19.6034 -19.6034 -16.7375 -16.7375 -16.6763 -16.6763 -11.0202 -11.0202 -10.8116 -10.8116 15.6971 15.6971 16.2901 16.2901 18.1443 18.1443 18.5624 18.5624 19.9592 19.9592 20.6454 20.6454 22.2152 22.2152 23.1373 23.1373 23.5192 23.5192 25.2953 25.2953 k = 0.3662 0.3662-0.0000 ( 1640 PWs) bands (ev): -46.7131 -46.7131 -45.5086 -45.5086 -19.7063 -19.7063 -19.5960 -19.5960 -16.7366 -16.7366 -16.6754 -16.6754 -11.0170 -11.0170 -10.8112 -10.8112 15.7017 15.7017 16.3362 16.3362 18.1719 18.1719 18.6361 18.6361 19.8279 19.8279 20.5296 20.5296 22.1497 22.1497 23.1036 23.1036 23.5228 23.5228 25.1656 25.1656 k = 0.3592 0.3592-0.0000 ( 1642 PWs) bands (ev): -46.7137 -46.7137 -45.5089 -45.5089 -19.7090 -19.7090 -19.5883 -19.5883 -16.7357 -16.7357 -16.6745 -16.6745 -11.0136 -11.0136 -10.8108 -10.8108 15.7034 15.7034 16.3831 16.3831 18.2008 18.2008 18.7131 18.7131 19.6973 19.6973 20.4169 20.4169 22.0844 22.0844 23.0703 23.0703 23.5235 23.5235 25.0343 25.0343 k = 0.3521 0.3521-0.0000 ( 1638 PWs) bands (ev): -46.7143 -46.7143 -45.5091 -45.5091 -19.7119 -19.7119 -19.5803 -19.5803 -16.7347 -16.7347 -16.6735 -16.6735 -11.0099 -11.0099 -10.8103 -10.8103 15.7016 15.7016 16.4303 16.4303 18.2309 18.2309 18.7932 18.7932 19.5678 19.5678 20.3080 20.3080 22.0207 22.0207 23.0373 23.0373 23.5216 23.5216 24.9021 24.9021 k = 0.3451 0.3451-0.0000 ( 1634 PWs) bands (ev): -46.7149 -46.7149 -45.5094 -45.5094 -19.7148 -19.7148 -19.5720 -19.5720 -16.7336 -16.7336 -16.6726 -16.6726 -11.0061 -11.0061 -10.8097 -10.8097 15.6960 15.6960 16.4773 16.4773 18.2622 18.2622 18.8762 18.8762 19.4395 19.4395 20.2037 20.2037 21.9595 21.9595 23.0047 23.0047 23.5174 23.5174 24.7695 24.7695 k = 0.3380 0.3380-0.0000 ( 1634 PWs) bands (ev): -46.7155 -46.7155 -45.5097 -45.5097 -19.7180 -19.7180 -19.5634 -19.5634 -16.7325 -16.7325 -16.6716 -16.6716 -11.0020 -11.0020 -10.8090 -10.8090 15.6862 15.6862 16.5235 16.5235 18.2946 18.2946 18.9615 18.9615 19.3127 19.3127 20.1048 20.1048 21.9020 21.9020 22.9725 22.9725 23.5111 23.5111 24.6372 24.6372 k = 0.3310 0.3310-0.0000 ( 1634 PWs) bands (ev): -46.7162 -46.7162 -45.5099 -45.5099 -19.7214 -19.7214 -19.5545 -19.5545 -16.7314 -16.7314 -16.6707 -16.6707 -10.9977 -10.9977 -10.8082 -10.8082 15.6718 15.6718 16.5683 16.5683 18.3282 18.3282 19.0470 19.0470 19.1894 19.1894 20.0119 20.0119 21.8490 21.8490 22.9407 22.9407 23.5029 23.5029 24.5056 24.5056 k = 0.3239 0.3239-0.0000 ( 1634 PWs) bands (ev): -46.7169 -46.7169 -45.5102 -45.5102 -19.7249 -19.7249 -19.5454 -19.5454 -16.7302 -16.7302 -16.6698 -16.6698 -10.9932 -10.9932 -10.8073 -10.8073 15.6525 15.6525 16.6113 16.6113 18.3629 18.3629 19.0516 19.0516 19.1503 19.1503 19.9260 19.9260 21.8015 21.8015 22.9095 22.9095 23.4930 23.4930 24.3754 24.3754 k = 0.3169 0.3169-0.0000 ( 1632 PWs) bands (ev): -46.7177 -46.7177 -45.5104 -45.5104 -19.7285 -19.7285 -19.5361 -19.5361 -16.7290 -16.7290 -16.6688 -16.6688 -10.9884 -10.9884 -10.8063 -10.8063 15.6279 15.6279 16.6518 16.6518 18.3985 18.3985 18.9332 18.9332 19.2370 19.2370 19.8479 19.8479 21.7605 21.7605 22.8789 22.8789 23.4815 23.4815 24.2473 24.2473 k = 0.3099 0.3099-0.0000 ( 1632 PWs) bands (ev): -46.7185 -46.7185 -45.5107 -45.5107 -19.7322 -19.7322 -19.5266 -19.5266 -16.7277 -16.7277 -16.6680 -16.6680 -10.9835 -10.9835 -10.8052 -10.8052 15.5977 15.5977 16.6893 16.6893 18.4352 18.4352 18.8119 18.8119 19.3280 19.3280 19.7792 19.7792 21.7267 21.7267 22.8491 22.8491 23.4683 23.4683 24.1220 24.1220 k = 0.3028 0.3028-0.0000 ( 1632 PWs) bands (ev): -46.7193 -46.7193 -45.5109 -45.5109 -19.7360 -19.7360 -19.5170 -19.5170 -16.7264 -16.7264 -16.6671 -16.6671 -10.9783 -10.9783 -10.8040 -10.8040 15.5619 15.5619 16.7231 16.7231 18.4727 18.4727 18.6915 18.6915 19.4164 19.4164 19.7233 19.7233 21.7009 21.7009 22.8201 22.8201 23.4534 23.4534 24.0003 24.0003 k = 0.2958 0.2958-0.0000 ( 1632 PWs) bands (ev): -46.7201 -46.7201 -45.5111 -45.5111 -19.7400 -19.7400 -19.5073 -19.5073 -16.7250 -16.7250 -16.6662 -16.6662 -10.9729 -10.9729 -10.8026 -10.8026 15.5204 15.5204 16.7529 16.7529 18.5111 18.5111 18.5726 18.5726 19.4905 19.4905 19.6912 19.6912 21.6837 21.6837 22.7921 22.7921 23.4362 23.4362 23.8836 23.8836 k = 0.2887 0.2887-0.0000 ( 1634 PWs) bands (ev): -46.7210 -46.7210 -45.5113 -45.5113 -19.7440 -19.7440 -19.4974 -19.4974 -16.7235 -16.7235 -16.6654 -16.6654 -10.9672 -10.9672 -10.8012 -10.8012 15.4730 15.4730 16.7780 16.7780 18.4551 18.4551 18.5503 18.5503 19.5217 19.5217 19.7111 19.7111 21.6756 21.6756 22.7652 22.7652 23.4157 23.4157 23.7737 23.7737 k = 0.2817 0.2817-0.0000 ( 1638 PWs) bands (ev): -46.7218 -46.7218 -45.5115 -45.5115 -19.7481 -19.7481 -19.4875 -19.4875 -16.7221 -16.7221 -16.6647 -16.6647 -10.9614 -10.9614 -10.7996 -10.7996 15.4200 15.4200 16.7982 16.7982 18.3395 18.3395 18.5903 18.5903 19.5096 19.5096 19.7829 19.7829 21.6771 21.6771 22.7396 22.7396 23.3898 23.3898 23.6735 23.6735 k = 0.2746 0.2746-0.0000 ( 1638 PWs) bands (ev): -46.7228 -46.7228 -45.5116 -45.5116 -19.7523 -19.7523 -19.4774 -19.4774 -16.7206 -16.7206 -16.6639 -16.6639 -10.9553 -10.9553 -10.7980 -10.7980 15.3614 15.3614 16.8131 16.8131 18.2256 18.2256 18.6309 18.6309 19.4864 19.4864 19.8737 19.8737 21.6883 21.6883 22.7156 22.7156 23.3547 23.3547 23.5879 23.5879 k = 0.2676 0.2676-0.0000 ( 1632 PWs) bands (ev): -46.7237 -46.7237 -45.5118 -45.5118 -19.7565 -19.7565 -19.4674 -19.4674 -16.7189 -16.7189 -16.6632 -16.6632 -10.9490 -10.9490 -10.7962 -10.7962 15.2977 15.2977 16.8226 16.8226 18.1136 18.1136 18.6721 18.6721 19.4648 19.4648 19.9699 19.9699 21.7096 21.7096 22.6932 22.6932 23.3062 23.3062 23.5221 23.5221 k = 0.2606 0.2606-0.0000 ( 1632 PWs) bands (ev): -46.7246 -46.7246 -45.5119 -45.5119 -19.7608 -19.7608 -19.4573 -19.4573 -16.7173 -16.7173 -16.6626 -16.6626 -10.9425 -10.9425 -10.7943 -10.7943 15.2290 15.2290 16.8265 16.8265 18.0036 18.0036 18.7138 18.7138 19.4480 19.4480 20.0670 20.0670 21.7405 21.7405 22.6728 22.6728 23.2449 23.2449 23.4766 23.4766 k = 0.2535 0.2535-0.0000 ( 1644 PWs) bands (ev): -46.7256 -46.7256 -45.5120 -45.5120 -19.7652 -19.7652 -19.4472 -19.4472 -16.7157 -16.7157 -16.6621 -16.6621 -10.9358 -10.9358 -10.7924 -10.7924 15.1560 15.1560 16.8249 16.8249 17.8956 17.8956 18.7561 18.7561 19.4367 19.4367 20.1626 20.1626 21.7810 21.7810 22.6548 22.6548 23.1781 23.1781 23.4453 23.4453 k = 0.2465 0.2465-0.0000 ( 1644 PWs) bands (ev): -46.7266 -46.7266 -45.5121 -45.5121 -19.7695 -19.7695 -19.4371 -19.4371 -16.7140 -16.7140 -16.6615 -16.6615 -10.9290 -10.9290 -10.7904 -10.7904 15.0789 15.0789 16.8178 16.8178 17.7898 17.7898 18.7987 18.7987 19.4311 19.4311 20.2552 20.2552 21.8305 21.8305 22.6396 22.6396 23.1134 23.1134 23.4224 23.4224 k = 0.2394 0.2394-0.0000 ( 1644 PWs) bands (ev): -46.7276 -46.7276 -45.5121 -45.5121 -19.7740 -19.7740 -19.4271 -19.4271 -16.7122 -16.7122 -16.6610 -16.6610 -10.9219 -10.9219 -10.7882 -10.7882 14.9984 14.9984 16.8056 16.8056 17.6862 17.6862 18.8416 18.8416 19.4307 19.4307 20.3431 20.3431 21.8883 21.8883 22.6278 22.6278 23.0559 23.0559 23.4042 23.4042 k = 0.2324 0.2324-0.0000 ( 1644 PWs) bands (ev): -46.7286 -46.7286 -45.5122 -45.5122 -19.7784 -19.7784 -19.4171 -19.4171 -16.7104 -16.7104 -16.6606 -16.6606 -10.9147 -10.9147 -10.7860 -10.7860 14.9149 14.9149 16.7885 16.7885 17.5848 17.5848 18.8847 18.8847 19.4351 19.4351 20.4244 20.4244 21.9533 21.9533 22.6204 22.6204 23.0091 23.0091 23.3889 23.3889 k = 0.2254 0.2254-0.0000 ( 1644 PWs) bands (ev): -46.7296 -46.7296 -45.5122 -45.5122 -19.7829 -19.7829 -19.4071 -19.4071 -16.7086 -16.7086 -16.6603 -16.6603 -10.9073 -10.9073 -10.7837 -10.7837 14.8290 14.8290 16.7669 16.7669 17.4858 17.4858 18.9279 18.9279 19.4437 19.4437 20.4973 20.4973 22.0242 22.0242 22.6185 22.6185 22.9758 22.9758 23.3756 23.3756 k = 0.2183 0.2183-0.0000 ( 1648 PWs) bands (ev): -46.7306 -46.7306 -45.5122 -45.5122 -19.7873 -19.7873 -19.3973 -19.3973 -16.7068 -16.7068 -16.6600 -16.6600 -10.8998 -10.8998 -10.7814 -10.7814 14.7412 14.7412 16.7412 16.7412 17.3892 17.3892 18.9712 18.9712 19.4560 19.4560 20.5598 20.5598 22.0994 22.0994 22.6235 22.6235 22.9583 22.9583 23.3638 23.3638 k = 0.2113 0.2113-0.0000 ( 1654 PWs) bands (ev): -46.7317 -46.7317 -45.5122 -45.5122 -19.7918 -19.7918 -19.3876 -19.3876 -16.7049 -16.7049 -16.6598 -16.6598 -10.8922 -10.8922 -10.7790 -10.7790 14.6520 14.6520 16.7118 16.7118 17.2951 17.2951 19.0144 19.0144 19.4714 19.4714 20.6103 20.6103 22.1767 22.1767 22.6367 22.6367 22.9588 22.9588 23.3535 23.3535 k = 0.2042 0.2042-0.0000 ( 1654 PWs) bands (ev): -46.7327 -46.7327 -45.5122 -45.5122 -19.7962 -19.7962 -19.3780 -19.3780 -16.7030 -16.7030 -16.6596 -16.6596 -10.8845 -10.8845 -10.7766 -10.7766 14.5619 14.5619 16.6793 16.6793 17.2035 17.2035 19.0575 19.0575 19.4893 19.4893 20.6476 20.6476 22.2538 22.2538 22.6594 22.6594 22.9794 22.9794 23.3444 23.3444 k = 0.1972 0.1972-0.0000 ( 1658 PWs) bands (ev): -46.7338 -46.7338 -45.5121 -45.5121 -19.8006 -19.8006 -19.3686 -19.3686 -16.7011 -16.7011 -16.6595 -16.6595 -10.8767 -10.8767 -10.7741 -10.7741 14.4713 14.4713 16.6440 16.6440 17.1145 17.1145 19.1003 19.1003 19.5091 19.5091 20.6708 20.6708 22.3278 22.3278 22.6932 22.6932 23.0215 23.0215 23.3366 23.3366 k = 0.1901 0.1901-0.0000 ( 1658 PWs) bands (ev): -46.7348 -46.7348 -45.5121 -45.5121 -19.8050 -19.8050 -19.3593 -19.3593 -16.6992 -16.6992 -16.6594 -16.6594 -10.8689 -10.8689 -10.7716 -10.7716 14.3808 14.3808 16.6066 16.6066 17.0282 17.0282 19.1427 19.1427 19.5303 19.5303 20.6804 20.6804 22.3955 22.3955 22.7400 22.7400 23.0852 23.0852 23.3304 23.3304 k = 0.1831 0.1831-0.0000 ( 1646 PWs) bands (ev): -46.7358 -46.7358 -45.5120 -45.5120 -19.8093 -19.8093 -19.3502 -19.3502 -16.6972 -16.6972 -16.6593 -16.6593 -10.8610 -10.8610 -10.7691 -10.7691 14.2906 14.2906 16.5674 16.5674 16.9446 16.9446 19.1847 19.1847 19.5526 19.5526 20.6772 20.6772 22.4544 22.4544 22.8021 22.8021 23.1689 23.1689 23.3262 23.3262 k = 0.1761 0.1761-0.0000 ( 1647 PWs) bands (ev): -46.7369 -46.7369 -45.5119 -45.5119 -19.8135 -19.8135 -19.3413 -19.3413 -16.6953 -16.6953 -16.6593 -16.6593 -10.8531 -10.8531 -10.7666 -10.7666 14.2013 14.2013 16.5268 16.5268 16.8637 16.8637 19.2261 19.2261 19.5753 19.5753 20.6628 20.6628 22.5040 22.5040 22.8794 22.8794 23.2701 23.2701 23.3249 23.3249 k = 0.1690 0.1690-0.0000 ( 1647 PWs) bands (ev): -46.7379 -46.7379 -45.5118 -45.5118 -19.8177 -19.8177 -19.3326 -19.3326 -16.6934 -16.6934 -16.6594 -16.6594 -10.8452 -10.8452 -10.7640 -10.7640 14.1131 14.1131 16.4853 16.4853 16.7856 16.7856 19.2668 19.2668 19.5981 19.5981 20.6389 20.6389 22.5459 22.5459 22.9686 22.9686 23.3285 23.3285 23.3857 23.3857 k = 0.1620 0.1620-0.0000 ( 1651 PWs) bands (ev): -46.7389 -46.7389 -45.5116 -45.5116 -19.8218 -19.8218 -19.3242 -19.3242 -16.6915 -16.6915 -16.6595 -16.6595 -10.8373 -10.8373 -10.7615 -10.7615 14.0264 14.0264 16.4433 16.4433 16.7103 16.7103 19.3067 19.3067 19.6207 19.6207 20.6075 20.6075 22.5830 22.5830 23.0618 23.0618 23.3425 23.3425 23.5128 23.5128 k = 0.1549 0.1549-0.0000 ( 1659 PWs) bands (ev): -46.7399 -46.7399 -45.5115 -45.5115 -19.8259 -19.8259 -19.3160 -19.3160 -16.6896 -16.6896 -16.6597 -16.6597 -10.8295 -10.8295 -10.7590 -10.7590 13.9415 13.9415 16.4009 16.4009 16.6379 16.6379 19.3457 19.3457 19.6427 19.6427 20.5703 20.5703 22.6175 22.6175 23.1435 23.1435 23.3797 23.3797 23.6490 23.6490 k = 0.1479 0.1479-0.0000 ( 1659 PWs) bands (ev): -46.7408 -46.7408 -45.5114 -45.5114 -19.8299 -19.8299 -19.3081 -19.3081 -16.6877 -16.6877 -16.6599 -16.6599 -10.8218 -10.8218 -10.7565 -10.7565 13.8587 13.8587 16.3587 16.3587 16.5685 16.5685 19.3837 19.3837 19.6640 19.6640 20.5291 20.5291 22.6511 22.6511 23.1951 23.1951 23.4565 23.4565 23.7925 23.7925 k = 0.1408 0.1408-0.0000 ( 1655 PWs) bands (ev): -46.7418 -46.7418 -45.5112 -45.5112 -19.8337 -19.8337 -19.3004 -19.3004 -16.6859 -16.6859 -16.6601 -16.6601 -10.8142 -10.8142 -10.7541 -10.7541 13.7782 13.7782 16.3170 16.3170 16.5020 16.5020 19.4205 19.4205 19.6843 19.6843 20.4852 20.4852 22.6848 22.6848 23.2188 23.2188 23.5690 23.5690 23.9414 23.9414 k = 0.1338 0.1338-0.0000 ( 1659 PWs) bands (ev): -46.7427 -46.7427 -45.5111 -45.5111 -19.8374 -19.8374 -19.2931 -19.2931 -16.6841 -16.6841 -16.6604 -16.6604 -10.8068 -10.8068 -10.7517 -10.7517 13.7003 13.7003 16.2759 16.2759 16.4385 16.4385 19.4560 19.4560 19.7035 19.7035 20.4397 20.4397 22.7191 22.7191 23.2287 23.2287 23.7014 23.7014 24.0946 24.0946 k = 0.1268 0.1268-0.0000 ( 1661 PWs) bands (ev): -46.7436 -46.7436 -45.5109 -45.5109 -19.8410 -19.8410 -19.2860 -19.2860 -16.6824 -16.6824 -16.6606 -16.6606 -10.7995 -10.7995 -10.7494 -10.7494 13.6252 13.6252 16.2357 16.2357 16.3781 16.3781 19.4901 19.4901 19.7213 19.7213 20.3937 20.3937 22.7543 22.7543 23.2329 23.2329 23.8446 23.8446 24.2506 24.2506 k = 0.1197 0.1197-0.0000 ( 1661 PWs) bands (ev): -46.7445 -46.7445 -45.5108 -45.5108 -19.8444 -19.8444 -19.2793 -19.2793 -16.6806 -16.6806 -16.6609 -16.6609 -10.7924 -10.7924 -10.7471 -10.7471 13.5532 13.5532 16.1966 16.1966 16.3207 16.3207 19.5227 19.5227 19.7378 19.7378 20.3480 20.3480 22.7902 22.7902 23.2346 23.2346 23.9945 23.9945 24.4086 24.4086 k = 0.1127 0.1127-0.0000 ( 1657 PWs) bands (ev): -46.7453 -46.7453 -45.5106 -45.5106 -19.8477 -19.8477 -19.2728 -19.2728 -16.6790 -16.6790 -16.6612 -16.6612 -10.7856 -10.7856 -10.7449 -10.7449 13.4843 13.4843 16.1589 16.1589 16.2665 16.2665 19.5536 19.5536 19.7529 19.7529 20.3034 20.3034 22.8269 22.8269 23.2351 23.2351 24.1486 24.1486 24.5674 24.5674 k = 0.1056 0.1056-0.0000 ( 1661 PWs) bands (ev): -46.7461 -46.7461 -45.5105 -45.5105 -19.8509 -19.8509 -19.2667 -19.2667 -16.6774 -16.6774 -16.6616 -16.6616 -10.7790 -10.7790 -10.7429 -10.7429 13.4189 13.4189 16.1227 16.1227 16.2153 16.2153 19.5827 19.5827 19.7664 19.7664 20.2605 20.2605 22.8640 22.8640 23.2350 23.2350 24.3054 24.3054 24.7258 24.7258 k = 0.0986 0.0986-0.0000 ( 1661 PWs) bands (ev): -46.7468 -46.7468 -45.5103 -45.5103 -19.8538 -19.8538 -19.2610 -19.2610 -16.6759 -16.6759 -16.6619 -16.6619 -10.7727 -10.7727 -10.7408 -10.7408 13.3569 13.3569 16.0882 16.0882 16.1674 16.1674 19.6098 19.6098 19.7782 19.7782 20.2199 20.2199 22.9013 22.9013 23.2346 23.2346 24.4638 24.4638 24.8829 24.8829 k = 0.0915 0.0915-0.0000 ( 1661 PWs) bands (ev): -46.7475 -46.7475 -45.5101 -45.5101 -19.8566 -19.8566 -19.2556 -19.2556 -16.6744 -16.6744 -16.6622 -16.6622 -10.7667 -10.7667 -10.7389 -10.7389 13.2987 13.2987 16.0556 16.0556 16.1226 16.1226 19.6350 19.6350 19.7883 19.7883 20.1820 20.1820 22.9384 22.9384 23.2341 23.2341 24.6227 24.6227 25.0374 25.0374 k = 0.0845 0.0845-0.0000 ( 1661 PWs) bands (ev): -46.7482 -46.7482 -45.5100 -45.5100 -19.8593 -19.8593 -19.2506 -19.2506 -16.6731 -16.6731 -16.6625 -16.6625 -10.7610 -10.7610 -10.7371 -10.7371 13.2442 13.2442 16.0248 16.0248 16.0810 16.0810 19.6581 19.6581 19.7965 19.7965 20.1474 20.1474 22.9749 22.9749 23.2337 23.2337 24.7810 24.7810 25.1878 25.1878 k = 0.0775 0.0775-0.0000 ( 1663 PWs) bands (ev): -46.7488 -46.7488 -45.5099 -45.5099 -19.8617 -19.8617 -19.2459 -19.2459 -16.6718 -16.6718 -16.6628 -16.6628 -10.7557 -10.7557 -10.7355 -10.7355 13.1937 13.1937 15.9962 15.9962 16.0427 16.0427 19.6789 19.6789 19.8026 19.8026 20.1166 20.1166 23.0104 23.0104 23.2332 23.2332 24.9377 24.9377 25.3327 25.3327 k = 0.0704 0.0704-0.0000 ( 1663 PWs) bands (ev): -46.7494 -46.7494 -45.5097 -45.5097 -19.8640 -19.8640 -19.2417 -19.2417 -16.6706 -16.6706 -16.6631 -16.6631 -10.7508 -10.7508 -10.7339 -10.7339 13.1472 13.1472 15.9697 15.9697 16.0077 16.0077 19.6975 19.6975 19.8066 19.8066 20.0900 20.0900 23.0445 23.0445 23.2328 23.2328 25.0916 25.0916 25.4701 25.4701 k = 0.0634 0.0634-0.0000 ( 1673 PWs) bands (ev): -46.7500 -46.7500 -45.5096 -45.5096 -19.8661 -19.8661 -19.2378 -19.2378 -16.6696 -16.6696 -16.6635 -16.6635 -10.7463 -10.7463 -10.7325 -10.7325 13.1049 13.1049 15.9455 15.9455 15.9758 15.9758 19.7139 19.7139 19.8081 19.8081 20.0678 20.0678 23.0769 23.0769 23.2325 23.2325 25.2413 25.2413 25.5977 25.5977 k = 0.0563 0.0563-0.0000 ( 1673 PWs) bands (ev): -46.7504 -46.7504 -45.5095 -45.5095 -19.8680 -19.8680 -19.2343 -19.2343 -16.6686 -16.6686 -16.6637 -16.6637 -10.7421 -10.7421 -10.7312 -10.7312 13.0668 13.0668 15.9236 15.9236 15.9474 15.9474 19.7281 19.7281 19.8073 19.8073 20.0503 20.0503 23.1071 23.1071 23.2322 23.2322 25.3853 25.3853 25.7127 25.7127 k = 0.0493 0.0493-0.0000 ( 1669 PWs) bands (ev): -46.7509 -46.7509 -45.5094 -45.5094 -19.8697 -19.8697 -19.2311 -19.2311 -16.6677 -16.6677 -16.6639 -16.6639 -10.7385 -10.7385 -10.7300 -10.7300 13.0330 13.0330 15.9042 15.9042 15.9221 15.9221 19.7404 19.7404 19.8044 19.8044 20.0372 20.0372 23.1348 23.1348 23.2321 23.2321 25.5219 25.5219 25.8120 25.8120 k = 0.0423 0.0423-0.0000 ( 1669 PWs) bands (ev): -46.7512 -46.7512 -45.5093 -45.5093 -19.8711 -19.8711 -19.2284 -19.2284 -16.6670 -16.6670 -16.6642 -16.6642 -10.7352 -10.7352 -10.7290 -10.7290 13.0036 13.0036 15.8872 15.8872 15.9003 15.9003 19.7505 19.7505 19.7999 19.7999 20.0280 20.0280 23.1595 23.1595 23.2319 23.2319 25.6488 25.6488 25.8929 25.8929 k = 0.0352 0.0352-0.0000 ( 1671 PWs) bands (ev): -46.7516 -46.7516 -45.5092 -45.5092 -19.8724 -19.8724 -19.2261 -19.2261 -16.6663 -16.6663 -16.6644 -16.6644 -10.7325 -10.7325 -10.7281 -10.7281 12.9786 12.9786 15.8728 15.8728 15.8818 15.8818 19.7588 19.7588 19.7945 19.7945 20.0219 20.0219 23.1810 23.1810 23.2318 23.2318 25.7636 25.7636 25.9544 25.9544 k = 0.0282 0.0282-0.0000 ( 1671 PWs) bands (ev): -46.7518 -46.7518 -45.5092 -45.5092 -19.8734 -19.8734 -19.2242 -19.2242 -16.6658 -16.6658 -16.6645 -16.6645 -10.7302 -10.7302 -10.7274 -10.7274 12.9581 12.9581 15.8609 15.8609 15.8666 15.8666 19.7653 19.7653 19.7889 19.7889 20.0182 20.0182 23.1990 23.1990 23.2318 23.2318 25.8636 25.8636 25.9980 25.9980 k = 0.0211 0.0211-0.0000 ( 1661 PWs) bands (ev): -46.7520 -46.7520 -45.5091 -45.5091 -19.8742 -19.8742 -19.2227 -19.2227 -16.6653 -16.6653 -16.6646 -16.6646 -10.7285 -10.7285 -10.7269 -10.7269 12.9421 12.9421 15.8516 15.8516 15.8548 15.8548 19.7703 19.7703 19.7839 19.7839 20.0162 20.0162 23.2133 23.2133 23.2318 23.2318 25.9458 25.9458 26.0271 26.0271 k = 0.0141 0.0141-0.0000 ( 1647 PWs) bands (ev): -46.7522 -46.7522 -45.5090 -45.5090 -19.8748 -19.8748 -19.2215 -19.2215 -16.6650 -16.6650 -16.6646 -16.6646 -10.7272 -10.7272 -10.7265 -10.7265 12.9306 12.9306 15.8450 15.8450 15.8464 15.8464 19.7738 19.7738 19.7800 19.7800 20.0152 20.0152 23.2236 23.2236 23.2320 23.2320 26.0072 26.0072 26.0452 26.0452 k = 0.0070 0.0070-0.0000 ( 1647 PWs) bands (ev): -46.7522 -46.7522 -45.5090 -45.5090 -19.8751 -19.8751 -19.2209 -19.2209 -16.6648 -16.6648 -16.6647 -16.6647 -10.7264 -10.7264 -10.7262 -10.7262 12.9237 12.9237 15.8410 15.8410 15.8414 15.8414 19.7759 19.7759 19.7774 19.7774 20.0147 20.0147 23.2299 23.2299 23.2319 23.2319 26.0452 26.0452 26.0550 26.0550 k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): -46.7523 -46.7523 -45.5090 -45.5090 -19.8752 -19.8752 -19.2207 -19.2207 -16.6647 -16.6647 -16.6647 -16.6647 -10.7261 -10.7261 -10.7261 -10.7261 12.9214 12.9214 15.8397 15.8397 15.8397 15.8397 19.7765 19.7765 19.7765 19.7765 20.0146 20.0146 23.2319 23.2319 23.2319 23.2319 26.0581 26.0581 26.0581 26.0581 k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): -46.7523 -46.7523 -45.5090 -45.5090 -19.8752 -19.8752 -19.2207 -19.2207 -16.6647 -16.6647 -16.6647 -16.6647 -10.7261 -10.7261 -10.7261 -10.7261 12.9214 12.9214 15.8397 15.8397 15.8397 15.8397 19.7765 19.7765 19.7765 19.7765 20.0146 20.0146 23.2319 23.2319 23.2319 23.2319 26.0581 26.0581 26.0581 26.0581 k = 0.0058 0.0058 0.0058 ( 1647 PWs) bands (ev): -46.7522 -46.7522 -45.5090 -45.5090 -19.8751 -19.8751 -19.2209 -19.2209 -16.6648 -16.6648 -16.6647 -16.6647 -10.7264 -10.7264 -10.7262 -10.7262 12.9238 12.9238 15.8412 15.8412 15.8413 15.8413 19.7757 19.7757 19.7775 19.7775 20.0148 20.0148 23.2308 23.2308 23.2310 23.2310 26.0445 26.0445 26.0553 26.0553 k = 0.0116 0.0116 0.0116 ( 1647 PWs) bands (ev): -46.7521 -46.7521 -45.5090 -45.5090 -19.8747 -19.8747 -19.2215 -19.2215 -16.6649 -16.6649 -16.6647 -16.6647 -10.7271 -10.7271 -10.7266 -10.7266 12.9308 12.9308 15.8457 15.8457 15.8460 15.8460 19.7734 19.7734 19.7803 19.7803 20.0153 20.0153 23.2273 23.2273 23.2281 23.2281 26.0039 26.0039 26.0469 26.0469 k = 0.0174 0.0174 0.0174 ( 1659 PWs) bands (ev): -46.7520 -46.7520 -45.5091 -45.5091 -19.8742 -19.8742 -19.2227 -19.2227 -16.6652 -16.6652 -16.6647 -16.6647 -10.7282 -10.7282 -10.7272 -10.7272 12.9425 12.9425 15.8531 15.8531 15.8540 15.8540 19.7695 19.7695 19.7846 19.7846 20.0164 20.0164 23.2215 23.2215 23.2233 23.2233 25.9368 25.9368 26.0331 26.0331 k = 0.0233 0.0233 0.0233 ( 1668 PWs) bands (ev): -46.7518 -46.7518 -45.5092 -45.5092 -19.8734 -19.8734 -19.2243 -19.2243 -16.6656 -16.6656 -16.6647 -16.6647 -10.7298 -10.7298 -10.7279 -10.7279 12.9589 12.9589 15.8636 15.8636 15.8650 15.8650 19.7639 19.7639 19.7897 19.7897 20.0190 20.0190 23.2135 23.2135 23.2168 23.2168 25.8443 25.8443 26.0139 26.0139 k = 0.0291 0.0291 0.0291 ( 1680 PWs) bands (ev): -46.7515 -46.7515 -45.5092 -45.5092 -19.8724 -19.8724 -19.2263 -19.2263 -16.6661 -16.6661 -16.6647 -16.6647 -10.7319 -10.7319 -10.7290 -10.7290 12.9798 12.9798 15.8770 15.8770 15.8792 15.8792 19.7567 19.7567 19.7947 19.7947 20.0237 20.0237 23.2034 23.2034 23.2086 23.2086 25.7287 25.7287 25.9897 25.9897 k = 0.0349 0.0349 0.0349 ( 1674 PWs) bands (ev): -46.7512 -46.7512 -45.5093 -45.5093 -19.8711 -19.8711 -19.2286 -19.2286 -16.6666 -16.6666 -16.6646 -16.6646 -10.7343 -10.7343 -10.7302 -10.7302 13.0054 13.0054 15.8934 15.8934 15.8966 15.8966 19.7479 19.7479 19.7984 19.7984 20.0317 20.0317 23.1916 23.1916 23.1989 23.1989 25.5932 25.5932 25.9606 25.9606 k = 0.0407 0.0407 0.0407 ( 1668 PWs) bands (ev): -46.7508 -46.7508 -45.5094 -45.5094 -19.8695 -19.8695 -19.2314 -19.2314 -16.6672 -16.6672 -16.6645 -16.6645 -10.7372 -10.7372 -10.7317 -10.7317 13.0354 13.0354 15.9127 15.9127 15.9171 15.9171 19.7375 19.7375 19.7997 19.7997 20.0441 20.0441 23.1780 23.1780 23.1879 23.1879 25.4407 25.4407 25.9270 25.9270 k = 0.0465 0.0465 0.0465 ( 1668 PWs) bands (ev): -46.7504 -46.7504 -45.5095 -45.5095 -19.8678 -19.8678 -19.2346 -19.2346 -16.6679 -16.6679 -16.6644 -16.6644 -10.7404 -10.7404 -10.7333 -10.7333 13.0699 13.0699 15.9349 15.9349 15.9406 15.9406 19.7254 19.7254 19.7975 19.7975 20.0618 20.0618 23.1630 23.1630 23.1758 23.1758 25.2747 25.2747 25.8892 25.8892 k = 0.0523 0.0523 0.0523 ( 1668 PWs) bands (ev): -46.7499 -46.7499 -45.5096 -45.5096 -19.8659 -19.8659 -19.2381 -19.2381 -16.6688 -16.6688 -16.6644 -16.6644 -10.7441 -10.7441 -10.7352 -10.7352 13.1089 13.1089 15.9599 15.9599 15.9672 15.9672 19.7116 19.7116 19.7912 19.7912 20.0852 20.0852 23.1468 23.1468 23.1627 23.1627 25.0979 25.0979 25.8475 25.8475 k = 0.0581 0.0581 0.0581 ( 1668 PWs) bands (ev): -46.7494 -46.7494 -45.5097 -45.5097 -19.8639 -19.8639 -19.2421 -19.2421 -16.6697 -16.6697 -16.6643 -16.6643 -10.7480 -10.7480 -10.7373 -10.7373 13.1521 13.1521 15.9878 15.9878 15.9967 15.9967 19.6960 19.6960 19.7807 19.7807 20.1141 20.1141 23.1296 23.1296 23.1488 23.1488 24.9130 24.9130 25.8022 25.8022 k = 0.0640 0.0640 0.0640 ( 1668 PWs) bands (ev): -46.7488 -46.7488 -45.5099 -45.5099 -19.8616 -19.8616 -19.2465 -19.2465 -16.6707 -16.6707 -16.6642 -16.6642 -10.7524 -10.7524 -10.7397 -10.7397 13.1995 13.1995 16.0185 16.0185 16.0292 16.0292 19.6787 19.6787 19.7663 19.7663 20.1482 20.1482 23.1117 23.1117 23.1344 23.1344 24.7223 24.7223 25.7539 25.7539 k = 0.0698 0.0698 0.0698 ( 1662 PWs) bands (ev): -46.7481 -46.7481 -45.5100 -45.5100 -19.8591 -19.8591 -19.2512 -19.2512 -16.6717 -16.6717 -16.6641 -16.6641 -10.7570 -10.7570 -10.7422 -10.7422 13.2511 13.2511 16.0519 16.0519 16.0646 16.0646 19.6595 19.6595 19.7482 19.7482 20.1869 20.1869 23.0933 23.0933 23.1195 23.1195 24.5279 24.5279 25.7027 25.7027 k = 0.0756 0.0756 0.0756 ( 1662 PWs) bands (ev): -46.7474 -46.7474 -45.5101 -45.5101 -19.8565 -19.8565 -19.2564 -19.2564 -16.6729 -16.6729 -16.6640 -16.6640 -10.7619 -10.7619 -10.7449 -10.7449 13.3067 13.3067 16.0880 16.0880 16.1029 16.1029 19.6386 19.6386 19.7267 19.7267 20.2294 20.2294 23.0748 23.0748 23.1043 23.1043 24.3316 24.3316 25.6491 25.6491 k = 0.0814 0.0814 0.0814 ( 1668 PWs) bands (ev): -46.7467 -46.7467 -45.5103 -45.5103 -19.8537 -19.8537 -19.2619 -19.2619 -16.6742 -16.6742 -16.6640 -16.6640 -10.7670 -10.7670 -10.7479 -10.7479 13.3663 13.3663 16.1268 16.1268 16.1439 16.1439 19.6157 19.6157 19.7021 19.7021 20.2750 20.2750 23.0564 23.0564 23.0888 23.0888 24.1356 24.1356 25.5933 25.5933 k = 0.0872 0.0872 0.0872 ( 1662 PWs) bands (ev): -46.7459 -46.7459 -45.5104 -45.5104 -19.8508 -19.8508 -19.2677 -19.2677 -16.6755 -16.6755 -16.6639 -16.6639 -10.7723 -10.7723 -10.7510 -10.7510 13.4297 13.4297 16.1682 16.1682 16.1877 16.1877 19.5911 19.5911 19.6747 19.6747 20.3228 20.3228 23.0384 23.0384 23.0727 23.0727 23.9419 23.9419 25.5357 25.5357 k = 0.0930 0.0930 0.0930 ( 1662 PWs) bands (ev): -46.7451 -46.7451 -45.5106 -45.5106 -19.8477 -19.8477 -19.2739 -19.2739 -16.6770 -16.6770 -16.6639 -16.6639 -10.7779 -10.7779 -10.7544 -10.7544 13.4967 13.4967 16.2120 16.2120 16.2341 16.2341 19.5647 19.5647 19.6447 19.6447 20.3719 20.3719 23.0211 23.0211 23.0554 23.0554 23.7531 23.7531 25.4767 25.4767 k = 0.0988 0.0988 0.0988 ( 1668 PWs) bands (ev): -46.7443 -46.7443 -45.5107 -45.5107 -19.8444 -19.8444 -19.2805 -19.2805 -16.6785 -16.6785 -16.6639 -16.6639 -10.7836 -10.7836 -10.7579 -10.7579 13.5674 13.5674 16.2584 16.2584 16.2832 16.2832 19.5364 19.5364 19.6122 19.6122 20.4208 20.4208 23.0045 23.0045 23.0352 23.0352 23.5730 23.5730 25.4164 25.4164 k = 0.1047 0.1047 0.1047 ( 1668 PWs) bands (ev): -46.7434 -46.7434 -45.5109 -45.5109 -19.8411 -19.8411 -19.2874 -19.2874 -16.6800 -16.6800 -16.6639 -16.6639 -10.7895 -10.7895 -10.7616 -10.7616 13.6415 13.6415 16.3071 16.3071 16.3347 16.3347 19.5064 19.5064 19.5774 19.5774 20.4683 20.4683 22.9892 22.9892 23.0082 23.0082 23.4079 23.4079 25.3552 25.3552 k = 0.1105 0.1105 0.1105 ( 1662 PWs) bands (ev): -46.7425 -46.7425 -45.5110 -45.5110 -19.8376 -19.8376 -19.2946 -19.2946 -16.6816 -16.6816 -16.6639 -16.6639 -10.7954 -10.7954 -10.7655 -10.7655 13.7189 13.7189 16.3582 16.3582 16.3887 16.3887 19.4746 19.4746 19.5404 19.5404 20.5123 20.5123 22.9646 22.9646 22.9751 22.9751 23.2702 23.2702 25.2933 25.2933 k = 0.1163 0.1163 0.1163 ( 1662 PWs) bands (ev): -46.7415 -46.7415 -45.5111 -45.5111 -19.8340 -19.8340 -19.3021 -19.3021 -16.6833 -16.6833 -16.6640 -16.6640 -10.8015 -10.8015 -10.7697 -10.7697 13.7995 13.7995 16.4115 16.4115 16.4450 16.4450 19.4412 19.4412 19.5014 19.5014 20.5501 20.5501 22.8907 22.8907 22.9625 22.9625 23.1767 23.1767 25.2310 25.2310 k = 0.1221 0.1221 0.1221 ( 1659 PWs) bands (ev): -46.7405 -46.7405 -45.5112 -45.5112 -19.8303 -19.8303 -19.3099 -19.3099 -16.6851 -16.6851 -16.6640 -16.6640 -10.8076 -10.8076 -10.7739 -10.7739 13.8832 13.8832 16.4669 16.4669 16.5036 16.5036 19.4062 19.4062 19.4606 19.4606 20.5787 20.5787 22.7903 22.7903 22.9516 22.9516 23.1276 23.1276 25.1684 25.1684 k = 0.1279 0.1279 0.1279 ( 1659 PWs) bands (ev): -46.7395 -46.7395 -45.5113 -45.5113 -19.8266 -19.8266 -19.3179 -19.3179 -16.6869 -16.6869 -16.6642 -16.6642 -10.8137 -10.8137 -10.7784 -10.7784 13.9698 13.9698 16.5244 16.5244 16.5643 16.5643 19.3697 19.3697 19.4180 19.4180 20.5942 20.5942 22.6861 22.6861 22.9425 22.9425 23.1040 23.1040 25.1058 25.1058 k = 0.1337 0.1337 0.1337 ( 1662 PWs) bands (ev): -46.7385 -46.7385 -45.5114 -45.5114 -19.8228 -19.8228 -19.3262 -19.3262 -16.6888 -16.6888 -16.6644 -16.6644 -10.8199 -10.8199 -10.7830 -10.7830 14.0592 14.0592 16.5838 16.5838 16.6270 16.6270 19.3317 19.3317 19.3739 19.3739 20.5925 20.5925 22.5958 22.5958 22.9352 22.9352 23.0932 23.0932 25.0433 25.0433 k = 0.1395 0.1395 0.1395 ( 1662 PWs) bands (ev): -46.7375 -46.7375 -45.5115 -45.5115 -19.8189 -19.8189 -19.3347 -19.3347 -16.6907 -16.6907 -16.6646 -16.6646 -10.8260 -10.8260 -10.7878 -10.7878 14.1512 14.1512 16.6450 16.6450 16.6917 16.6917 19.2925 19.2925 19.3284 19.3284 20.5702 20.5702 22.5287 22.5287 22.9300 22.9300 23.0895 23.0895 24.9812 24.9812 k = 0.1453 0.1453 0.1453 ( 1662 PWs) bands (ev): -46.7364 -46.7364 -45.5115 -45.5115 -19.8150 -19.8150 -19.3435 -19.3435 -16.6927 -16.6927 -16.6649 -16.6649 -10.8321 -10.8321 -10.7927 -10.7927 14.2456 14.2456 16.7081 16.7081 16.7581 16.7581 19.2521 19.2521 19.2816 19.2816 20.5250 20.5250 22.4894 22.4894 22.9268 22.9268 23.0909 23.0909 24.9077 24.9077 k = 0.1512 0.1512 0.1512 ( 1662 PWs) bands (ev): -46.7353 -46.7353 -45.5116 -45.5116 -19.8109 -19.8109 -19.3525 -19.3525 -16.6947 -16.6947 -16.6652 -16.6652 -10.8382 -10.8382 -10.7978 -10.7978 14.3424 14.3424 16.7727 16.7727 16.8263 16.8263 19.2107 19.2107 19.2338 19.2338 20.4568 20.4568 22.4793 22.4793 22.9257 22.9257 23.0964 23.0964 24.8331 24.8332 k = 0.1570 0.1570 0.1570 ( 1659 PWs) bands (ev): -46.7343 -46.7343 -45.5116 -45.5116 -19.8069 -19.8069 -19.3616 -19.3616 -16.6968 -16.6968 -16.6656 -16.6656 -10.8441 -10.8441 -10.8031 -10.8031 14.4414 14.4414 16.8388 16.8388 16.8959 16.8959 19.1684 19.1684 19.1851 19.1851 20.3678 20.3678 22.4966 22.4966 22.9267 22.9267 23.1059 23.1059 24.7597 24.7598 k = 0.1628 0.1628 0.1628 ( 1659 PWs) bands (ev): -46.7332 -46.7332 -45.5116 -45.5116 -19.8029 -19.8029 -19.3709 -19.3709 -16.6989 -16.6989 -16.6661 -16.6661 -10.8500 -10.8500 -10.8085 -10.8085 14.5425 14.5425 16.9063 16.9063 16.9670 16.9670 19.1253 19.1253 19.1357 19.1357 20.2612 20.2612 22.5381 22.5381 22.9298 22.9298 23.1193 23.1193 24.6878 24.6878 k = 0.1686 0.1686 0.1686 ( 1659 PWs) bands (ev): -46.7321 -46.7321 -45.5116 -45.5116 -19.7989 -19.7989 -19.3804 -19.3804 -16.7010 -16.7010 -16.6666 -16.6666 -10.8558 -10.8558 -10.8140 -10.8140 14.6455 14.6455 16.9750 16.9750 17.0393 17.0393 19.0817 19.0817 19.0857 19.0857 20.1412 20.1412 22.5993 22.5993 22.9349 22.9349 23.1371 23.1371 24.6173 24.6173 k = 0.1744 0.1744 0.1744 ( 1659 PWs) bands (ev): -46.7310 -46.7310 -45.5115 -45.5115 -19.7948 -19.7948 -19.3900 -19.3900 -16.7031 -16.7031 -16.6672 -16.6672 -10.8615 -10.8615 -10.8197 -10.8197 14.7502 14.7502 17.0448 17.0448 17.1127 17.1127 19.0354 19.0354 19.0377 19.0377 20.0115 20.0115 22.6756 22.6756 22.9419 22.9419 23.1602 23.1602 24.5485 24.5485 k = 0.1802 0.1802 0.1802 ( 1656 PWs) bands (ev): -46.7299 -46.7299 -45.5114 -45.5114 -19.7908 -19.7908 -19.3996 -19.3996 -16.7053 -16.7053 -16.6679 -16.6679 -10.8671 -10.8671 -10.8255 -10.8255 14.8565 14.8565 17.1156 17.1156 17.1871 17.1871 18.9849 18.9849 18.9935 18.9935 19.8756 19.8756 22.7621 22.7621 22.9509 22.9509 23.1904 23.1904 24.4816 24.4816 k = 0.1860 0.1860 0.1860 ( 1650 PWs) bands (ev): -46.7288 -46.7288 -45.5113 -45.5113 -19.7867 -19.7867 -19.4094 -19.4094 -16.7075 -16.7075 -16.6687 -16.6687 -10.8726 -10.8726 -10.8314 -10.8314 14.9643 14.9643 17.1872 17.1872 17.2623 17.2623 18.9344 18.9344 18.9491 18.9491 19.7359 19.7359 22.8527 22.8527 22.9615 22.9615 23.2308 23.2308 24.4167 24.4167 k = 0.1919 0.1919 0.1919 ( 1650 PWs) bands (ev): -46.7277 -46.7277 -45.5112 -45.5112 -19.7827 -19.7827 -19.4193 -19.4193 -16.7097 -16.7097 -16.6695 -16.6695 -10.8779 -10.8779 -10.8374 -10.8374 15.0733 15.0733 17.2594 17.2594 17.3381 17.3381 18.8840 18.8840 18.9048 18.9048 19.5946 19.5946 22.9403 22.9403 22.9738 22.9738 23.2863 23.2863 24.3542 24.3542 k = 0.1977 0.1977 0.1977 ( 1650 PWs) bands (ev): -46.7266 -46.7266 -45.5111 -45.5111 -19.7787 -19.7787 -19.4291 -19.4291 -16.7120 -16.7120 -16.6705 -16.6705 -10.8832 -10.8832 -10.8435 -10.8435 15.1836 15.1836 17.3320 17.3320 17.4143 17.4143 18.8338 18.8338 18.8608 18.8608 19.4533 19.4533 22.9875 22.9875 23.0174 23.0174 23.3625 23.3625 24.2944 24.2944 k = 0.2035 0.2035 0.2035 ( 1650 PWs) bands (ev): -46.7255 -46.7255 -45.5109 -45.5109 -19.7747 -19.7747 -19.4390 -19.4390 -16.7142 -16.7142 -16.6716 -16.6716 -10.8883 -10.8883 -10.8497 -10.8497 15.2948 15.2948 17.4050 17.4050 17.4907 17.4907 18.7842 18.7842 18.8171 18.8171 19.3133 19.3133 23.0023 23.0023 23.0801 23.0801 23.4614 23.4614 24.2380 24.2380 k = 0.2093 0.2093 0.2093 ( 1647 PWs) bands (ev): -46.7244 -46.7244 -45.5107 -45.5107 -19.7708 -19.7708 -19.4489 -19.4489 -16.7164 -16.7164 -16.6727 -16.6727 -10.8933 -10.8933 -10.8560 -10.8560 15.4069 15.4069 17.4780 17.4780 17.5673 17.5673 18.7351 18.7351 18.7740 18.7740 19.1757 19.1757 23.0180 23.0180 23.1301 23.1301 23.5790 23.5790 24.1863 24.1863 k = 0.2151 0.2151 0.2151 ( 1647 PWs) bands (ev): -46.7233 -46.7233 -45.5105 -45.5105 -19.7670 -19.7670 -19.4588 -19.4588 -16.7187 -16.7187 -16.6740 -16.6740 -10.8982 -10.8982 -10.8624 -10.8624 15.5196 15.5196 17.5510 17.5510 17.6436 17.6436 18.6866 18.6866 18.7316 18.7316 19.0412 19.0412 23.0343 23.0343 23.1714 23.1714 23.7074 23.7074 24.1424 24.1425 k = 0.2209 0.2209 0.2209 ( 1647 PWs) bands (ev): -46.7222 -46.7222 -45.5102 -45.5102 -19.7632 -19.7632 -19.4686 -19.4686 -16.7209 -16.7209 -16.6754 -16.6754 -10.9030 -10.9030 -10.8689 -10.8689 15.6329 15.6329 17.6237 17.6237 17.7196 17.7196 18.6389 18.6389 18.6901 18.6901 18.9107 18.9107 23.0507 23.0507 23.2069 23.2069 23.8329 23.8329 24.1164 24.1164 k = 0.2267 0.2267 0.2267 ( 1647 PWs) bands (ev): -46.7212 -46.7212 -45.5100 -45.5100 -19.7594 -19.7594 -19.4783 -19.4783 -16.7232 -16.7232 -16.6768 -16.6768 -10.9077 -10.9077 -10.8754 -10.8754 15.7464 15.7464 17.6959 17.6959 17.7951 17.7951 18.5918 18.5918 18.6495 18.6495 18.7850 18.7850 23.0669 23.0669 23.2383 23.2383 23.9174 23.9174 24.1442 24.1442 k = 0.2326 0.2326 0.2326 ( 1646 PWs) bands (ev): -46.7202 -46.7202 -45.5097 -45.5097 -19.7557 -19.7557 -19.4880 -19.4880 -16.7254 -16.7254 -16.6784 -16.6784 -10.9123 -10.9123 -10.8820 -10.8820 15.8601 15.8601 17.7674 17.7674 17.8698 17.8698 18.5447 18.5447 18.6101 18.6101 18.6654 18.6654 23.0823 23.0823 23.2658 23.2658 23.9299 23.9299 24.1884 24.1884 k = 0.2384 0.2384 0.2384 ( 1646 PWs) bands (ev): -46.7191 -46.7191 -45.5094 -45.5094 -19.7521 -19.7521 -19.4976 -19.4976 -16.7276 -16.7276 -16.6801 -16.6801 -10.9169 -10.9169 -10.8887 -10.8887 15.9737 15.9737 17.8379 17.8379 17.9434 17.9434 18.4931 18.4931 18.5568 18.5568 18.5720 18.5720 23.0964 23.0964 23.2890 23.2890 23.9137 23.9137 24.1645 24.1645 k = 0.2442 0.2442 0.2442 ( 1646 PWs) bands (ev): -46.7181 -46.7181 -45.5090 -45.5090 -19.7486 -19.7486 -19.5070 -19.5070 -16.7298 -16.7298 -16.6819 -16.6819 -10.9214 -10.9214 -10.8954 -10.8954 16.0869 16.0869 17.9072 17.9072 18.0158 18.0158 18.4165 18.4165 18.4806 18.4806 18.5354 18.5354 23.1086 23.1086 23.3069 23.3069 23.8954 23.8954 24.1462 24.1462 k = 0.2500 0.2500 0.2500 ( 1658 PWs) bands (ev): -46.7171 -46.7171 -45.5087 -45.5087 -19.7452 -19.7452 -19.5163 -19.5163 -16.7321 -16.7321 -16.6839 -16.6839 -10.9259 -10.9259 -10.9021 -10.9021 16.1995 16.1995 17.9748 17.9748 18.0865 18.0865 18.3189 18.3189 18.4332 18.4332 18.5006 18.5006 23.1183 23.1183 23.3183 23.3183 23.8829 23.8829 24.1338 24.1338 k = 0.2558 0.2558 0.2558 ( 1649 PWs) bands (ev): -46.7162 -46.7162 -45.5083 -45.5083 -19.7418 -19.7418 -19.5254 -19.5254 -16.7342 -16.7342 -16.6859 -16.6859 -10.9303 -10.9303 -10.9089 -10.9089 16.3111 16.3111 18.0402 18.0402 18.1552 18.1552 18.2223 18.2223 18.3938 18.3938 18.4678 18.4678 23.1251 23.1251 23.3220 23.3220 23.8795 23.8795 24.1280 24.1280 k = 0.2616 0.2616 0.2616 ( 1649 PWs) bands (ev): -46.7152 -46.7152 -45.5079 -45.5079 -19.7385 -19.7385 -19.5343 -19.5343 -16.7363 -16.7363 -16.6880 -16.6880 -10.9347 -10.9347 -10.9157 -10.9157 16.4213 16.4213 18.1018 18.1018 18.1314 18.1314 18.2207 18.2207 18.3593 18.3593 18.4381 18.4381 23.1285 23.1285 23.3175 23.3175 23.8865 23.8865 24.1291 24.1291 k = 0.2674 0.2674 0.2674 ( 1649 PWs) bands (ev): -46.7143 -46.7143 -45.5075 -45.5075 -19.7353 -19.7353 -19.5430 -19.5430 -16.7384 -16.7384 -16.6903 -16.6903 -10.9391 -10.9391 -10.9225 -10.9225 16.5295 16.5295 18.0466 18.0466 18.1575 18.1575 18.2801 18.2801 18.3321 18.3321 18.4143 18.4143 23.1282 23.1282 23.3053 23.3053 23.9039 23.9039 24.1372 24.1372 k = 0.2733 0.2733 0.2733 ( 1649 PWs) bands (ev): -46.7133 -46.7133 -45.5070 -45.5070 -19.7322 -19.7322 -19.5515 -19.5515 -16.7405 -16.7405 -16.6926 -16.6926 -10.9436 -10.9436 -10.9293 -10.9293 16.6351 16.6351 17.9700 17.9700 18.1963 18.1963 18.3202 18.3202 18.3215 18.3215 18.4095 18.4095 23.1243 23.1243 23.2865 23.2865 23.9309 23.9309 24.1524 24.1524 k = 0.2791 0.2791 0.2791 ( 1649 PWs) bands (ev): -46.7124 -46.7124 -45.5066 -45.5066 -19.7292 -19.7292 -19.5598 -19.5598 -16.7426 -16.7426 -16.6950 -16.6950 -10.9480 -10.9480 -10.9361 -10.9361 16.7371 16.7371 17.9019 17.9019 18.2036 18.2036 18.3211 18.3211 18.3426 18.3426 18.4433 18.4433 23.1166 23.1166 23.2626 23.2626 23.9660 23.9660 24.1745 24.1745 k = 0.2849 0.2849 0.2849 ( 1649 PWs) bands (ev): -46.7116 -46.7116 -45.5061 -45.5061 -19.7263 -19.7263 -19.5678 -19.5678 -16.7446 -16.7446 -16.6976 -16.6976 -10.9525 -10.9525 -10.9429 -10.9429 16.8342 16.8342 17.8437 17.8437 18.1885 18.1885 18.3037 18.3037 18.3861 18.3861 18.4951 18.4951 23.1056 23.1056 23.2348 23.2348 24.0080 24.0080 24.2033 24.2033 k = 0.2907 0.2907 0.2907 ( 1643 PWs) bands (ev): -46.7107 -46.7107 -45.5057 -45.5057 -19.7235 -19.7235 -19.5755 -19.5755 -16.7465 -16.7465 -16.7002 -16.7002 -10.9570 -10.9570 -10.9496 -10.9496 16.9244 16.9244 17.7969 17.7969 18.1671 18.1671 18.2832 18.2832 18.4361 18.4361 18.5493 18.5493 23.0916 23.0916 23.2046 23.2046 24.0556 24.0556 24.2382 24.2382 k = 0.2965 0.2965 0.2965 ( 1643 PWs) bands (ev): -46.7099 -46.7099 -45.5052 -45.5052 -19.7208 -19.7208 -19.5830 -19.5830 -16.7484 -16.7484 -16.7029 -16.7029 -10.9615 -10.9615 -10.9564 -10.9564 17.0053 17.0053 17.7638 17.7638 18.1451 18.1451 18.2631 18.2631 18.4868 18.4868 18.6024 18.6024 23.0748 23.0748 23.1727 23.1727 24.1078 24.1078 24.2788 24.2788 k = 0.3023 0.3023 0.3023 ( 1643 PWs) bands (ev): -46.7090 -46.7090 -45.5047 -45.5047 -19.7182 -19.7182 -19.5902 -19.5902 -16.7503 -16.7503 -16.7057 -16.7057 -10.9661 -10.9661 -10.9631 -10.9631 17.0737 17.0737 17.7471 17.7471 18.1245 18.1245 18.2442 18.2442 18.5363 18.5363 18.6534 18.6534 23.0558 23.0558 23.1398 23.1398 24.1640 24.1640 24.3245 24.3245 k = 0.3081 0.3081 0.3081 ( 1643 PWs) bands (ev): -46.7082 -46.7082 -45.5042 -45.5042 -19.7157 -19.7157 -19.5971 -19.5971 -16.7522 -16.7522 -16.7085 -16.7085 -10.9708 -10.9708 -10.9697 -10.9697 17.1269 17.1269 17.7488 17.7488 18.1067 18.1067 18.2270 18.2270 18.5838 18.5838 18.7018 18.7018 23.0350 23.0350 23.1064 23.1064 24.2235 24.2235 24.3747 24.3747 k = 0.3140 0.3140 0.3140 ( 1649 PWs) bands (ev): -46.7075 -46.7075 -45.5037 -45.5037 -19.7134 -19.7134 -19.6037 -19.6037 -16.7540 -16.7540 -16.7114 -16.7114 -10.9763 -10.9763 -10.9756 -10.9756 17.1636 17.1636 17.7691 17.7691 18.0927 18.0927 18.2117 18.2117 18.6291 18.6291 18.7474 18.7474 23.0127 23.0127 23.0730 23.0730 24.2859 24.2859 24.4289 24.4289 k = 0.3198 0.3198 0.3198 ( 1640 PWs) bands (ev): -46.7067 -46.7067 -45.5032 -45.5032 -19.7110 -19.7110 -19.6100 -19.6100 -16.7557 -16.7557 -16.7144 -16.7144 -10.9828 -10.9828 -10.9804 -10.9804 17.1856 17.1856 17.8041 17.8041 18.0846 18.0846 18.1983 18.1983 18.6718 18.6718 18.7901 18.7901 22.9894 22.9894 23.0399 23.0399 24.3508 24.3508 24.4867 24.4867 k = 0.3256 0.3256 0.3256 ( 1640 PWs) bands (ev): -46.7060 -46.7060 -45.5027 -45.5027 -19.7088 -19.7088 -19.6160 -19.6160 -16.7574 -16.7574 -16.7174 -16.7174 -10.9892 -10.9892 -10.9852 -10.9852 17.1970 17.1970 17.8460 17.8460 18.0860 18.0860 18.1868 18.1868 18.7119 18.7119 18.8297 18.8297 22.9653 22.9653 23.0071 23.0071 24.4178 24.4178 24.5475 24.5475 k = 0.3314 0.3314 0.3314 ( 1646 PWs) bands (ev): -46.7053 -46.7053 -45.5022 -45.5022 -19.7068 -19.7068 -19.6217 -19.6217 -16.7591 -16.7591 -16.7205 -16.7205 -10.9955 -10.9955 -10.9902 -10.9902 17.2022 17.2022 17.8843 17.8843 18.1024 18.1024 18.1773 18.1773 18.7492 18.7492 18.8661 18.8661 22.9406 22.9406 22.9748 22.9748 24.4867 24.4867 24.6108 24.6108 k = 0.3372 0.3372 0.3372 ( 1646 PWs) bands (ev): -46.7046 -46.7046 -45.5018 -45.5018 -19.7048 -19.7048 -19.6271 -19.6271 -16.7607 -16.7607 -16.7236 -16.7236 -11.0017 -11.0017 -10.9952 -10.9952 17.2050 17.2050 17.9102 17.9102 18.1387 18.1387 18.1699 18.1699 18.7838 18.7838 18.8994 18.8994 22.9156 22.9156 22.9432 22.9432 24.5572 24.5572 24.6763 24.6763 k = 0.3430 0.3430 0.3430 ( 1640 PWs) bands (ev): -46.7039 -46.7039 -45.5013 -45.5013 -19.7030 -19.7030 -19.6321 -19.6321 -16.7622 -16.7622 -16.7267 -16.7267 -11.0078 -11.0078 -11.0003 -11.0003 17.2078 17.2078 17.9231 17.9231 18.1644 18.1644 18.1927 18.1927 18.8156 18.8156 18.9294 18.9294 22.8905 22.8905 22.9125 22.9125 24.6289 24.6289 24.7435 24.7435 k = 0.3488 0.3488 0.3488 ( 1646 PWs) bands (ev): -46.7032 -46.7032 -45.5008 -45.5008 -19.7013 -19.7013 -19.6368 -19.6368 -16.7637 -16.7637 -16.7298 -16.7298 -11.0138 -11.0138 -11.0054 -11.0054 17.2124 17.2124 17.9281 17.9281 18.1610 18.1610 18.2572 18.2572 18.8448 18.8448 18.9562 18.9562 22.8654 22.8654 22.8825 22.8825 24.7017 24.7017 24.8121 24.8121 k = 0.3547 0.3547 0.3547 ( 1646 PWs) bands (ev): -46.7026 -46.7026 -45.5003 -45.5003 -19.6997 -19.6997 -19.6412 -19.6412 -16.7651 -16.7651 -16.7329 -16.7329 -11.0197 -11.0197 -11.0106 -11.0106 17.2197 17.2197 17.9294 17.9294 18.1595 18.1595 18.3262 18.3262 18.8713 18.8713 18.9797 18.9797 22.8405 22.8405 22.8534 22.8534 24.7753 24.7753 24.8816 24.8816 k = 0.3605 0.3605 0.3605 ( 1646 PWs) bands (ev): -46.7020 -46.7020 -45.4998 -45.4998 -19.6982 -19.6982 -19.6452 -19.6452 -16.7665 -16.7665 -16.7361 -16.7361 -11.0254 -11.0254 -11.0158 -11.0158 17.2304 17.2304 17.9297 17.9297 18.1600 18.1600 18.3963 18.3963 18.8953 18.8953 19.0001 19.0001 22.8159 22.8159 22.8253 22.8253 24.8494 24.8494 24.9517 24.9517 k = 0.3663 0.3663 0.3663 ( 1652 PWs) bands (ev): -46.7014 -46.7014 -45.4994 -45.4994 -19.6969 -19.6969 -19.6490 -19.6490 -16.7678 -16.7678 -16.7392 -16.7392 -11.0310 -11.0310 -11.0210 -11.0210 17.2449 17.2449 17.9301 17.9301 18.1623 18.1623 18.4650 18.4650 18.9168 18.9168 19.0173 19.0173 22.7917 22.7917 22.7982 22.7982 24.9237 24.9237 25.0221 25.0221 k = 0.3721 0.3721 0.3721 ( 1658 PWs) bands (ev): -46.7009 -46.7009 -45.4989 -45.4989 -19.6957 -19.6957 -19.6525 -19.6525 -16.7691 -16.7691 -16.7423 -16.7423 -11.0364 -11.0364 -11.0262 -11.0262 17.2632 17.2632 17.9314 17.9314 18.1666 18.1666 18.5311 18.5311 18.9361 18.9361 19.0314 19.0314 22.7680 22.7680 22.7720 22.7720 24.9979 24.9979 25.0924 25.0924 k = 0.3779 0.3779 0.3779 ( 1652 PWs) bands (ev): -46.7003 -46.7003 -45.4985 -45.4985 -19.6945 -19.6945 -19.6556 -19.6556 -16.7704 -16.7704 -16.7453 -16.7453 -11.0417 -11.0417 -11.0314 -11.0314 17.2855 17.2855 17.9341 17.9341 18.1726 18.1726 18.5933 18.5933 18.9535 18.9535 19.0425 19.0425 22.7450 22.7450 22.7470 22.7470 25.0718 25.0718 25.1622 25.1622 k = 0.3837 0.3837 0.3837 ( 1652 PWs) bands (ev): -46.6998 -46.6998 -45.4981 -45.4981 -19.6935 -19.6935 -19.6584 -19.6584 -16.7715 -16.7715 -16.7483 -16.7483 -11.0467 -11.0467 -11.0366 -11.0366 17.3115 17.3115 17.9382 17.9382 18.1805 18.1805 18.6508 18.6508 18.9691 18.9691 19.0507 19.0507 22.7226 22.7226 22.7230 22.7230 25.1452 25.1452 25.2312 25.2312 k = 0.3895 0.3895 0.3895 ( 1652 PWs) bands (ev): -46.6993 -46.6993 -45.4977 -45.4977 -19.6927 -19.6927 -19.6609 -19.6609 -16.7726 -16.7726 -16.7512 -16.7512 -11.0516 -11.0516 -11.0417 -11.0417 17.3411 17.3411 17.9441 17.9441 18.1899 18.1899 18.7028 18.7028 18.9833 18.9833 19.0560 19.0560 22.7001 22.7001 22.7009 22.7009 25.2176 25.2176 25.2991 25.2991 k = 0.3953 0.3953 0.3953 ( 1652 PWs) bands (ev): -46.6989 -46.6989 -45.4973 -45.4973 -19.6919 -19.6919 -19.6631 -19.6631 -16.7736 -16.7736 -16.7540 -16.7540 -11.0563 -11.0563 -11.0467 -11.0467 17.3740 17.3740 17.9519 17.9519 18.2010 18.2010 18.7487 18.7487 18.9965 18.9965 19.0585 19.0585 22.6783 22.6783 22.6801 22.6801 25.2888 25.2888 25.3656 25.3656 k = 0.4012 0.4012 0.4012 ( 1652 PWs) bands (ev): -46.6984 -46.6984 -45.4969 -45.4969 -19.6913 -19.6913 -19.6651 -19.6651 -16.7746 -16.7746 -16.7568 -16.7568 -11.0608 -11.0608 -11.0516 -11.0516 17.4098 17.4098 17.9616 17.9616 18.2137 18.2137 18.7878 18.7878 19.0088 19.0088 19.0585 19.0585 22.6576 22.6576 22.6601 22.6601 25.3584 25.3584 25.4304 25.4304 k = 0.4070 0.4070 0.4070 ( 1646 PWs) bands (ev): -46.6980 -46.6980 -45.4966 -45.4966 -19.6908 -19.6908 -19.6667 -19.6667 -16.7755 -16.7755 -16.7595 -16.7595 -11.0651 -11.0651 -11.0565 -11.0565 17.4481 17.4481 17.9737 17.9737 18.2277 18.2277 18.8199 18.8199 19.0205 19.0205 19.0560 19.0560 22.6381 22.6381 22.6410 22.6410 25.4263 25.4263 25.4931 25.4931 k = 0.4128 0.4128 0.4128 ( 1646 PWs) bands (ev): -46.6976 -46.6976 -45.4962 -45.4962 -19.6904 -19.6904 -19.6682 -19.6682 -16.7764 -16.7764 -16.7621 -16.7621 -11.0691 -11.0691 -11.0611 -11.0611 17.4883 17.4883 17.9882 17.9882 18.2431 18.2431 18.8450 18.8450 19.0314 19.0314 19.0512 19.0512 22.6197 22.6197 22.6229 22.6229 25.4921 25.4921 25.5535 25.5535 k = 0.4186 0.4186 0.4186 ( 1643 PWs) bands (ev): -46.6972 -46.6972 -45.4959 -45.4959 -19.6900 -19.6900 -19.6694 -19.6694 -16.7772 -16.7772 -16.7645 -16.7645 -11.0730 -11.0730 -11.0656 -11.0656 17.5296 17.5296 18.0054 18.0054 18.2596 18.2596 18.8635 18.8635 19.0410 19.0410 19.0443 19.0443 22.6025 22.6025 22.6058 22.6058 25.5554 25.5554 25.6114 25.6114 k = 0.4244 0.4244 0.4244 ( 1643 PWs) bands (ev): -46.6969 -46.6969 -45.4956 -45.4956 -19.6898 -19.6898 -19.6705 -19.6705 -16.7779 -16.7779 -16.7669 -16.7669 -11.0766 -11.0766 -11.0700 -11.0700 17.5713 17.5713 18.0257 18.0257 18.2772 18.2772 18.8764 18.8764 19.0354 19.0354 19.0485 19.0485 22.5865 22.5865 22.5897 22.5897 25.6160 25.6160 25.6664 25.6664 k = 0.4302 0.4302 0.4302 ( 1643 PWs) bands (ev): -46.6965 -46.6965 -45.4953 -45.4953 -19.6896 -19.6896 -19.6713 -19.6713 -16.7786 -16.7786 -16.7691 -16.7691 -11.0799 -11.0799 -11.0741 -11.0741 17.6125 17.6125 18.0495 18.0495 18.2956 18.2956 18.8846 18.8846 19.0247 19.0247 19.0530 19.0530 22.5716 22.5716 22.5746 22.5746 25.6736 25.6736 25.7182 25.7182 k = 0.4360 0.4360 0.4360 ( 1643 PWs) bands (ev): -46.6962 -46.6962 -45.4951 -45.4951 -19.6895 -19.6895 -19.6721 -19.6721 -16.7793 -16.7793 -16.7711 -16.7711 -11.0831 -11.0831 -11.0779 -11.0779 17.6522 17.6522 18.0772 18.0772 18.3147 18.3147 18.8892 18.8892 19.0126 19.0126 19.0536 19.0536 22.5579 22.5579 22.5607 22.5607 25.7278 25.7278 25.7668 25.7668 k = 0.4419 0.4419 0.4419 ( 1643 PWs) bands (ev): -46.6960 -46.6960 -45.4948 -45.4948 -19.6894 -19.6894 -19.6726 -19.6726 -16.7799 -16.7799 -16.7731 -16.7731 -11.0859 -11.0859 -11.0815 -11.0815 17.6894 17.6894 18.1090 18.1090 18.3343 18.3343 18.8910 18.8910 18.9992 18.9992 19.0499 19.0499 22.5454 22.5454 22.5479 22.5479 25.7785 25.7785 25.8119 25.8119 k = 0.4477 0.4477 0.4477 ( 1643 PWs) bands (ev): -46.6957 -46.6957 -45.4946 -45.4946 -19.6894 -19.6894 -19.6731 -19.6731 -16.7804 -16.7804 -16.7748 -16.7748 -11.0885 -11.0885 -11.0849 -11.0849 17.7234 17.7234 18.1451 18.1451 18.3542 18.3542 18.8908 18.8908 18.9848 18.9848 19.0415 19.0415 22.5342 22.5342 22.5363 22.5363 25.8253 25.8253 25.8532 25.8532 k = 0.4535 0.4535 0.4535 ( 1637 PWs) bands (ev): -46.6955 -46.6955 -45.4944 -45.4944 -19.6893 -19.6893 -19.6735 -19.6735 -16.7808 -16.7808 -16.7764 -16.7764 -11.0909 -11.0909 -11.0879 -11.0879 17.7537 17.7537 18.1852 18.1852 18.3740 18.3740 18.8891 18.8891 18.9697 18.9697 19.0284 19.0284 22.5241 22.5241 22.5258 22.5258 25.8679 25.8679 25.8907 25.8907 k = 0.4593 0.4593 0.4593 ( 1637 PWs) bands (ev): -46.6953 -46.6953 -45.4943 -45.4943 -19.6893 -19.6893 -19.6738 -19.6738 -16.7813 -16.7813 -16.7778 -16.7778 -11.0930 -11.0930 -11.0906 -11.0906 17.7799 17.7799 18.2286 18.2286 18.3934 18.3934 18.8864 18.8864 18.9544 18.9544 19.0109 19.0109 22.5151 22.5151 22.5166 22.5166 25.9062 25.9062 25.9241 25.9241 k = 0.4651 0.4651 0.4651 ( 1640 PWs) bands (ev): -46.6951 -46.6951 -45.4941 -45.4941 -19.6893 -19.6893 -19.6741 -19.6741 -16.7816 -16.7816 -16.7791 -16.7791 -11.0948 -11.0948 -11.0930 -11.0930 17.8021 17.8021 18.2743 18.2743 18.4120 18.4120 18.8831 18.8831 18.9393 18.9393 18.9893 18.9893 22.5074 22.5074 22.5085 22.5085 25.9399 25.9399 25.9533 25.9533 k = 0.4709 0.4709 0.4709 ( 1640 PWs) bands (ev): -46.6950 -46.6950 -45.4940 -45.4940 -19.6892 -19.6892 -19.6743 -19.6743 -16.7819 -16.7819 -16.7801 -16.7801 -11.0963 -11.0963 -11.0951 -11.0951 17.8204 17.8204 18.3209 18.3209 18.4293 18.4293 18.8795 18.8795 18.9249 18.9249 18.9649 18.9649 22.5009 22.5009 22.5016 22.5016 25.9687 25.9687 25.9783 25.9783 k = 0.4767 0.4767 0.4767 ( 1640 PWs) bands (ev): -46.6949 -46.6949 -45.4939 -45.4939 -19.6892 -19.6892 -19.6745 -19.6745 -16.7822 -16.7822 -16.7810 -16.7810 -11.0976 -11.0976 -11.0968 -11.0968 17.8350 17.8350 18.3664 18.3664 18.4447 18.4447 18.8754 18.8754 18.9118 18.9118 18.9390 18.9390 22.4955 22.4955 22.4960 22.4960 25.9926 25.9926 25.9988 25.9988 k = 0.4826 0.4826 0.4826 ( 1640 PWs) bands (ev): -46.6948 -46.6948 -45.4938 -45.4938 -19.6892 -19.6892 -19.6746 -19.6746 -16.7824 -16.7824 -16.7817 -16.7817 -11.0986 -11.0986 -11.0981 -11.0981 17.8461 17.8461 18.4083 18.4083 18.4577 18.4577 18.8703 18.8703 18.9006 18.9006 18.9146 18.9146 22.4913 22.4913 22.4916 22.4916 26.0113 26.0113 26.0149 26.0149 k = 0.4884 0.4884 0.4884 ( 1640 PWs) bands (ev): -46.6947 -46.6947 -45.4937 -45.4937 -19.6892 -19.6892 -19.6747 -19.6747 -16.7825 -16.7825 -16.7822 -16.7822 -11.0993 -11.0993 -11.0991 -11.0991 17.8539 17.8539 18.4434 18.4434 18.4676 18.4676 18.8626 18.8626 18.8919 18.8919 18.8961 18.8961 22.4884 22.4884 22.4885 22.4885 26.0248 26.0248 26.0264 26.0264 k = 0.4942 0.4942 0.4942 ( 1640 PWs) bands (ev): -46.6947 -46.6947 -45.4937 -45.4937 -19.6892 -19.6892 -19.6748 -19.6748 -16.7826 -16.7826 -16.7825 -16.7825 -11.0997 -11.0997 -11.0997 -11.0997 17.8585 17.8585 18.4673 18.4673 18.4738 18.4738 18.8533 18.8533 18.8865 18.8865 18.8870 18.8870 22.4866 22.4866 22.4866 22.4866 26.0329 26.0329 26.0333 26.0333 k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): -46.6946 -46.6946 -45.4937 -45.4937 -19.6892 -19.6892 -19.6748 -19.6748 -16.7826 -16.7826 -16.7826 -16.7826 -11.0999 -11.0999 -11.0999 -11.0999 17.8601 17.8601 18.4760 18.4760 18.4760 18.4760 18.8489 18.8489 18.8846 18.8846 18.8846 18.8846 22.4860 22.4860 22.4860 22.4860 26.0356 26.0356 26.0356 26.0356 k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): -46.6946 -46.6946 -45.4937 -45.4937 -19.6892 -19.6892 -19.6748 -19.6748 -16.7826 -16.7826 -16.7826 -16.7826 -11.0999 -11.0999 -11.0999 -11.0999 17.8601 17.8601 18.4760 18.4760 18.4760 18.4760 18.8489 18.8489 18.8846 18.8846 18.8846 18.8846 22.4860 22.4860 22.4860 22.4860 26.0356 26.0356 26.0356 26.0356 k = 0.4930 0.5000 0.4930 ( 1640 PWs) bands (ev): -46.6947 -46.6947 -45.4937 -45.4937 -19.6892 -19.6892 -19.6748 -19.6748 -16.7826 -16.7826 -16.7825 -16.7825 -11.0998 -11.0998 -11.0996 -11.0996 17.8586 17.8586 18.4679 18.4679 18.4735 18.4735 18.8530 18.8530 18.8855 18.8855 18.8881 18.8881 22.4862 22.4862 22.4869 22.4869 26.0320 26.0320 26.0343 26.0343 k = 0.4859 0.5000 0.4859 ( 1640 PWs) bands (ev): -46.6947 -46.6947 -45.4937 -45.4937 -19.6892 -19.6892 -19.6747 -19.6747 -16.7825 -16.7825 -16.7822 -16.7822 -11.0994 -11.0994 -11.0990 -11.0990 17.8540 17.8540 18.4454 18.4454 18.4664 18.4664 18.8593 18.8593 18.8897 18.8897 18.9011 18.9011 22.4870 22.4870 22.4898 22.4898 26.0212 26.0212 26.0304 26.0304 k = 0.4789 0.5000 0.4789 ( 1640 PWs) bands (ev): -46.6948 -46.6948 -45.4938 -45.4938 -19.6892 -19.6892 -19.6746 -19.6746 -16.7823 -16.7823 -16.7817 -16.7817 -11.0989 -11.0989 -11.0979 -11.0979 17.8465 17.8465 18.4122 18.4122 18.4552 18.4552 18.8594 18.8594 18.8985 18.8985 18.9266 18.9266 22.4882 22.4882 22.4945 22.4945 26.0034 26.0034 26.0239 26.0239 k = 0.4718 0.5000 0.4718 ( 1640 PWs) bands (ev): -46.6948 -46.6948 -45.4939 -45.4939 -19.6892 -19.6892 -19.6745 -19.6745 -16.7821 -16.7821 -16.7811 -16.7811 -11.0982 -11.0982 -11.0963 -11.0963 17.8358 17.8358 18.3719 18.3719 18.4408 18.4408 18.8543 18.8543 18.9103 18.9103 18.9607 18.9607 22.4899 22.4899 22.5009 22.5009 25.9786 25.9786 26.0149 26.0149 k = 0.4648 0.5000 0.4648 ( 1640 PWs) bands (ev): -46.6950 -46.6950 -45.4940 -45.4940 -19.6892 -19.6892 -19.6744 -19.6744 -16.7819 -16.7819 -16.7802 -16.7802 -11.0973 -11.0973 -11.0943 -11.0943 17.8220 17.8220 18.3272 18.3272 18.4240 18.4240 18.8460 18.8460 18.9241 18.9241 18.9993 18.9993 22.4921 22.4921 22.5091 22.5091 25.9471 25.9471 26.0035 26.0035 k = 0.4577 0.5000 0.4577 ( 1640 PWs) bands (ev): -46.6951 -46.6951 -45.4941 -45.4941 -19.6893 -19.6893 -19.6741 -19.6741 -16.7816 -16.7816 -16.7792 -16.7792 -11.0962 -11.0962 -11.0919 -11.0919 17.8051 17.8051 18.2797 18.2797 18.4057 18.4057 18.8354 18.8354 18.9390 18.9390 19.0401 19.0401 22.4949 22.4949 22.5188 22.5188 25.9092 25.9092 25.9898 25.9898 k = 0.4507 0.5000 0.4507 ( 1636 PWs) bands (ev): -46.6953 -46.6953 -45.4942 -45.4942 -19.6893 -19.6893 -19.6739 -19.6739 -16.7812 -16.7812 -16.7780 -16.7780 -11.0949 -11.0949 -11.0891 -11.0891 17.7850 17.7850 18.2307 18.2307 18.3865 18.3865 18.8227 18.8227 18.9545 18.9545 19.0816 19.0816 22.4981 22.4981 22.5300 22.5300 25.8650 25.8650 25.9739 25.9739 k = 0.4437 0.5000 0.4437 ( 1638 PWs) bands (ev): -46.6955 -46.6955 -45.4944 -45.4944 -19.6893 -19.6893 -19.6736 -19.6736 -16.7808 -16.7808 -16.7766 -16.7766 -11.0934 -11.0934 -11.0858 -11.0858 17.7617 17.7617 18.1809 18.1809 18.3671 18.3671 18.8083 18.8083 18.9699 18.9699 19.1230 19.1230 22.5019 22.5019 22.5425 22.5425 25.8149 25.8149 25.9560 25.9560 k = 0.4366 0.5000 0.4366 ( 1642 PWs) bands (ev): -46.6957 -46.6957 -45.4946 -45.4946 -19.6893 -19.6893 -19.6733 -19.6733 -16.7803 -16.7803 -16.7751 -16.7751 -11.0918 -11.0918 -11.0822 -11.0822 17.7353 17.7353 18.1309 18.1309 18.3480 18.3480 18.7922 18.7922 18.9850 18.9850 19.1638 19.1638 22.5062 22.5062 22.5561 22.5561 25.7593 25.7593 25.9364 25.9364 k = 0.4296 0.5000 0.4296 ( 1638 PWs) bands (ev): -46.6959 -46.6959 -45.4948 -45.4948 -19.6893 -19.6893 -19.6729 -19.6729 -16.7798 -16.7798 -16.7734 -16.7734 -11.0900 -11.0900 -11.0782 -11.0782 17.7060 17.7060 18.0812 18.0812 18.3294 18.3294 18.7746 18.7746 18.9993 18.9993 19.2036 19.2036 22.5110 22.5110 22.5707 22.5707 25.6984 25.6984 25.9151 25.9151 k = 0.4225 0.5000 0.4225 ( 1644 PWs) bands (ev): -46.6962 -46.6962 -45.4950 -45.4950 -19.6893 -19.6893 -19.6726 -19.6726 -16.7792 -16.7792 -16.7715 -16.7715 -11.0880 -11.0880 -11.0738 -11.0738 17.6739 17.6739 18.0320 18.0320 18.3115 18.3115 18.7557 18.7557 19.0128 19.0128 19.2421 19.2421 22.5164 22.5164 22.5860 22.5860 25.6326 25.6326 25.8924 25.8924 k = 0.4155 0.5000 0.4155 ( 1640 PWs) bands (ev): -46.6965 -46.6965 -45.4953 -45.4953 -19.6892 -19.6892 -19.6721 -19.6721 -16.7785 -16.7785 -16.7695 -16.7695 -11.0859 -11.0859 -11.0690 -11.0690 17.6394 17.6394 17.9836 17.9836 18.2947 18.2947 18.7356 18.7356 19.0251 19.0251 19.2789 19.2789 22.5224 22.5224 22.6018 22.6018 25.5623 25.5623 25.8685 25.8685 k = 0.4085 0.5000 0.4085 ( 1644 PWs) bands (ev): -46.6968 -46.6968 -45.4956 -45.4956 -19.6891 -19.6891 -19.6716 -19.6716 -16.7779 -16.7779 -16.7674 -16.7674 -11.0837 -11.0837 -11.0639 -11.0639 17.6025 17.6025 17.9362 17.9362 18.2788 18.2788 18.7144 18.7144 19.0363 19.0363 19.3141 19.3141 22.5289 22.5289 22.6180 22.6180 25.4877 25.4877 25.8438 25.8438 k = 0.4014 0.5000 0.4014 ( 1644 PWs) bands (ev): -46.6971 -46.6971 -45.4958 -45.4958 -19.6890 -19.6890 -19.6711 -19.6711 -16.7771 -16.7771 -16.7651 -16.7651 -11.0813 -11.0813 -11.0585 -11.0585 17.5638 17.5638 17.8899 17.8899 18.2640 18.2640 18.6924 18.6924 19.0462 19.0462 19.3474 19.3474 22.5361 22.5361 22.6343 22.6343 25.4091 25.4091 25.8183 25.8183 k = 0.3944 0.5000 0.3944 ( 1644 PWs) bands (ev): -46.6975 -46.6975 -45.4961 -45.4961 -19.6888 -19.6888 -19.6705 -19.6705 -16.7763 -16.7763 -16.7627 -16.7627 -11.0789 -11.0789 -11.0527 -11.0527 17.5235 17.5235 17.8449 17.8449 18.2502 18.2502 18.6695 18.6695 19.0548 19.0548 19.3787 19.3787 22.5437 22.5437 22.6506 22.6506 25.3269 25.3269 25.7923 25.7923 k = 0.3873 0.5000 0.3873 ( 1646 PWs) bands (ev): -46.6979 -46.6979 -45.4965 -45.4965 -19.6886 -19.6886 -19.6699 -19.6699 -16.7755 -16.7755 -16.7602 -16.7602 -11.0763 -11.0763 -11.0467 -11.0467 17.4820 17.4820 17.8012 17.8012 18.2375 18.2375 18.6461 18.6461 19.0621 19.0621 19.4079 19.4079 22.5520 22.5520 22.6666 22.6666 25.2413 25.2413 25.7662 25.7662 k = 0.3803 0.5000 0.3803 ( 1642 PWs) bands (ev): -46.6983 -46.6983 -45.4968 -45.4968 -19.6883 -19.6883 -19.6692 -19.6692 -16.7746 -16.7746 -16.7575 -16.7575 -11.0737 -11.0737 -11.0404 -11.0404 17.4397 17.4397 17.7589 17.7589 18.2258 18.2258 18.6221 18.6221 19.0680 19.0680 19.4350 19.4350 22.5608 22.5608 22.6820 22.6820 25.1526 25.1526 25.7400 25.7400 k = 0.3732 0.5000 0.3732 ( 1642 PWs) bands (ev): -46.6987 -46.6987 -45.4972 -45.4972 -19.6880 -19.6880 -19.6684 -19.6684 -16.7736 -16.7736 -16.7548 -16.7548 -11.0710 -11.0710 -11.0338 -11.0338 17.3968 17.3968 17.7180 17.7180 18.2150 18.2150 18.5978 18.5978 19.0728 19.0728 19.4600 19.4600 22.5702 22.5702 22.6968 22.6968 25.0610 25.0610 25.7141 25.7141 k = 0.3662 0.5000 0.3662 ( 1642 PWs) bands (ev): -46.6991 -46.6991 -45.4975 -45.4975 -19.6876 -19.6876 -19.6676 -19.6676 -16.7726 -16.7726 -16.7519 -16.7519 -11.0683 -11.0683 -11.0271 -11.0271 17.3538 17.3538 17.6786 17.6786 18.2051 18.2051 18.5733 18.5733 19.0763 19.0763 19.4828 19.4828 22.5801 22.5801 22.7106 22.7106 24.9668 24.9668 25.6886 25.6886 k = 0.3592 0.5000 0.3592 ( 1650 PWs) bands (ev): -46.6996 -46.6996 -45.4979 -45.4979 -19.6872 -19.6872 -19.6669 -19.6669 -16.7717 -16.7717 -16.7491 -16.7491 -11.0655 -11.0655 -11.0201 -11.0201 17.3108 17.3108 17.6407 17.6407 18.1962 18.1962 18.5486 18.5486 19.0786 19.0786 19.5034 19.5034 22.5905 22.5905 22.7233 22.7233 24.8702 24.8702 25.6636 25.6636 k = 0.3521 0.5000 0.3521 ( 1646 PWs) bands (ev): -46.7000 -46.7000 -45.4983 -45.4983 -19.6866 -19.6866 -19.6660 -19.6660 -16.7706 -16.7706 -16.7460 -16.7460 -11.0628 -11.0628 -11.0129 -11.0129 17.2683 17.2683 17.6044 17.6044 18.1882 18.1882 18.5240 18.5240 19.0800 19.0800 19.5218 19.5218 22.6016 22.6016 22.7348 22.7348 24.7714 24.7714 25.6394 25.6394 k = 0.3451 0.5000 0.3451 ( 1642 PWs) bands (ev): -46.7005 -46.7005 -45.4988 -45.4988 -19.6860 -19.6860 -19.6650 -19.6650 -16.7695 -16.7695 -16.7430 -16.7430 -11.0600 -11.0600 -11.0055 -11.0055 17.2262 17.2262 17.5697 17.5697 18.1811 18.1811 18.4995 18.4995 19.0804 19.0804 19.5381 19.5381 22.6131 22.6131 22.7448 22.7448 24.6706 24.6706 25.6161 25.6161 k = 0.3380 0.5000 0.3380 ( 1646 PWs) bands (ev): -46.7010 -46.7010 -45.4992 -45.4992 -19.6853 -19.6853 -19.6640 -19.6640 -16.7684 -16.7684 -16.7399 -16.7399 -11.0572 -11.0572 -10.9980 -10.9980 17.1850 17.1850 17.5365 17.5365 18.1749 18.1749 18.4752 18.4752 19.0800 19.0800 19.5523 19.5523 22.6250 22.6250 22.7532 22.7532 24.5681 24.5681 25.5937 25.5937 k = 0.3310 0.5000 0.3310 ( 1646 PWs) bands (ev): -46.7015 -46.7015 -45.4996 -45.4996 -19.6845 -19.6845 -19.6630 -19.6630 -16.7672 -16.7672 -16.7367 -16.7367 -11.0545 -11.0545 -10.9903 -10.9903 17.1447 17.1447 17.5051 17.5051 18.1696 18.1696 18.4512 18.4512 19.0788 19.0788 19.5646 19.5646 22.6374 22.6374 22.7598 22.7598 24.4638 24.4638 25.5724 25.5724 k = 0.3239 0.5000 0.3239 ( 1646 PWs) bands (ev): -46.7021 -46.7021 -45.5001 -45.5001 -19.6836 -19.6836 -19.6619 -19.6619 -16.7660 -16.7660 -16.7335 -16.7335 -11.0518 -11.0518 -10.9826 -10.9826 17.1055 17.1055 17.4753 17.4753 18.1652 18.1652 18.4276 18.4276 19.0772 19.0772 19.5748 19.5748 22.6502 22.6502 22.7645 22.7645 24.3581 24.3581 25.5521 25.5521 k = 0.3169 0.5000 0.3169 ( 1642 PWs) bands (ev): -46.7026 -46.7026 -45.5005 -45.5005 -19.6825 -19.6825 -19.6607 -19.6607 -16.7648 -16.7648 -16.7302 -16.7302 -11.0491 -11.0491 -10.9747 -10.9747 17.0676 17.0676 17.4473 17.4473 18.1618 18.1618 18.4045 18.4045 19.0751 19.0751 19.5833 19.5833 22.6634 22.6634 22.7673 22.7673 24.2511 24.2511 25.5331 25.5331 k = 0.3099 0.5000 0.3099 ( 1650 PWs) bands (ev): -46.7032 -46.7032 -45.5010 -45.5010 -19.6815 -19.6815 -19.6596 -19.6596 -16.7637 -16.7637 -16.7270 -16.7270 -11.0465 -11.0465 -10.9668 -10.9668 17.0309 17.0309 17.4210 17.4210 18.1594 18.1594 18.3820 18.3820 19.0728 19.0728 19.5901 19.5901 22.6768 22.6768 22.7679 22.7679 24.1429 24.1429 25.5151 25.5151 k = 0.3028 0.5000 0.3028 ( 1662 PWs) bands (ev): -46.7037 -46.7037 -45.5015 -45.5015 -19.6803 -19.6803 -19.6584 -19.6584 -16.7625 -16.7625 -16.7237 -16.7237 -11.0441 -11.0441 -10.9589 -10.9589 16.9957 16.9957 17.3964 17.3964 18.1580 18.1580 18.3601 18.3601 19.0704 19.0704 19.5952 19.5952 22.6904 22.6904 22.7662 22.7662 24.0338 24.0338 25.4981 25.4981 k = 0.2958 0.5000 0.2958 ( 1662 PWs) bands (ev): -46.7043 -46.7043 -45.5020 -45.5020 -19.6790 -19.6790 -19.6571 -19.6571 -16.7613 -16.7613 -16.7204 -16.7204 -11.0416 -11.0416 -10.9509 -10.9509 16.9619 16.9619 17.3736 17.3736 18.1576 18.1576 18.3390 18.3390 19.0681 19.0681 19.5989 19.5989 22.7043 22.7043 22.7623 22.7623 23.9238 23.9238 25.4823 25.4823 k = 0.2887 0.5000 0.2887 ( 1662 PWs) bands (ev): -46.7049 -46.7049 -45.5025 -45.5025 -19.6775 -19.6775 -19.6557 -19.6557 -16.7601 -16.7601 -16.7171 -16.7171 -11.0393 -11.0393 -10.9429 -10.9429 16.9297 16.9297 17.3526 17.3526 18.1584 18.1584 18.3186 18.3186 19.0662 19.0662 19.6013 19.6013 22.7182 22.7182 22.7562 22.7562 23.8131 23.8131 25.4673 25.4673 k = 0.2817 0.5000 0.2817 ( 1662 PWs) bands (ev): -46.7055 -46.7055 -45.5030 -45.5030 -19.6760 -19.6760 -19.6543 -19.6543 -16.7589 -16.7589 -16.7137 -16.7137 -11.0371 -11.0371 -10.9349 -10.9349 16.8991 16.8991 17.3332 17.3332 18.1602 18.1602 18.2991 18.2991 19.0647 19.0647 19.6026 19.6026 22.7320 22.7320 22.7478 22.7478 23.7020 23.7020 25.4532 25.4532 k = 0.2746 0.5000 0.2746 ( 1670 PWs) bands (ev): -46.7060 -46.7060 -45.5035 -45.5035 -19.6744 -19.6744 -19.6529 -19.6529 -16.7577 -16.7577 -16.7104 -16.7104 -11.0351 -11.0351 -10.9269 -10.9269 16.8701 16.8701 17.3155 17.3155 18.1633 18.1633 18.2805 18.2805 19.0638 19.0638 19.6028 19.6028 22.7357 22.7357 22.7468 22.7468 23.5906 23.5906 25.4398 25.4398 k = 0.2676 0.5000 0.2676 ( 1670 PWs) bands (ev): -46.7066 -46.7066 -45.5040 -45.5040 -19.6726 -19.6726 -19.6514 -19.6514 -16.7566 -16.7566 -16.7070 -16.7070 -11.0331 -11.0331 -10.9190 -10.9190 16.8428 16.8428 17.2994 17.2994 18.1675 18.1675 18.2627 18.2627 19.0639 19.0639 19.6023 19.6023 22.7227 22.7227 22.7600 22.7600 23.4792 23.4792 25.4269 25.4269 k = 0.2606 0.5000 0.2606 ( 1666 PWs) bands (ev): -46.7072 -46.7072 -45.5045 -45.5045 -19.6708 -19.6708 -19.6498 -19.6498 -16.7555 -16.7555 -16.7037 -16.7037 -11.0313 -11.0313 -10.9112 -10.9112 16.8171 16.8171 17.2849 17.2849 18.1730 18.1730 18.2460 18.2460 19.0651 19.0651 19.6011 19.6011 22.7068 22.7068 22.7729 22.7729 23.3682 23.3682 25.4143 25.4143 k = 0.2535 0.5000 0.2535 ( 1666 PWs) bands (ev): -46.7078 -46.7078 -45.5051 -45.5051 -19.6688 -19.6688 -19.6482 -19.6482 -16.7544 -16.7544 -16.7003 -16.7003 -11.0296 -11.0296 -10.9034 -10.9034 16.7930 16.7930 17.2719 17.2719 18.1798 18.1798 18.2304 18.2304 19.0676 19.0676 19.5995 19.5995 22.6884 22.6884 22.7847 22.7847 23.2582 23.2582 25.4018 25.4018 k = 0.2465 0.5000 0.2465 ( 1666 PWs) bands (ev): -46.7084 -46.7084 -45.5056 -45.5056 -19.6667 -19.6667 -19.6466 -19.6466 -16.7533 -16.7533 -16.6970 -16.6970 -11.0281 -11.0281 -10.8957 -10.8957 16.7705 16.7705 17.2603 17.2603 18.1876 18.1876 18.2160 18.2160 19.0717 19.0717 19.5976 19.5976 22.6674 22.6674 22.7942 22.7942 23.1506 23.1506 25.3891 25.3891 k = 0.2394 0.5000 0.2394 ( 1666 PWs) bands (ev): -46.7090 -46.7090 -45.5061 -45.5061 -19.6646 -19.6646 -19.6450 -19.6450 -16.7523 -16.7523 -16.6937 -16.6937 -11.0267 -11.0267 -10.8881 -10.8881 16.7496 16.7496 17.2501 17.2501 18.1945 18.1945 18.2049 18.2049 19.0775 19.0775 19.5956 19.5956 22.6438 22.6438 22.7983 22.7983 23.0487 23.0487 25.3759 25.3759 k = 0.2324 0.5000 0.2324 ( 1658 PWs) bands (ev): -46.7096 -46.7096 -45.5066 -45.5066 -19.6623 -19.6623 -19.6432 -19.6432 -16.7514 -16.7514 -16.6903 -16.6903 -11.0255 -11.0255 -10.8807 -10.8807 16.7303 16.7303 17.2411 17.2411 18.1875 18.1875 18.2101 18.2101 19.0854 19.0854 19.5937 19.5937 22.6170 22.6170 22.7874 22.7874 22.9628 22.9628 25.3619 25.3619 k = 0.2254 0.5000 0.2254 ( 1658 PWs) bands (ev): -46.7102 -46.7102 -45.5071 -45.5071 -19.6600 -19.6600 -19.6415 -19.6415 -16.7505 -16.7505 -16.6870 -16.6870 -11.0244 -11.0244 -10.8733 -10.8733 16.7125 16.7125 17.2333 17.2333 18.1765 18.1765 18.2220 18.2220 19.0955 19.0955 19.5921 19.5921 22.5860 22.5860 22.7411 22.7411 22.9143 22.9143 25.3467 25.3467 k = 0.2183 0.5000 0.2183 ( 1646 PWs) bands (ev): -46.7108 -46.7108 -45.5076 -45.5076 -19.6575 -19.6575 -19.6397 -19.6397 -16.7496 -16.7496 -16.6838 -16.6838 -11.0235 -11.0235 -10.8662 -10.8662 16.6961 16.6961 17.2265 17.2265 18.1661 18.1661 18.2356 18.2356 19.1080 19.1080 19.5909 19.5909 22.5470 22.5470 22.6642 22.6642 22.9024 22.9024 25.3298 25.3298 k = 0.2113 0.5000 0.2113 ( 1646 PWs) bands (ev): -46.7114 -46.7114 -45.5081 -45.5081 -19.6550 -19.6550 -19.6380 -19.6380 -16.7488 -16.7488 -16.6805 -16.6805 -11.0227 -11.0227 -10.8591 -10.8591 16.6812 16.6812 17.2206 17.2206 18.1566 18.1566 18.2509 18.2509 19.1233 19.1233 19.5903 19.5903 22.4892 22.4892 22.5897 22.5897 22.9051 22.9051 25.3107 25.3107 k = 0.2042 0.5000 0.2042 ( 1650 PWs) bands (ev): -46.7120 -46.7120 -45.5086 -45.5086 -19.6525 -19.6525 -19.6362 -19.6362 -16.7481 -16.7481 -16.6774 -16.6774 -11.0221 -11.0221 -10.8523 -10.8523 16.6676 16.6676 17.2155 17.2155 18.1481 18.1481 18.2677 18.2677 19.1414 19.1414 19.5905 19.5905 22.4040 22.4040 22.5360 22.5360 22.9124 22.9124 25.2888 25.2888 k = 0.1972 0.5000 0.1972 ( 1646 PWs) bands (ev): -46.7126 -46.7126 -45.5091 -45.5091 -19.6499 -19.6499 -19.6344 -19.6344 -16.7475 -16.7475 -16.6742 -16.6742 -11.0216 -11.0216 -10.8456 -10.8456 16.6552 16.6552 17.2112 17.2112 18.1407 18.1407 18.2860 18.2860 19.1627 19.1627 19.5916 19.5916 22.3039 22.3039 22.4942 22.4942 22.9213 22.9213 25.2635 25.2635 k = 0.1901 0.5000 0.1901 ( 1646 PWs) bands (ev): -46.7131 -46.7131 -45.5096 -45.5096 -19.6472 -19.6472 -19.6326 -19.6326 -16.7469 -16.7469 -16.6711 -16.6711 -11.0213 -11.0213 -10.8391 -10.8391 16.6441 16.6441 17.2074 17.2074 18.1343 18.1343 18.3058 18.3058 19.1873 19.1873 19.5937 19.5937 22.1986 22.1986 22.4559 22.4559 22.9305 22.9305 25.2338 25.2338 k = 0.1831 0.5000 0.1831 ( 1650 PWs) bands (ev): -46.7137 -46.7137 -45.5101 -45.5101 -19.6445 -19.6445 -19.6308 -19.6308 -16.7464 -16.7464 -16.6680 -16.6680 -11.0211 -11.0211 -10.8328 -10.8328 16.6341 16.6341 17.2041 17.2041 18.1288 18.1288 18.3271 18.3271 19.2154 19.2154 19.5971 19.5971 22.0916 22.0916 22.4182 22.4182 22.9394 22.9394 25.1987 25.1987 k = 0.1761 0.5000 0.1761 ( 1650 PWs) bands (ev): -46.7143 -46.7143 -45.5106 -45.5106 -19.6418 -19.6418 -19.6291 -19.6291 -16.7460 -16.7460 -16.6650 -16.6650 -11.0211 -11.0211 -10.8267 -10.8267 16.6251 16.6251 17.2011 17.2011 18.1244 18.1244 18.3500 18.3500 19.2471 19.2471 19.6017 19.6017 21.9842 21.9842 22.3804 22.3804 22.9477 22.9477 25.1570 25.1570 k = 0.1690 0.5000 0.1690 ( 1664 PWs) bands (ev): -46.7148 -46.7148 -45.5111 -45.5111 -19.6391 -19.6391 -19.6274 -19.6274 -16.7457 -16.7457 -16.6621 -16.6621 -11.0211 -11.0211 -10.8209 -10.8209 16.6171 16.6171 17.1985 17.1985 18.1208 18.1208 18.3744 18.3744 19.2826 19.2826 19.6078 19.6078 21.8770 21.8770 22.3422 22.3422 22.9549 22.9549 25.1067 25.1067 k = 0.1620 0.5000 0.1620 ( 1660 PWs) bands (ev): -46.7153 -46.7153 -45.5115 -45.5115 -19.6363 -19.6363 -19.6256 -19.6256 -16.7454 -16.7454 -16.6592 -16.6592 -11.0213 -11.0213 -10.8152 -10.8152 16.6101 16.6101 17.1961 17.1961 18.1181 18.1181 18.4003 18.4003 19.3219 19.3219 19.6154 19.6154 21.7705 21.7705 22.3037 22.3037 22.9610 22.9610 25.0458 25.0458 k = 0.1549 0.5000 0.1549 ( 1648 PWs) bands (ev): -46.7158 -46.7158 -45.5119 -45.5119 -19.6335 -19.6335 -19.6237 -19.6237 -16.7451 -16.7451 -16.6563 -16.6563 -11.0216 -11.0216 -10.8098 -10.8098 16.6038 16.6038 17.1938 17.1938 18.1164 18.1164 18.4278 18.4278 19.3650 19.3650 19.6248 19.6248 21.6648 21.6648 22.2650 22.2650 22.9656 22.9656 24.9716 24.9716 k = 0.1479 0.5000 0.1479 ( 1640 PWs) bands (ev): -46.7163 -46.7163 -45.5124 -45.5124 -19.6308 -19.6308 -19.6220 -19.6220 -16.7449 -16.7449 -16.6536 -16.6536 -11.0220 -11.0220 -10.8045 -10.8045 16.5983 16.5983 17.1916 17.1916 18.1154 18.1154 18.4569 18.4569 19.4118 19.4118 19.6361 19.6361 21.5601 21.5601 22.2261 22.2261 22.9683 22.9683 24.8820 24.8820 k = 0.1408 0.5000 0.1408 ( 1640 PWs) bands (ev): -46.7168 -46.7168 -45.5128 -45.5128 -19.6281 -19.6281 -19.6203 -19.6203 -16.7448 -16.7448 -16.6509 -16.6509 -11.0224 -11.0224 -10.7995 -10.7995 16.5935 16.5935 17.1895 17.1895 18.1151 18.1151 18.4875 18.4875 19.4619 19.4619 19.6497 19.6497 21.4566 21.4566 22.1872 22.1872 22.9687 22.9687 24.7769 24.7769 k = 0.1338 0.5000 0.1338 ( 1644 PWs) bands (ev): -46.7173 -46.7173 -45.5132 -45.5132 -19.6254 -19.6254 -19.6186 -19.6186 -16.7448 -16.7448 -16.6483 -16.6483 -11.0230 -11.0230 -10.7948 -10.7948 16.5893 16.5893 17.1873 17.1873 18.1155 18.1155 18.5197 18.5197 19.5146 19.5146 19.6663 19.6663 21.3544 21.3544 22.1486 22.1486 22.9663 22.9663 24.6595 24.6595 k = 0.1268 0.5000 0.1268 ( 1642 PWs) bands (ev): -46.7177 -46.7177 -45.5136 -45.5136 -19.6229 -19.6229 -19.6169 -19.6169 -16.7448 -16.7448 -16.6458 -16.6458 -11.0236 -11.0236 -10.7902 -10.7902 16.5856 16.5856 17.1852 17.1852 18.1165 18.1165 18.5534 18.5534 19.5680 19.5680 19.6879 19.6879 21.2537 21.2537 22.1103 22.1103 22.9605 22.9605 24.5344 24.5344 k = 0.1197 0.5000 0.1197 ( 1642 PWs) bands (ev): -46.7181 -46.7181 -45.5139 -45.5139 -19.6204 -19.6204 -19.6153 -19.6153 -16.7449 -16.7449 -16.6433 -16.6433 -11.0243 -11.0243 -10.7860 -10.7860 16.5824 16.5824 17.1830 17.1830 18.1181 18.1181 18.5887 18.5887 19.6175 19.6175 19.7187 19.7187 21.1547 21.1547 22.0725 22.0725 22.9504 22.9504 24.4064 24.4064 k = 0.1127 0.5000 0.1127 ( 1638 PWs) bands (ev): -46.7185 -46.7185 -45.5143 -45.5143 -19.6180 -19.6180 -19.6136 -19.6136 -16.7449 -16.7449 -16.6410 -16.6410 -11.0250 -11.0250 -10.7819 -10.7819 16.5797 16.5797 17.1807 17.1807 18.1202 18.1202 18.6255 18.6255 19.6573 19.6573 19.7645 19.7645 21.0574 21.0574 22.0355 22.0355 22.9349 22.9349 24.2793 24.2793 k = 0.1056 0.5000 0.1056 ( 1638 PWs) bands (ev): -46.7189 -46.7189 -45.5146 -45.5146 -19.6157 -19.6157 -19.6120 -19.6120 -16.7451 -16.7451 -16.6388 -16.6388 -11.0257 -11.0257 -10.7781 -10.7781 16.5773 16.5773 17.1785 17.1785 18.1227 18.1227 18.6638 18.6638 19.6868 19.6868 19.8255 19.8255 20.9621 20.9621 21.9994 21.9994 22.9128 22.9128 24.1563 24.1563 k = 0.0986 0.5000 0.0986 ( 1638 PWs) bands (ev): -46.7193 -46.7193 -45.5149 -45.5149 -19.6137 -19.6137 -19.6104 -19.6104 -16.7452 -16.7452 -16.6367 -16.6367 -11.0265 -11.0265 -10.7745 -10.7745 16.5752 16.5752 17.1762 17.1762 18.1255 18.1255 18.7035 18.7035 19.7108 19.7108 19.8966 19.8966 20.8691 20.8691 21.9643 21.9643 22.8825 22.8825 24.0403 24.0403 k = 0.0915 0.5000 0.0915 ( 1638 PWs) bands (ev): -46.7196 -46.7196 -45.5152 -45.5152 -19.6118 -19.6118 -19.6087 -19.6087 -16.7454 -16.7454 -16.6347 -16.6347 -11.0272 -11.0272 -10.7712 -10.7712 16.5734 16.5734 17.1739 17.1739 18.1286 18.1286 18.7447 18.7447 19.7321 19.7321 19.9742 19.9742 20.7786 20.7786 21.9305 21.9305 22.8422 22.8422 23.9338 23.9338 k = 0.0845 0.5000 0.0845 ( 1644 PWs) bands (ev): -46.7200 -46.7200 -45.5155 -45.5155 -19.6103 -19.6103 -19.6069 -19.6069 -16.7456 -16.7456 -16.6329 -16.6329 -11.0280 -11.0280 -10.7682 -10.7682 16.5719 16.5719 17.1716 17.1716 18.1319 18.1319 18.7872 18.7872 19.7521 19.7521 20.0566 20.0566 20.6912 20.6912 21.8980 21.8980 22.7905 22.7905 23.8392 23.8392 k = 0.0775 0.5000 0.0775 ( 1644 PWs) bands (ev): -46.7203 -46.7203 -45.5157 -45.5157 -19.6089 -19.6089 -19.6052 -19.6052 -16.7458 -16.7458 -16.6311 -16.6311 -11.0287 -11.0287 -10.7653 -10.7653 16.5705 16.5705 17.1694 17.1694 18.1352 18.1352 18.8309 18.8309 19.7710 19.7710 20.1423 20.1423 20.6078 20.6078 21.8670 21.8670 22.7265 22.7265 23.7578 23.7578 k = 0.0704 0.5000 0.0704 ( 1650 PWs) bands (ev): -46.7205 -46.7205 -45.5160 -45.5160 -19.6077 -19.6077 -19.6035 -19.6035 -16.7460 -16.7460 -16.6296 -16.6296 -11.0294 -11.0294 -10.7628 -10.7628 16.5694 16.5694 17.1672 17.1672 18.1386 18.1386 18.8756 18.8756 19.7887 19.7887 20.2286 20.2286 20.5308 20.5308 21.8375 21.8375 22.6502 22.6502 23.6903 23.6903 k = 0.0634 0.5000 0.0634 ( 1650 PWs) bands (ev): -46.7208 -46.7208 -45.5162 -45.5162 -19.6066 -19.6066 -19.6020 -19.6020 -16.7463 -16.7463 -16.6281 -16.6281 -11.0301 -11.0301 -10.7604 -10.7604 16.5684 16.5684 17.1652 17.1652 18.1420 18.1420 18.9211 18.9211 19.8048 19.8048 20.3054 20.3054 20.4707 20.4707 21.8096 21.8096 22.5628 22.5628 23.6360 23.6360 k = 0.0563 0.5000 0.0563 ( 1650 PWs) bands (ev): -46.7210 -46.7210 -45.5164 -45.5164 -19.6056 -19.6056 -19.6005 -19.6005 -16.7465 -16.7465 -16.6268 -16.6268 -11.0307 -11.0307 -10.7583 -10.7583 16.5675 16.5675 17.1632 17.1632 18.1452 18.1452 18.9670 18.9670 19.8187 19.8187 20.3223 20.3223 20.4779 20.4779 21.7831 21.7831 22.4665 22.4665 23.5935 23.5935 k = 0.0493 0.5000 0.0493 ( 1650 PWs) bands (ev): -46.7212 -46.7212 -45.5166 -45.5166 -19.6048 -19.6048 -19.5991 -19.5991 -16.7466 -16.7466 -16.6256 -16.6256 -11.0313 -11.0313 -10.7565 -10.7565 16.5668 16.5668 17.1614 17.1614 18.1482 18.1482 19.0129 19.0129 19.8296 19.8296 20.2750 20.2750 20.5574 20.5574 21.7577 21.7577 22.3641 22.3641 23.5609 23.5609 k = 0.0423 0.5000 0.0423 ( 1654 PWs) bands (ev): -46.7214 -46.7214 -45.5167 -45.5167 -19.6041 -19.6041 -19.5980 -19.5980 -16.7468 -16.7468 -16.6246 -16.6246 -11.0318 -11.0318 -10.7549 -10.7549 16.5662 16.5662 17.1599 17.1599 18.1509 18.1509 19.0581 19.0581 19.8365 19.8365 20.2193 20.2193 20.6542 20.6542 21.7329 21.7329 22.2589 22.2589 23.5363 23.5363 k = 0.0352 0.5000 0.0352 ( 1654 PWs) bands (ev): -46.7215 -46.7215 -45.5169 -45.5169 -19.6035 -19.6035 -19.5970 -19.5970 -16.7470 -16.7470 -16.6237 -16.6237 -11.0323 -11.0323 -10.7535 -10.7535 16.5657 16.5657 17.1585 17.1585 18.1534 18.1534 19.1018 19.1018 19.8385 19.8385 20.1687 20.1687 20.7555 20.7555 21.7075 21.7075 22.1548 22.1548 23.5180 23.5180 k = 0.0282 0.5000 0.0282 ( 1650 PWs) bands (ev): -46.7216 -46.7216 -45.5170 -45.5170 -19.6029 -19.6029 -19.5961 -19.5961 -16.7471 -16.7471 -16.6230 -16.6230 -11.0327 -11.0327 -10.7524 -10.7524 16.5653 16.5653 17.1573 17.1573 18.1555 18.1555 19.1424 19.1424 19.8347 19.8347 20.1274 20.1274 20.8575 20.8575 21.6793 21.6793 22.0570 22.0570 23.5047 23.5047 k = 0.0211 0.5000 0.0211 ( 1654 PWs) bands (ev): -46.7217 -46.7217 -45.5170 -45.5170 -19.6026 -19.6026 -19.5955 -19.5955 -16.7472 -16.7472 -16.6224 -16.6224 -11.0330 -11.0330 -10.7516 -10.7516 16.5650 16.5650 17.1564 17.1564 18.1571 18.1571 19.1783 19.1783 19.8257 19.8257 20.0969 20.0969 20.9569 20.9569 21.6449 21.6449 21.9726 21.9726 23.4953 23.4953 k = 0.0141 0.5000 0.0141 ( 1654 PWs) bands (ev): -46.7218 -46.7218 -45.5171 -45.5171 -19.6023 -19.6023 -19.5950 -19.5950 -16.7473 -16.7473 -16.6220 -16.6220 -11.0332 -11.0332 -10.7510 -10.7510 16.5648 16.5648 17.1557 17.1557 18.1583 18.1583 19.2070 19.2070 19.8142 19.8142 20.0772 20.0772 21.0480 21.0480 21.6026 21.6026 21.9094 21.9094 23.4892 23.4892 k = 0.0070 0.5000 0.0070 ( 1654 PWs) bands (ev): -46.7219 -46.7219 -45.5171 -45.5171 -19.6021 -19.6021 -19.5947 -19.5947 -16.7473 -16.7473 -16.6218 -16.6218 -11.0333 -11.0333 -10.7506 -10.7506 16.5647 16.5647 17.1553 17.1553 18.1590 18.1590 19.2258 19.2258 19.8046 19.8046 20.0665 20.0665 21.1189 21.1189 21.5601 21.5601 21.8723 21.8723 23.4857 23.4857 k = 0.0000 0.5000-0.0000 ( 1654 PWs) bands (ev): -46.7219 -46.7219 -45.5171 -45.5171 -19.6021 -19.6021 -19.5946 -19.5946 -16.7474 -16.7474 -16.6217 -16.6217 -11.0334 -11.0334 -10.7505 -10.7505 16.5646 16.5646 17.1551 17.1551 18.1593 18.1593 19.2324 19.2324 19.8009 19.8009 20.0632 20.0632 21.1477 21.1477 21.5403 21.5403 21.8604 21.8604 23.4845 23.4845 k = 0.5000 0.5000-0.0000 ( 1652 PWs) bands (ev): -46.7080 -46.7080 -45.5052 -45.5052 -19.6951 -19.6951 -19.6588 -19.6588 -16.7456 -16.7456 -16.6852 -16.6852 -11.0469 -11.0469 -10.8115 -10.8115 15.5008 15.5008 15.8579 15.8579 17.8853 17.8853 17.9031 17.9031 22.0062 22.0062 22.3774 22.3774 22.5813 22.5813 22.6874 22.6874 23.7505 23.7505 25.8032 25.8032 k = 0.5000 0.5000 0.0100 ( 1652 PWs) bands (ev): -46.7080 -46.7080 -45.5052 -45.5052 -19.6951 -19.6951 -19.6588 -19.6588 -16.7456 -16.7456 -16.6853 -16.6853 -11.0469 -11.0469 -10.8117 -10.8117 15.5032 15.5032 15.8601 15.8601 17.8851 17.8851 17.9030 17.9030 22.0018 22.0018 22.3776 22.3776 22.5816 22.5816 22.6817 22.6817 23.7519 23.7519 25.8038 25.8038 k = 0.5000 0.5000 0.0200 ( 1648 PWs) bands (ev): -46.7080 -46.7080 -45.5051 -45.5051 -19.6951 -19.6951 -19.6588 -19.6588 -16.7457 -16.7457 -16.6856 -16.6856 -11.0471 -11.0471 -10.8126 -10.8126 15.5102 15.5102 15.8666 15.8666 17.8844 17.8844 17.9027 17.9027 21.9885 21.9885 22.3779 22.3779 22.5825 22.5825 22.6647 22.6647 23.7559 23.7559 25.8055 25.8055 k = 0.5000 0.5000 0.0300 ( 1648 PWs) bands (ev): -46.7079 -46.7079 -45.5051 -45.5051 -19.6950 -19.6950 -19.6589 -19.6589 -16.7459 -16.7459 -16.6861 -16.6861 -11.0473 -11.0473 -10.8141 -10.8141 15.5218 15.5218 15.8774 15.8774 17.8832 17.8832 17.9022 17.9022 21.9667 21.9667 22.3785 22.3785 22.5838 22.5838 22.6369 22.6369 23.7625 23.7625 25.8081 25.8081 k = 0.5000 0.5000 0.0400 ( 1640 PWs) bands (ev): -46.7078 -46.7078 -45.5050 -45.5050 -19.6949 -19.6949 -19.6589 -19.6589 -16.7462 -16.7462 -16.6867 -16.6867 -11.0477 -11.0477 -10.8161 -10.8161 15.5380 15.5380 15.8926 15.8926 17.8815 17.8815 17.9015 17.9015 21.9367 21.9367 22.3793 22.3793 22.5846 22.5846 22.5999 22.5999 23.7718 23.7718 25.8117 25.8117 k = 0.5000 0.5000 0.0500 ( 1640 PWs) bands (ev): -46.7077 -46.7077 -45.5049 -45.5049 -19.6949 -19.6949 -19.6590 -19.6590 -16.7465 -16.7465 -16.6876 -16.6876 -11.0481 -11.0481 -10.8187 -10.8187 15.5588 15.5588 15.9121 15.9121 17.8795 17.8795 17.9006 17.9006 21.8988 21.8988 22.3803 22.3803 22.5494 22.5494 22.5897 22.5897 23.7837 23.7837 25.8159 25.8159 k = 0.5000 0.5000 0.0600 ( 1640 PWs) bands (ev): -46.7075 -46.7075 -45.5048 -45.5048 -19.6948 -19.6948 -19.6592 -19.6592 -16.7469 -16.7469 -16.6887 -16.6887 -11.0487 -11.0487 -10.8218 -10.8218 15.5841 15.5841 15.9358 15.9358 17.8770 17.8770 17.8996 17.8996 21.8537 21.8537 22.3815 22.3815 22.4929 22.4929 22.5925 22.5925 23.7982 23.7982 25.8206 25.8206 k = 0.5000 0.5000 0.0700 ( 1648 PWs) bands (ev): -46.7074 -46.7074 -45.5046 -45.5046 -19.6947 -19.6947 -19.6594 -19.6594 -16.7475 -16.7475 -16.6900 -16.6900 -11.0494 -11.0494 -10.8256 -10.8256 15.6139 15.6139 15.9638 15.9638 17.8741 17.8741 17.8985 17.8985 21.8019 21.8019 22.3829 22.3829 22.4281 22.4281 22.5961 22.5961 23.8152 23.8152 25.8257 25.8257 k = 0.5000 0.5000 0.0800 ( 1648 PWs) bands (ev): -46.7072 -46.7072 -45.5045 -45.5045 -19.6946 -19.6946 -19.6596 -19.6596 -16.7480 -16.7480 -16.6915 -16.6915 -11.0501 -11.0501 -10.8298 -10.8298 15.6480 15.6480 15.9959 15.9959 17.8710 17.8710 17.8974 17.8974 21.7441 21.7441 22.3561 22.3561 22.3845 22.3845 22.6002 22.6002 23.8348 23.8348 25.8311 25.8311 k = 0.5000 0.5000 0.0900 ( 1648 PWs) bands (ev): -46.7070 -46.7070 -45.5043 -45.5043 -19.6945 -19.6945 -19.6598 -19.6598 -16.7487 -16.7487 -16.6931 -16.6931 -11.0509 -11.0509 -10.8345 -10.8345 15.6864 15.6864 16.0322 16.0322 17.8676 17.8676 17.8962 17.8962 21.6807 21.6807 22.2779 22.2779 22.3862 22.3862 22.6049 22.6049 23.8569 23.8569 25.8367 25.8367 k = 0.5000 0.5000 0.1000 ( 1648 PWs) bands (ev): -46.7067 -46.7067 -45.5041 -45.5041 -19.6943 -19.6943 -19.6601 -19.6601 -16.7494 -16.7494 -16.6949 -16.6949 -11.0519 -11.0519 -10.8397 -10.8397 15.7290 15.7290 16.0725 16.0725 17.8640 17.8640 17.8951 17.8951 21.6126 21.6126 22.1944 22.1944 22.3881 22.3881 22.6099 22.6099 23.8815 23.8815 25.8425 25.8425 k = 0.5000 0.5000 0.1100 ( 1648 PWs) bands (ev): -46.7065 -46.7065 -45.5039 -45.5039 -19.6942 -19.6942 -19.6603 -19.6603 -16.7501 -16.7501 -16.6969 -16.6969 -11.0529 -11.0529 -10.8454 -10.8454 15.7756 15.7756 16.1168 16.1168 17.8602 17.8602 17.8940 17.8940 21.5402 21.5402 22.1062 22.1062 22.3902 22.3902 22.6153 22.6153 23.9086 23.9086 25.8484 25.8484 k = 0.5000 0.5000 0.1200 ( 1648 PWs) bands (ev): -46.7062 -46.7062 -45.5036 -45.5036 -19.6940 -19.6940 -19.6606 -19.6606 -16.7509 -16.7509 -16.6990 -16.6990 -11.0540 -11.0540 -10.8515 -10.8515 15.8261 15.8261 16.1651 16.1651 17.8564 17.8564 17.8932 17.8932 21.4641 21.4641 22.0142 22.0142 22.3924 22.3924 22.6210 22.6210 23.9382 23.9382 25.8543 25.8543 k = 0.5000 0.5000 0.1300 ( 1656 PWs) bands (ev): -46.7059 -46.7059 -45.5034 -45.5034 -19.6939 -19.6939 -19.6610 -19.6610 -16.7518 -16.7518 -16.7013 -16.7013 -11.0551 -11.0551 -10.8580 -10.8580 15.8805 15.8805 16.2172 16.2172 17.8526 17.8526 17.8925 17.8925 21.3849 21.3849 21.9190 21.9190 22.3948 22.3948 22.6268 22.6268 23.9703 23.9703 25.8603 25.8603 k = 0.5000 0.5000 0.1400 ( 1656 PWs) bands (ev): -46.7056 -46.7056 -45.5031 -45.5031 -19.6937 -19.6937 -19.6613 -19.6613 -16.7527 -16.7527 -16.7036 -16.7036 -11.0564 -11.0564 -10.8650 -10.8650 15.9384 15.9384 16.2731 16.2731 17.8488 17.8488 17.8921 17.8921 21.3030 21.3030 21.8212 21.8212 22.3973 22.3973 22.6329 22.6329 24.0048 24.0048 25.8664 25.8664 k = 0.5000 0.5000 0.1500 ( 1648 PWs) bands (ev): -46.7053 -46.7053 -45.5028 -45.5028 -19.6935 -19.6935 -19.6617 -19.6617 -16.7537 -16.7537 -16.7061 -16.7061 -11.0577 -11.0577 -10.8722 -10.8722 15.9998 15.9998 16.3326 16.3326 17.8452 17.8452 17.8920 17.8920 21.2190 21.2190 21.7213 21.7213 22.4000 22.4000 22.6391 22.6391 24.0419 24.0419 25.8725 25.8725 k = 0.5000 0.5000 0.1600 ( 1640 PWs) bands (ev): -46.7049 -46.7049 -45.5025 -45.5025 -19.6933 -19.6933 -19.6620 -19.6620 -16.7547 -16.7547 -16.7086 -16.7086 -11.0591 -11.0591 -10.8798 -10.8798 16.0645 16.0645 16.3956 16.3956 17.8419 17.8419 17.8924 17.8924 21.1332 21.1332 21.6198 21.6198 22.4028 22.4028 22.6455 22.6455 24.0814 24.0814 25.8787 25.8787 k = 0.5000 0.5000 0.1700 ( 1640 PWs) bands (ev): -46.7045 -46.7045 -45.5022 -45.5022 -19.6931 -19.6931 -19.6624 -19.6624 -16.7557 -16.7557 -16.7114 -16.7114 -11.0605 -11.0605 -10.8877 -10.8877 16.1322 16.1322 16.4621 16.4621 17.8388 17.8388 17.8932 17.8932 21.0460 21.0460 21.5171 21.5171 22.4056 22.4056 22.6517 22.6517 24.1234 24.1234 25.8850 25.8850 k = 0.5000 0.5000 0.1800 ( 1640 PWs) bands (ev): -46.7042 -46.7042 -45.5019 -45.5019 -19.6929 -19.6929 -19.6628 -19.6628 -16.7568 -16.7568 -16.7141 -16.7141 -11.0620 -11.0620 -10.8959 -10.8959 16.2028 16.2028 16.5319 16.5319 17.8361 17.8361 17.8946 17.8946 20.9578 20.9578 21.4136 21.4136 22.4086 22.4086 22.6577 22.6577 24.1679 24.1679 25.8913 25.8913 k = 0.5000 0.5000 0.1900 ( 1648 PWs) bands (ev): -46.7038 -46.7038 -45.5016 -45.5016 -19.6928 -19.6928 -19.6633 -19.6633 -16.7579 -16.7579 -16.7170 -16.7170 -11.0635 -11.0635 -10.9043 -10.9043 16.2759 16.2759 16.6048 16.6048 17.8340 17.8340 17.8965 17.8965 20.8690 20.8690 21.3096 21.3096 22.4116 22.4116 22.6636 22.6636 24.2148 24.2148 25.8977 25.8977 k = 0.5000 0.5000 0.2000 ( 1648 PWs) bands (ev): -46.7034 -46.7034 -45.5012 -45.5012 -19.6926 -19.6926 -19.6637 -19.6637 -16.7591 -16.7591 -16.7200 -16.7200 -11.0650 -11.0650 -10.9129 -10.9129 16.3514 16.3514 16.6807 16.6807 17.8324 17.8324 17.8992 17.8992 20.7798 20.7798 21.2054 21.2054 22.4148 22.4148 22.6691 22.6691 24.2641 24.2641 25.9041 25.9041 k = 0.5000 0.5000 0.2100 ( 1648 PWs) bands (ev): -46.7030 -46.7030 -45.5009 -45.5009 -19.6924 -19.6924 -19.6642 -19.6642 -16.7602 -16.7602 -16.7230 -16.7230 -11.0666 -11.0666 -10.9217 -10.9217 16.4290 16.4290 16.7594 16.7594 17.8316 17.8316 17.9027 17.9027 20.6904 20.6904 21.1013 21.1013 22.4180 22.4180 22.6742 22.6742 24.3159 24.3159 25.9105 25.9105 k = 0.5000 0.5000 0.2200 ( 1648 PWs) bands (ev): -46.7026 -46.7026 -45.5005 -45.5005 -19.6922 -19.6922 -19.6647 -19.6647 -16.7614 -16.7614 -16.7260 -16.7260 -11.0683 -11.0683 -10.9306 -10.9306 16.5083 16.5083 16.8408 16.8408 17.8316 17.8316 17.9070 17.9070 20.6012 20.6012 20.9975 20.9975 22.4213 22.4213 22.6787 22.6787 24.3701 24.3701 25.9169 25.9169 k = 0.5000 0.5000 0.2300 ( 1648 PWs) bands (ev): -46.7022 -46.7022 -45.5002 -45.5002 -19.6920 -19.6920 -19.6652 -19.6652 -16.7626 -16.7626 -16.7290 -16.7290 -11.0699 -11.0699 -10.9396 -10.9396 16.5891 16.5891 16.9247 16.9247 17.8326 17.8326 17.9123 17.9123 20.5124 20.5124 20.8943 20.8943 22.4246 22.4246 22.6827 22.6827 24.4266 24.4266 25.9234 25.9234 k = 0.5000 0.5000 0.2400 ( 1656 PWs) bands (ev): -46.7017 -46.7017 -45.4998 -45.4998 -19.6918 -19.6918 -19.6657 -19.6657 -16.7637 -16.7637 -16.7321 -16.7321 -11.0716 -11.0716 -10.9486 -10.9486 16.6710 16.6710 17.0108 17.0108 17.8345 17.8345 17.9185 17.9185 20.4241 20.4241 20.7918 20.7918 22.4279 22.4279 22.6859 22.6859 24.4855 24.4855 25.9298 25.9298 k = 0.5000 0.5000 0.2500 ( 1656 PWs) bands (ev): -46.7013 -46.7013 -45.4995 -45.4995 -19.6917 -19.6917 -19.6662 -19.6662 -16.7649 -16.7649 -16.7352 -16.7352 -11.0732 -11.0732 -10.9577 -10.9577 16.7536 16.7536 17.0990 17.0990 17.8377 17.8377 17.9258 17.9258 20.3366 20.3366 20.6902 20.6902 22.4313 22.4313 22.6883 22.6883 24.5467 24.5467 25.9362 25.9362 k = 0.5000 0.5000 0.2600 ( 1656 PWs) bands (ev): -46.7009 -46.7009 -45.4991 -45.4991 -19.6915 -19.6915 -19.6667 -19.6667 -16.7661 -16.7661 -16.7382 -16.7382 -11.0749 -11.0749 -10.9667 -10.9667 16.8366 16.8366 17.1890 17.1890 17.8422 17.8422 17.9342 17.9342 20.2501 20.2501 20.5896 20.5896 22.4347 22.4347 22.6898 22.6898 24.6101 24.6101 25.9426 25.9426 k = 0.5000 0.5000 0.2700 ( 1648 PWs) bands (ev): -46.7005 -46.7005 -45.4987 -45.4987 -19.6913 -19.6913 -19.6672 -19.6672 -16.7672 -16.7672 -16.7412 -16.7412 -11.0766 -11.0766 -10.9757 -10.9757 16.9194 16.9194 17.2805 17.2805 17.8483 17.8483 17.9439 17.9439 20.1647 20.1647 20.4902 20.4902 22.4380 22.4380 22.6904 22.6904 24.6756 24.6756 25.9489 25.9489 k = 0.5000 0.5000 0.2800 ( 1648 PWs) bands (ev): -46.7001 -46.7001 -45.4984 -45.4984 -19.6911 -19.6911 -19.6677 -19.6677 -16.7683 -16.7683 -16.7442 -16.7442 -11.0782 -11.0782 -10.9846 -10.9846 17.0017 17.0017 17.3734 17.3734 17.8561 17.8561 17.9548 17.9548 20.0805 20.0805 20.3922 20.3922 22.4414 22.4414 22.6897 22.6897 24.7432 24.7432 25.9552 25.9552 k = 0.5000 0.5000 0.2900 ( 1648 PWs) bands (ev): -46.6997 -46.6997 -45.4980 -45.4980 -19.6909 -19.6909 -19.6682 -19.6682 -16.7694 -16.7694 -16.7472 -16.7472 -11.0798 -11.0798 -10.9934 -10.9934 17.0827 17.0827 17.4671 17.4671 17.8659 17.8659 17.9671 17.9671 19.9978 19.9978 20.2956 20.2956 22.4447 22.4447 22.6879 22.6879 24.8126 24.8126 25.9613 25.9613 k = 0.5000 0.5000 0.3000 ( 1644 PWs) bands (ev): -46.6993 -46.6993 -45.4977 -45.4977 -19.6907 -19.6907 -19.6687 -19.6687 -16.7705 -16.7705 -16.7501 -16.7501 -11.0814 -11.0814 -11.0020 -11.0020 17.1620 17.1620 17.5615 17.5615 17.8780 17.8780 17.9808 17.9808 19.9166 19.9166 20.2005 20.2005 22.4480 22.4480 22.6849 22.6849 24.8838 24.8838 25.9674 25.9674 k = 0.5000 0.5000 0.3100 ( 1644 PWs) bands (ev): -46.6989 -46.6989 -45.4973 -45.4973 -19.6906 -19.6906 -19.6692 -19.6692 -16.7716 -16.7716 -16.7529 -16.7529 -11.0830 -11.0830 -11.0104 -11.0104 17.2388 17.2388 17.6562 17.6562 17.8927 17.8927 17.9959 17.9959 19.8372 19.8372 20.1070 20.1070 22.4512 22.4512 22.6805 22.6805 24.9566 24.9566 25.9732 25.9732 k = 0.5000 0.5000 0.3200 ( 1644 PWs) bands (ev): -46.6985 -46.6985 -45.4970 -45.4970 -19.6904 -19.6904 -19.6697 -19.6697 -16.7726 -16.7726 -16.7557 -16.7557 -11.0845 -11.0845 -11.0187 -11.0187 17.3125 17.3125 17.7508 17.7508 17.9104 17.9104 18.0126 18.0126 19.7596 19.7596 20.0154 20.0154 22.4543 22.4543 22.6748 22.6748 25.0307 25.0307 25.9790 25.9790 k = 0.5000 0.5000 0.3300 ( 1644 PWs) bands (ev): -46.6981 -46.6981 -45.4967 -45.4967 -19.6903 -19.6903 -19.6702 -19.6702 -16.7736 -16.7736 -16.7583 -16.7583 -11.0860 -11.0860 -11.0266 -11.0266 17.3822 17.3822 17.8447 17.8447 17.9315 17.9315 18.0310 18.0310 19.6840 19.6840 19.9255 19.9255 22.4574 22.4574 22.6676 22.6676 25.1059 25.1059 25.9845 25.9845 k = 0.5000 0.5000 0.3400 ( 1644 PWs) bands (ev): -46.6977 -46.6977 -45.4964 -45.4964 -19.6902 -19.6902 -19.6706 -19.6706 -16.7746 -16.7746 -16.7609 -16.7609 -11.0875 -11.0875 -11.0343 -11.0343 17.4471 17.4471 17.9373 17.9373 17.9564 17.9564 18.0515 18.0515 19.6105 19.6105 19.8376 19.8376 22.4603 22.4603 22.6592 22.6592 25.1819 25.1819 25.9899 25.9899 k = 0.5000 0.5000 0.3500 ( 1628 PWs) bands (ev): -46.6974 -46.6974 -45.4961 -45.4961 -19.6900 -19.6900 -19.6710 -19.6710 -16.7754 -16.7754 -16.7633 -16.7633 -11.0888 -11.0888 -11.0417 -11.0417 17.5066 17.5066 17.9855 17.9855 18.0261 18.0261 18.0761 18.0761 19.5392 19.5392 19.7517 19.7517 22.4633 22.4633 22.6494 22.6494 25.2583 25.2583 25.9950 25.9950 k = 0.5000 0.5000 0.3600 ( 1628 PWs) bands (ev): -46.6971 -46.6971 -45.4958 -45.4958 -19.6899 -19.6899 -19.6715 -19.6715 -16.7763 -16.7763 -16.7656 -16.7656 -11.0902 -11.0902 -11.0487 -11.0487 17.5601 17.5601 18.0188 18.0188 18.0863 18.0863 18.1291 18.1291 19.4703 19.4703 19.6679 19.6679 22.4660 22.4660 22.6384 22.6384 25.3348 25.3348 25.9999 25.9999 k = 0.5000 0.5000 0.3700 ( 1632 PWs) bands (ev): -46.6967 -46.6967 -45.4955 -45.4955 -19.6898 -19.6898 -19.6719 -19.6719 -16.7771 -16.7771 -16.7679 -16.7679 -11.0914 -11.0914 -11.0554 -11.0554 17.6075 17.6075 18.0559 18.0559 18.1151 18.1151 18.2127 18.2127 19.4039 19.4039 19.5862 19.5862 22.4686 22.4686 22.6263 22.6263 25.4107 25.4107 26.0046 26.0046 k = 0.5000 0.5000 0.3800 ( 1632 PWs) bands (ev): -46.6964 -46.6964 -45.4952 -45.4952 -19.6897 -19.6897 -19.6723 -19.6723 -16.7779 -16.7779 -16.7700 -16.7700 -11.0926 -11.0926 -11.0617 -11.0617 17.6491 17.6491 18.0964 18.0964 18.1421 18.1421 18.2969 18.2969 19.3402 19.3402 19.5069 19.5069 22.4710 22.4710 22.6131 22.6131 25.4856 25.4856 26.0089 26.0089 k = 0.5000 0.5000 0.3900 ( 1632 PWs) bands (ev): -46.6962 -46.6962 -45.4950 -45.4950 -19.6896 -19.6896 -19.6727 -19.6727 -16.7786 -16.7786 -16.7719 -16.7719 -11.0937 -11.0937 -11.0676 -11.0676 17.6853 17.6853 18.1392 18.1392 18.1701 18.1701 18.3781 18.3781 19.2792 19.2792 19.4299 19.4299 22.4733 22.4733 22.5993 22.5993 25.5588 25.5588 26.0130 26.0130 k = 0.5000 0.5000 0.4000 ( 1648 PWs) bands (ev): -46.6959 -46.6959 -45.4948 -45.4948 -19.6896 -19.6896 -19.6731 -19.6731 -16.7793 -16.7793 -16.7738 -16.7738 -11.0948 -11.0948 -11.0730 -11.0730 17.7168 17.7168 18.1832 18.1832 18.1994 18.1994 18.4555 18.4555 19.2213 19.2213 19.3554 19.3554 22.4754 22.4754 22.5849 22.5849 25.6298 25.6298 26.0168 26.0168 k = 0.5000 0.5000 0.4100 ( 1644 PWs) bands (ev): -46.6957 -46.6957 -45.4946 -45.4946 -19.6895 -19.6895 -19.6734 -19.6734 -16.7799 -16.7799 -16.7754 -16.7754 -11.0957 -11.0957 -11.0780 -11.0780 17.7443 17.7443 18.2272 18.2272 18.2302 18.2302 18.5283 18.5283 19.1666 19.1666 19.2837 19.2837 22.4773 22.4773 22.5703 22.5703 25.6976 25.6976 26.0203 26.0203 k = 0.5000 0.5000 0.4200 ( 1640 PWs) bands (ev): -46.6955 -46.6955 -45.4944 -45.4944 -19.6894 -19.6894 -19.6737 -19.6737 -16.7805 -16.7805 -16.7769 -16.7769 -11.0966 -11.0966 -11.0825 -11.0825 17.7684 17.7684 18.2621 18.2621 18.2703 18.2703 18.5957 18.5957 19.1154 19.1154 19.2149 19.2149 22.4791 22.4791 22.5559 22.5559 25.7616 25.7616 26.0234 26.0234 k = 0.5000 0.5000 0.4300 ( 1640 PWs) bands (ev): -46.6953 -46.6953 -45.4943 -45.4943 -19.6894 -19.6894 -19.6739 -19.6739 -16.7810 -16.7810 -16.7782 -16.7782 -11.0973 -11.0973 -11.0865 -11.0865 17.7894 17.7894 18.2951 18.2951 18.3114 18.3114 18.6572 18.6572 19.0678 19.0678 19.1492 19.1492 22.4807 22.4807 22.5418 22.5418 25.8208 25.8208 26.0262 26.0262 k = 0.5000 0.5000 0.4400 ( 1640 PWs) bands (ev): -46.6951 -46.6951 -45.4941 -45.4941 -19.6893 -19.6893 -19.6742 -19.6742 -16.7814 -16.7814 -16.7793 -16.7793 -11.0980 -11.0980 -11.0900 -11.0900 17.8077 17.8077 18.3288 18.3288 18.3497 18.3497 18.7120 18.7120 19.0243 19.0243 19.0873 19.0873 22.4821 22.4821 22.5285 22.5285 25.8745 25.8745 26.0287 26.0287 k = 0.5000 0.5000 0.4500 ( 1640 PWs) bands (ev): -46.6950 -46.6950 -45.4940 -45.4940 -19.6893 -19.6893 -19.6744 -19.6744 -16.7818 -16.7818 -16.7803 -16.7803 -11.0986 -11.0986 -11.0930 -11.0930 17.8234 17.8234 18.3625 18.3625 18.3845 18.3845 18.7595 18.7595 18.9854 18.9854 19.0296 19.0296 22.4832 22.4832 22.5165 22.5165 25.9216 25.9216 26.0308 26.0308 k = 0.5000 0.5000 0.4600 ( 1640 PWs) bands (ev): -46.6948 -46.6948 -45.4939 -45.4939 -19.6892 -19.6892 -19.6745 -19.6745 -16.7821 -16.7821 -16.7811 -16.7811 -11.0990 -11.0990 -11.0955 -11.0955 17.8363 17.8363 18.3954 18.3954 18.4150 18.4150 18.7989 18.7989 18.9515 18.9515 18.9774 18.9774 22.4842 22.4842 22.5060 22.5060 25.9615 25.9615 26.0325 26.0325 k = 0.5000 0.5000 0.4700 ( 1640 PWs) bands (ev): -46.6948 -46.6948 -45.4938 -45.4938 -19.6892 -19.6892 -19.6746 -19.6746 -16.7823 -16.7823 -16.7818 -16.7818 -11.0994 -11.0994 -11.0974 -11.0974 17.8466 17.8466 18.4259 18.4259 18.4404 18.4404 18.8294 18.8294 18.9235 18.9235 18.9326 18.9326 22.4850 22.4850 22.4975 22.4975 25.9934 25.9934 26.0339 26.0339 k = 0.5000 0.5000 0.4800 ( 1640 PWs) bands (ev): -46.6947 -46.6947 -45.4937 -45.4937 -19.6892 -19.6892 -19.6747 -19.6747 -16.7825 -16.7825 -16.7822 -16.7822 -11.0997 -11.0997 -11.0988 -11.0988 17.8540 17.8540 18.4517 18.4517 18.4597 18.4597 18.8489 18.8489 18.8992 18.8992 18.9024 18.9024 22.4855 22.4855 22.4912 22.4912 26.0167 26.0167 26.0348 26.0348 k = 0.5000 0.5000 0.4900 ( 1640 PWs) bands (ev): -46.6947 -46.6947 -45.4937 -45.4937 -19.6892 -19.6892 -19.6748 -19.6748 -16.7826 -16.7826 -16.7825 -16.7825 -11.0998 -11.0998 -11.0996 -11.0996 17.8585 17.8585 18.4695 18.4695 18.4718 18.4718 18.8523 18.8523 18.8852 18.8852 18.8891 18.8891 22.4859 22.4859 22.4873 22.4873 26.0309 26.0309 26.0354 26.0354 k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): -46.6946 -46.6946 -45.4937 -45.4937 -19.6892 -19.6892 -19.6748 -19.6748 -16.7826 -16.7826 -16.7826 -16.7826 -11.0999 -11.0999 -11.0999 -11.0999 17.8601 17.8601 18.4760 18.4760 18.4760 18.4760 18.8489 18.8489 18.8846 18.8846 18.8846 18.8846 22.4860 22.4860 22.4860 22.4860 26.0356 26.0356 26.0356 26.0356 Writing output data file TaTc.save init_run : 0.16s CPU 5.56s WALL ( 1 calls) electrons : 45.12s CPU 46.32s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 5.23s WALL ( 1 calls) potinit : 0.01s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 45.12s CPU 46.31s 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 0.05s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.03s WALL ( 384 calls) cegterg : 39.92s CPU 40.73s WALL ( 395 calls) Called by sum_band: Called by *egterg: h_psi : 20.55s CPU 21.23s WALL ( 4768 calls) s_psi : 1.08s CPU 1.06s WALL ( 4768 calls) g_psi : 0.04s CPU 0.05s WALL ( 3989 calls) cdiaghg : 18.46s CPU 18.64s WALL ( 4373 calls) cegterg:over : 1.47s CPU 1.46s WALL ( 3989 calls) cegterg:upda : 0.90s CPU 0.91s WALL ( 3989 calls) cegterg:last : 0.62s CPU 0.66s WALL ( 1090 calls) cdiaghg:chol : 0.94s CPU 0.94s WALL ( 4373 calls) cdiaghg:inve : 0.45s CPU 0.51s WALL ( 4373 calls) cdiaghg:para : 1.11s CPU 1.08s WALL ( 8746 calls) Called by h_psi: h_psi:vloc : 17.92s CPU 18.61s WALL ( 4768 calls) h_psi:vnl : 2.60s CPU 2.59s WALL ( 4768 calls) add_vuspsi : 1.48s CPU 1.43s WALL ( 4768 calls) General routines calbec : 1.11s CPU 1.15s WALL ( 4768 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 16.56s CPU 17.18s WALL ( 472780 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.08s CPU 0.10s WALL ( 768 calls) Parallel routines fft_scatter : 8.46s CPU 9.02s WALL ( 472803 calls) PWSCF : 0m54.83s CPU 1m20.53s WALL This run was terminated on: 21:18:19 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=