Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 19:39:53 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: ./AlRe.save/ 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 18 14 4 368 238 42 Max 19 15 5 375 246 45 Sum 673 509 169 13397 8709 1575 bravais-lattice index = 14 lattice parameter (alat) = 5.4424 a.u. unit-cell volume = 161.2033 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 number of electrons = 18.00 number of Kohn-Sham states= 26 kinetic-energy cutoff = 54.0000 Ry charge density cutoff = 290.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.442411 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 Re read from file: /users/gautes/Pseudo/Re.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 151eeb7d95de718c8ba0a4937714e2a1 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 1275 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 Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 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 Re 15.00 186.20700 Re( 1.00) Al 3.00 26.98150 Al( 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= 422 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023697 k( 2) = ( 0.0000000 0.0090909 -0.0000000), wk = 0.0023697 k( 3) = ( 0.0000000 0.0181818 -0.0000000), wk = 0.0023697 k( 4) = ( 0.0000000 0.0272727 -0.0000000), wk = 0.0023697 k( 5) = ( 0.0000000 0.0363636 -0.0000000), wk = 0.0023697 k( 6) = ( 0.0000000 0.0454546 -0.0000000), wk = 0.0023697 k( 7) = ( 0.0000000 0.0545455 -0.0000000), wk = 0.0023697 k( 8) = ( 0.0000000 0.0636364 -0.0000000), wk = 0.0023697 k( 9) = ( 0.0000000 0.0727273 -0.0000000), wk = 0.0023697 k( 10) = ( 0.0000000 0.0818182 -0.0000000), wk = 0.0023697 k( 11) = ( 0.0000000 0.0909091 -0.0000000), wk = 0.0023697 k( 12) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0023697 k( 13) = ( 0.0000000 0.1090909 -0.0000000), wk = 0.0023697 k( 14) = ( 0.0000000 0.1181818 -0.0000000), wk = 0.0023697 k( 15) = ( 0.0000000 0.1272727 -0.0000000), wk = 0.0023697 k( 16) = ( 0.0000000 0.1363636 -0.0000000), wk = 0.0023697 k( 17) = ( 0.0000000 0.1454545 -0.0000000), wk = 0.0023697 k( 18) = ( 0.0000000 0.1545455 -0.0000000), wk = 0.0023697 k( 19) = ( 0.0000000 0.1636364 -0.0000000), wk = 0.0023697 k( 20) = ( 0.0000000 0.1727273 -0.0000000), wk = 0.0023697 k( 21) = ( 0.0000000 0.1818182 -0.0000000), wk = 0.0023697 k( 22) = ( 0.0000000 0.1909091 -0.0000000), wk = 0.0023697 k( 23) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0023697 k( 24) = ( 0.0000000 0.2090909 -0.0000000), wk = 0.0023697 k( 25) = ( 0.0000000 0.2181818 -0.0000000), wk = 0.0023697 k( 26) = ( 0.0000000 0.2272727 -0.0000000), wk = 0.0023697 k( 27) = ( 0.0000000 0.2363636 -0.0000000), wk = 0.0023697 k( 28) = ( 0.0000000 0.2454545 -0.0000000), wk = 0.0023697 k( 29) = ( 0.0000000 0.2545455 -0.0000000), wk = 0.0023697 k( 30) = ( 0.0000000 0.2636364 -0.0000000), wk = 0.0023697 k( 31) = ( 0.0000000 0.2727273 -0.0000000), wk = 0.0023697 k( 32) = ( 0.0000000 0.2818182 -0.0000000), wk = 0.0023697 k( 33) = ( 0.0000000 0.2909091 -0.0000000), wk = 0.0023697 k( 34) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0023697 k( 35) = ( 0.0000000 0.3090909 -0.0000000), wk = 0.0023697 k( 36) = ( 0.0000000 0.3181818 -0.0000000), wk = 0.0023697 k( 37) = ( 0.0000000 0.3272727 -0.0000000), wk = 0.0023697 k( 38) = ( 0.0000000 0.3363636 -0.0000000), wk = 0.0023697 k( 39) = ( 0.0000000 0.3454546 -0.0000000), wk = 0.0023697 k( 40) = ( 0.0000000 0.3545454 -0.0000000), wk = 0.0023697 k( 41) = ( 0.0000000 0.3636364 -0.0000000), wk = 0.0023697 k( 42) = ( 0.0000000 0.3727273 -0.0000000), wk = 0.0023697 k( 43) = ( 0.0000000 0.3818182 -0.0000000), wk = 0.0023697 k( 44) = ( 0.0000000 0.3909091 -0.0000000), wk = 0.0023697 k( 45) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0023697 k( 46) = ( 0.0000000 0.4090909 -0.0000000), wk = 0.0023697 k( 47) = ( 0.0000000 0.4181818 -0.0000000), wk = 0.0023697 k( 48) = ( 0.0000000 0.4272727 -0.0000000), wk = 0.0023697 k( 49) = ( 0.0000000 0.4363636 -0.0000000), wk = 0.0023697 k( 50) = ( 0.0000000 0.4454546 -0.0000000), wk = 0.0023697 k( 51) = ( 0.0000000 0.4545455 -0.0000000), wk = 0.0023697 k( 52) = ( 0.0000000 0.4636364 -0.0000000), wk = 0.0023697 k( 53) = ( 0.0000000 0.4727273 -0.0000000), wk = 0.0023697 k( 54) = ( 0.0000000 0.4818182 -0.0000000), wk = 0.0023697 k( 55) = ( 0.0000000 0.4909091 -0.0000000), wk = 0.0023697 k( 56) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023697 k( 57) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023697 k( 58) = ( 0.0090909 0.5000000 -0.0000000), wk = 0.0023697 k( 59) = ( 0.0181818 0.5000000 -0.0000000), wk = 0.0023697 k( 60) = ( 0.0272727 0.5000000 -0.0000000), wk = 0.0023697 k( 61) = ( 0.0363636 0.5000000 -0.0000000), wk = 0.0023697 k( 62) = ( 0.0454546 0.5000000 -0.0000000), wk = 0.0023697 k( 63) = ( 0.0545455 0.5000000 -0.0000000), wk = 0.0023697 k( 64) = ( 0.0636364 0.5000000 -0.0000000), wk = 0.0023697 k( 65) = ( 0.0727273 0.5000000 -0.0000000), wk = 0.0023697 k( 66) = ( 0.0818182 0.5000000 -0.0000000), wk = 0.0023697 k( 67) = ( 0.0909091 0.5000000 -0.0000000), wk = 0.0023697 k( 68) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0023697 k( 69) = ( 0.1090909 0.5000000 -0.0000000), wk = 0.0023697 k( 70) = ( 0.1181818 0.5000000 -0.0000000), wk = 0.0023697 k( 71) = ( 0.1272727 0.5000000 -0.0000000), wk = 0.0023697 k( 72) = ( 0.1363636 0.5000000 -0.0000000), wk = 0.0023697 k( 73) = ( 0.1454545 0.5000000 -0.0000000), wk = 0.0023697 k( 74) = ( 0.1545455 0.5000000 -0.0000000), wk = 0.0023697 k( 75) = ( 0.1636364 0.5000000 -0.0000000), wk = 0.0023697 k( 76) = ( 0.1727273 0.5000000 -0.0000000), wk = 0.0023697 k( 77) = ( 0.1818182 0.5000000 -0.0000000), wk = 0.0023697 k( 78) = ( 0.1909091 0.5000000 -0.0000000), wk = 0.0023697 k( 79) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0023697 k( 80) = ( 0.2090909 0.5000000 -0.0000000), wk = 0.0023697 k( 81) = ( 0.2181818 0.5000000 -0.0000000), wk = 0.0023697 k( 82) = ( 0.2272727 0.5000000 -0.0000000), wk = 0.0023697 k( 83) = ( 0.2363636 0.5000000 -0.0000000), wk = 0.0023697 k( 84) = ( 0.2454545 0.5000000 -0.0000000), wk = 0.0023697 k( 85) = ( 0.2545455 0.5000000 -0.0000000), wk = 0.0023697 k( 86) = ( 0.2636364 0.5000000 -0.0000000), wk = 0.0023697 k( 87) = ( 0.2727273 0.5000000 -0.0000000), wk = 0.0023697 k( 88) = ( 0.2818182 0.5000000 -0.0000000), wk = 0.0023697 k( 89) = ( 0.2909091 0.5000000 -0.0000000), wk = 0.0023697 k( 90) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0023697 k( 91) = ( 0.3090909 0.5000000 -0.0000000), wk = 0.0023697 k( 92) = ( 0.3181818 0.5000000 -0.0000000), wk = 0.0023697 k( 93) = ( 0.3272727 0.5000000 -0.0000000), wk = 0.0023697 k( 94) = ( 0.3363636 0.5000000 -0.0000000), wk = 0.0023697 k( 95) = ( 0.3454546 0.5000000 -0.0000000), wk = 0.0023697 k( 96) = ( 0.3545454 0.5000000 -0.0000000), wk = 0.0023697 k( 97) = ( 0.3636364 0.5000000 -0.0000000), wk = 0.0023697 k( 98) = ( 0.3727273 0.5000000 -0.0000000), wk = 0.0023697 k( 99) = ( 0.3818182 0.5000000 -0.0000000), wk = 0.0023697 k( 100) = ( 0.3909091 0.5000000 -0.0000000), wk = 0.0023697 k( 101) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0023697 k( 102) = ( 0.4090909 0.5000000 -0.0000000), wk = 0.0023697 k( 103) = ( 0.4181818 0.5000000 -0.0000000), wk = 0.0023697 k( 104) = ( 0.4272727 0.5000000 -0.0000000), wk = 0.0023697 k( 105) = ( 0.4363636 0.5000000 -0.0000000), wk = 0.0023697 k( 106) = ( 0.4454546 0.5000000 -0.0000000), wk = 0.0023697 k( 107) = ( 0.4545455 0.5000000 -0.0000000), wk = 0.0023697 k( 108) = ( 0.4636364 0.5000000 -0.0000000), wk = 0.0023697 k( 109) = ( 0.4727273 0.5000000 -0.0000000), wk = 0.0023697 k( 110) = ( 0.4818182 0.5000000 -0.0000000), wk = 0.0023697 k( 111) = ( 0.4909091 0.5000000 -0.0000000), wk = 0.0023697 k( 112) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023697 k( 113) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023697 k( 114) = ( 0.4935897 0.4935897 -0.0000000), wk = 0.0023697 k( 115) = ( 0.4871795 0.4871795 -0.0000000), wk = 0.0023697 k( 116) = ( 0.4807692 0.4807692 -0.0000000), wk = 0.0023697 k( 117) = ( 0.4743590 0.4743590 -0.0000000), wk = 0.0023697 k( 118) = ( 0.4679487 0.4679487 -0.0000000), wk = 0.0023697 k( 119) = ( 0.4615385 0.4615385 -0.0000000), wk = 0.0023697 k( 120) = ( 0.4551282 0.4551282 -0.0000000), wk = 0.0023697 k( 121) = ( 0.4487179 0.4487179 -0.0000000), wk = 0.0023697 k( 122) = ( 0.4423077 0.4423077 -0.0000000), wk = 0.0023697 k( 123) = ( 0.4358974 0.4358974 -0.0000000), wk = 0.0023697 k( 124) = ( 0.4294872 0.4294872 -0.0000000), wk = 0.0023697 k( 125) = ( 0.4230769 0.4230769 -0.0000000), wk = 0.0023697 k( 126) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0023697 k( 127) = ( 0.4102564 0.4102564 -0.0000000), wk = 0.0023697 k( 128) = ( 0.4038462 0.4038461 -0.0000000), wk = 0.0023697 k( 129) = ( 0.3974359 0.3974359 -0.0000000), wk = 0.0023697 k( 130) = ( 0.3910256 0.3910256 -0.0000000), wk = 0.0023697 k( 131) = ( 0.3846154 0.3846154 -0.0000000), wk = 0.0023697 k( 132) = ( 0.3782051 0.3782051 -0.0000000), wk = 0.0023697 k( 133) = ( 0.3717949 0.3717949 -0.0000000), wk = 0.0023697 k( 134) = ( 0.3653846 0.3653846 -0.0000000), wk = 0.0023697 k( 135) = ( 0.3589744 0.3589744 -0.0000000), wk = 0.0023697 k( 136) = ( 0.3525641 0.3525641 -0.0000000), wk = 0.0023697 k( 137) = ( 0.3461538 0.3461538 -0.0000000), wk = 0.0023697 k( 138) = ( 0.3397436 0.3397436 -0.0000000), wk = 0.0023697 k( 139) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0023697 k( 140) = ( 0.3269231 0.3269231 -0.0000000), wk = 0.0023697 k( 141) = ( 0.3205128 0.3205128 -0.0000000), wk = 0.0023697 k( 142) = ( 0.3141026 0.3141026 -0.0000000), wk = 0.0023697 k( 143) = ( 0.3076923 0.3076923 -0.0000000), wk = 0.0023697 k( 144) = ( 0.3012821 0.3012820 -0.0000000), wk = 0.0023697 k( 145) = ( 0.2948718 0.2948718 -0.0000000), wk = 0.0023697 k( 146) = ( 0.2884615 0.2884615 -0.0000000), wk = 0.0023697 k( 147) = ( 0.2820513 0.2820513 -0.0000000), wk = 0.0023697 k( 148) = ( 0.2756410 0.2756410 -0.0000000), wk = 0.0023697 k( 149) = ( 0.2692308 0.2692308 -0.0000000), wk = 0.0023697 k( 150) = ( 0.2628205 0.2628205 -0.0000000), wk = 0.0023697 k( 151) = ( 0.2564103 0.2564103 -0.0000000), wk = 0.0023697 k( 152) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0023697 k( 153) = ( 0.2435897 0.2435897 -0.0000000), wk = 0.0023697 k( 154) = ( 0.2371795 0.2371795 -0.0000000), wk = 0.0023697 k( 155) = ( 0.2307692 0.2307692 -0.0000000), wk = 0.0023697 k( 156) = ( 0.2243590 0.2243590 -0.0000000), wk = 0.0023697 k( 157) = ( 0.2179487 0.2179487 -0.0000000), wk = 0.0023697 k( 158) = ( 0.2115385 0.2115385 -0.0000000), wk = 0.0023697 k( 159) = ( 0.2051282 0.2051282 -0.0000000), wk = 0.0023697 k( 160) = ( 0.1987180 0.1987179 -0.0000000), wk = 0.0023697 k( 161) = ( 0.1923077 0.1923077 -0.0000000), wk = 0.0023697 k( 162) = ( 0.1858974 0.1858974 -0.0000000), wk = 0.0023697 k( 163) = ( 0.1794872 0.1794872 -0.0000000), wk = 0.0023697 k( 164) = ( 0.1730769 0.1730769 -0.0000000), wk = 0.0023697 k( 165) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0023697 k( 166) = ( 0.1602564 0.1602564 -0.0000000), wk = 0.0023697 k( 167) = ( 0.1538461 0.1538461 -0.0000000), wk = 0.0023697 k( 168) = ( 0.1474359 0.1474359 -0.0000000), wk = 0.0023697 k( 169) = ( 0.1410256 0.1410256 -0.0000000), wk = 0.0023697 k( 170) = ( 0.1346154 0.1346154 -0.0000000), wk = 0.0023697 k( 171) = ( 0.1282051 0.1282051 -0.0000000), wk = 0.0023697 k( 172) = ( 0.1217949 0.1217949 -0.0000000), wk = 0.0023697 k( 173) = ( 0.1153846 0.1153846 -0.0000000), wk = 0.0023697 k( 174) = ( 0.1089744 0.1089744 -0.0000000), wk = 0.0023697 k( 175) = ( 0.1025641 0.1025641 -0.0000000), wk = 0.0023697 k( 176) = ( 0.0961538 0.0961538 -0.0000000), wk = 0.0023697 k( 177) = ( 0.0897436 0.0897436 -0.0000000), wk = 0.0023697 k( 178) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0023697 k( 179) = ( 0.0769231 0.0769231 -0.0000000), wk = 0.0023697 k( 180) = ( 0.0705128 0.0705128 -0.0000000), wk = 0.0023697 k( 181) = ( 0.0641026 0.0641026 -0.0000000), wk = 0.0023697 k( 182) = ( 0.0576923 0.0576923 -0.0000000), wk = 0.0023697 k( 183) = ( 0.0512821 0.0512820 -0.0000000), wk = 0.0023697 k( 184) = ( 0.0448718 0.0448718 -0.0000000), wk = 0.0023697 k( 185) = ( 0.0384615 0.0384615 -0.0000000), wk = 0.0023697 k( 186) = ( 0.0320513 0.0320513 -0.0000000), wk = 0.0023697 k( 187) = ( 0.0256410 0.0256410 -0.0000000), wk = 0.0023697 k( 188) = ( 0.0192308 0.0192308 -0.0000000), wk = 0.0023697 k( 189) = ( 0.0128205 0.0128205 -0.0000000), wk = 0.0023697 k( 190) = ( 0.0064103 0.0064103 -0.0000000), wk = 0.0023697 k( 191) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023697 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023697 k( 193) = ( 0.0052632 0.0052632 0.0052632), wk = 0.0023697 k( 194) = ( 0.0105263 0.0105263 0.0105263), wk = 0.0023697 k( 195) = ( 0.0157895 0.0157895 0.0157895), wk = 0.0023697 k( 196) = ( 0.0210526 0.0210526 0.0210526), wk = 0.0023697 k( 197) = ( 0.0263158 0.0263158 0.0263158), wk = 0.0023697 k( 198) = ( 0.0315790 0.0315790 0.0315789), wk = 0.0023697 k( 199) = ( 0.0368421 0.0368421 0.0368421), wk = 0.0023697 k( 200) = ( 0.0421053 0.0421053 0.0421053), wk = 0.0023697 k( 201) = ( 0.0473684 0.0473684 0.0473684), wk = 0.0023697 k( 202) = ( 0.0526316 0.0526316 0.0526316), wk = 0.0023697 k( 203) = ( 0.0578947 0.0578947 0.0578947), wk = 0.0023697 k( 204) = ( 0.0631579 0.0631579 0.0631579), wk = 0.0023697 k( 205) = ( 0.0684210 0.0684210 0.0684210), wk = 0.0023697 k( 206) = ( 0.0736842 0.0736842 0.0736842), wk = 0.0023697 k( 207) = ( 0.0789474 0.0789474 0.0789474), wk = 0.0023697 k( 208) = ( 0.0842105 0.0842105 0.0842105), wk = 0.0023697 k( 209) = ( 0.0894737 0.0894737 0.0894737), wk = 0.0023697 k( 210) = ( 0.0947368 0.0947368 0.0947368), wk = 0.0023697 k( 211) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0023697 k( 212) = ( 0.1052632 0.1052632 0.1052632), wk = 0.0023697 k( 213) = ( 0.1105263 0.1105263 0.1105263), wk = 0.0023697 k( 214) = ( 0.1157895 0.1157895 0.1157895), wk = 0.0023697 k( 215) = ( 0.1210526 0.1210526 0.1210526), wk = 0.0023697 k( 216) = ( 0.1263158 0.1263158 0.1263158), wk = 0.0023697 k( 217) = ( 0.1315790 0.1315790 0.1315789), wk = 0.0023697 k( 218) = ( 0.1368421 0.1368421 0.1368421), wk = 0.0023697 k( 219) = ( 0.1421053 0.1421053 0.1421053), wk = 0.0023697 k( 220) = ( 0.1473684 0.1473684 0.1473684), wk = 0.0023697 k( 221) = ( 0.1526316 0.1526316 0.1526316), wk = 0.0023697 k( 222) = ( 0.1578947 0.1578947 0.1578947), wk = 0.0023697 k( 223) = ( 0.1631579 0.1631579 0.1631579), wk = 0.0023697 k( 224) = ( 0.1684210 0.1684210 0.1684210), wk = 0.0023697 k( 225) = ( 0.1736842 0.1736842 0.1736842), wk = 0.0023697 k( 226) = ( 0.1789474 0.1789474 0.1789474), wk = 0.0023697 k( 227) = ( 0.1842105 0.1842105 0.1842105), wk = 0.0023697 k( 228) = ( 0.1894737 0.1894737 0.1894737), wk = 0.0023697 k( 229) = ( 0.1947368 0.1947368 0.1947368), wk = 0.0023697 k( 230) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0023697 k( 231) = ( 0.2052632 0.2052632 0.2052632), wk = 0.0023697 k( 232) = ( 0.2105263 0.2105263 0.2105263), wk = 0.0023697 k( 233) = ( 0.2157895 0.2157895 0.2157895), wk = 0.0023697 k( 234) = ( 0.2210526 0.2210526 0.2210526), wk = 0.0023697 k( 235) = ( 0.2263158 0.2263158 0.2263158), wk = 0.0023697 k( 236) = ( 0.2315790 0.2315789 0.2315789), wk = 0.0023697 k( 237) = ( 0.2368421 0.2368421 0.2368421), wk = 0.0023697 k( 238) = ( 0.2421053 0.2421053 0.2421053), wk = 0.0023697 k( 239) = ( 0.2473684 0.2473684 0.2473684), wk = 0.0023697 k( 240) = ( 0.2526316 0.2526316 0.2526316), wk = 0.0023697 k( 241) = ( 0.2578947 0.2578947 0.2578947), wk = 0.0023697 k( 242) = ( 0.2631579 0.2631579 0.2631579), wk = 0.0023697 k( 243) = ( 0.2684210 0.2684210 0.2684210), wk = 0.0023697 k( 244) = ( 0.2736842 0.2736842 0.2736842), wk = 0.0023697 k( 245) = ( 0.2789474 0.2789474 0.2789474), wk = 0.0023697 k( 246) = ( 0.2842105 0.2842105 0.2842105), wk = 0.0023697 k( 247) = ( 0.2894737 0.2894737 0.2894737), wk = 0.0023697 k( 248) = ( 0.2947368 0.2947368 0.2947368), wk = 0.0023697 k( 249) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0023697 k( 250) = ( 0.3052632 0.3052632 0.3052632), wk = 0.0023697 k( 251) = ( 0.3105263 0.3105263 0.3105263), wk = 0.0023697 k( 252) = ( 0.3157895 0.3157895 0.3157895), wk = 0.0023697 k( 253) = ( 0.3210526 0.3210526 0.3210526), wk = 0.0023697 k( 254) = ( 0.3263158 0.3263158 0.3263158), wk = 0.0023697 k( 255) = ( 0.3315789 0.3315789 0.3315789), wk = 0.0023697 k( 256) = ( 0.3368421 0.3368421 0.3368421), wk = 0.0023697 k( 257) = ( 0.3421053 0.3421053 0.3421053), wk = 0.0023697 k( 258) = ( 0.3473684 0.3473684 0.3473684), wk = 0.0023697 k( 259) = ( 0.3526316 0.3526316 0.3526316), wk = 0.0023697 k( 260) = ( 0.3578947 0.3578947 0.3578947), wk = 0.0023697 k( 261) = ( 0.3631579 0.3631579 0.3631579), wk = 0.0023697 k( 262) = ( 0.3684211 0.3684210 0.3684210), wk = 0.0023697 k( 263) = ( 0.3736842 0.3736842 0.3736842), wk = 0.0023697 k( 264) = ( 0.3789474 0.3789474 0.3789474), wk = 0.0023697 k( 265) = ( 0.3842105 0.3842105 0.3842105), wk = 0.0023697 k( 266) = ( 0.3894737 0.3894737 0.3894737), wk = 0.0023697 k( 267) = ( 0.3947368 0.3947368 0.3947368), wk = 0.0023697 k( 268) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0023697 k( 269) = ( 0.4052632 0.4052632 0.4052632), wk = 0.0023697 k( 270) = ( 0.4105263 0.4105263 0.4105263), wk = 0.0023697 k( 271) = ( 0.4157895 0.4157895 0.4157895), wk = 0.0023697 k( 272) = ( 0.4210526 0.4210526 0.4210526), wk = 0.0023697 k( 273) = ( 0.4263158 0.4263158 0.4263158), wk = 0.0023697 k( 274) = ( 0.4315790 0.4315789 0.4315789), wk = 0.0023697 k( 275) = ( 0.4368421 0.4368421 0.4368421), wk = 0.0023697 k( 276) = ( 0.4421053 0.4421053 0.4421053), wk = 0.0023697 k( 277) = ( 0.4473684 0.4473684 0.4473684), wk = 0.0023697 k( 278) = ( 0.4526316 0.4526316 0.4526316), wk = 0.0023697 k( 279) = ( 0.4578947 0.4578947 0.4578947), wk = 0.0023697 k( 280) = ( 0.4631579 0.4631579 0.4631579), wk = 0.0023697 k( 281) = ( 0.4684211 0.4684210 0.4684210), wk = 0.0023697 k( 282) = ( 0.4736842 0.4736842 0.4736842), wk = 0.0023697 k( 283) = ( 0.4789474 0.4789474 0.4789474), wk = 0.0023697 k( 284) = ( 0.4842105 0.4842105 0.4842105), wk = 0.0023697 k( 285) = ( 0.4894737 0.4894737 0.4894737), wk = 0.0023697 k( 286) = ( 0.4947368 0.4947368 0.4947368), wk = 0.0023697 k( 287) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023697 k( 288) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023697 k( 289) = ( 0.4935897 0.5000000 0.4935897), wk = 0.0023697 k( 290) = ( 0.4871795 0.5000000 0.4871795), wk = 0.0023697 k( 291) = ( 0.4807692 0.5000000 0.4807692), wk = 0.0023697 k( 292) = ( 0.4743590 0.5000000 0.4743590), wk = 0.0023697 k( 293) = ( 0.4679487 0.5000000 0.4679487), wk = 0.0023697 k( 294) = ( 0.4615385 0.5000000 0.4615385), wk = 0.0023697 k( 295) = ( 0.4551282 0.5000000 0.4551282), wk = 0.0023697 k( 296) = ( 0.4487179 0.5000000 0.4487179), wk = 0.0023697 k( 297) = ( 0.4423077 0.5000000 0.4423077), wk = 0.0023697 k( 298) = ( 0.4358974 0.5000000 0.4358974), wk = 0.0023697 k( 299) = ( 0.4294872 0.5000000 0.4294872), wk = 0.0023697 k( 300) = ( 0.4230769 0.5000000 0.4230769), wk = 0.0023697 k( 301) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0023697 k( 302) = ( 0.4102564 0.5000000 0.4102564), wk = 0.0023697 k( 303) = ( 0.4038462 0.5000000 0.4038461), wk = 0.0023697 k( 304) = ( 0.3974359 0.5000000 0.3974359), wk = 0.0023697 k( 305) = ( 0.3910256 0.5000000 0.3910256), wk = 0.0023697 k( 306) = ( 0.3846154 0.5000000 0.3846154), wk = 0.0023697 k( 307) = ( 0.3782051 0.5000000 0.3782051), wk = 0.0023697 k( 308) = ( 0.3717949 0.5000000 0.3717949), wk = 0.0023697 k( 309) = ( 0.3653846 0.5000000 0.3653846), wk = 0.0023697 k( 310) = ( 0.3589744 0.5000000 0.3589744), wk = 0.0023697 k( 311) = ( 0.3525641 0.5000000 0.3525641), wk = 0.0023697 k( 312) = ( 0.3461538 0.5000000 0.3461538), wk = 0.0023697 k( 313) = ( 0.3397436 0.5000000 0.3397436), wk = 0.0023697 k( 314) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0023697 k( 315) = ( 0.3269231 0.5000000 0.3269231), wk = 0.0023697 k( 316) = ( 0.3205128 0.5000000 0.3205128), wk = 0.0023697 k( 317) = ( 0.3141026 0.5000000 0.3141026), wk = 0.0023697 k( 318) = ( 0.3076923 0.5000000 0.3076923), wk = 0.0023697 k( 319) = ( 0.3012821 0.5000000 0.3012820), wk = 0.0023697 k( 320) = ( 0.2948718 0.5000000 0.2948718), wk = 0.0023697 k( 321) = ( 0.2884615 0.5000000 0.2884615), wk = 0.0023697 k( 322) = ( 0.2820513 0.5000000 0.2820513), wk = 0.0023697 k( 323) = ( 0.2756410 0.5000000 0.2756410), wk = 0.0023697 k( 324) = ( 0.2692308 0.5000000 0.2692308), wk = 0.0023697 k( 325) = ( 0.2628205 0.5000000 0.2628205), wk = 0.0023697 k( 326) = ( 0.2564103 0.5000000 0.2564103), wk = 0.0023697 k( 327) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0023697 k( 328) = ( 0.2435897 0.5000000 0.2435897), wk = 0.0023697 k( 329) = ( 0.2371795 0.5000000 0.2371795), wk = 0.0023697 k( 330) = ( 0.2307692 0.5000000 0.2307692), wk = 0.0023697 k( 331) = ( 0.2243590 0.5000000 0.2243590), wk = 0.0023697 k( 332) = ( 0.2179487 0.5000000 0.2179487), wk = 0.0023697 k( 333) = ( 0.2115385 0.5000000 0.2115385), wk = 0.0023697 k( 334) = ( 0.2051282 0.5000000 0.2051282), wk = 0.0023697 k( 335) = ( 0.1987180 0.5000000 0.1987179), wk = 0.0023697 k( 336) = ( 0.1923077 0.5000000 0.1923077), wk = 0.0023697 k( 337) = ( 0.1858974 0.5000000 0.1858974), wk = 0.0023697 k( 338) = ( 0.1794872 0.5000000 0.1794872), wk = 0.0023697 k( 339) = ( 0.1730769 0.5000000 0.1730769), wk = 0.0023697 k( 340) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0023697 k( 341) = ( 0.1602564 0.5000000 0.1602564), wk = 0.0023697 k( 342) = ( 0.1538461 0.5000000 0.1538461), wk = 0.0023697 k( 343) = ( 0.1474359 0.5000000 0.1474359), wk = 0.0023697 k( 344) = ( 0.1410256 0.5000000 0.1410256), wk = 0.0023697 k( 345) = ( 0.1346154 0.5000000 0.1346154), wk = 0.0023697 k( 346) = ( 0.1282051 0.5000000 0.1282051), wk = 0.0023697 k( 347) = ( 0.1217949 0.5000000 0.1217949), wk = 0.0023697 k( 348) = ( 0.1153846 0.5000000 0.1153846), wk = 0.0023697 k( 349) = ( 0.1089744 0.5000000 0.1089744), wk = 0.0023697 k( 350) = ( 0.1025641 0.5000000 0.1025641), wk = 0.0023697 k( 351) = ( 0.0961538 0.5000000 0.0961538), wk = 0.0023697 k( 352) = ( 0.0897436 0.5000000 0.0897436), wk = 0.0023697 k( 353) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0023697 k( 354) = ( 0.0769231 0.5000000 0.0769231), wk = 0.0023697 k( 355) = ( 0.0705128 0.5000000 0.0705128), wk = 0.0023697 k( 356) = ( 0.0641026 0.5000000 0.0641026), wk = 0.0023697 k( 357) = ( 0.0576923 0.5000000 0.0576923), wk = 0.0023697 k( 358) = ( 0.0512821 0.5000000 0.0512820), wk = 0.0023697 k( 359) = ( 0.0448718 0.5000000 0.0448718), wk = 0.0023697 k( 360) = ( 0.0384615 0.5000000 0.0384615), wk = 0.0023697 k( 361) = ( 0.0320513 0.5000000 0.0320513), wk = 0.0023697 k( 362) = ( 0.0256410 0.5000000 0.0256410), wk = 0.0023697 k( 363) = ( 0.0192308 0.5000000 0.0192308), wk = 0.0023697 k( 364) = ( 0.0128205 0.5000000 0.0128205), wk = 0.0023697 k( 365) = ( 0.0064103 0.5000000 0.0064103), wk = 0.0023697 k( 366) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023697 k( 367) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023697 k( 368) = ( 0.5000000 0.5000000 0.0090909), wk = 0.0023697 k( 369) = ( 0.5000000 0.5000000 0.0181818), wk = 0.0023697 k( 370) = ( 0.5000000 0.5000000 0.0272727), wk = 0.0023697 k( 371) = ( 0.5000000 0.5000000 0.0363636), wk = 0.0023697 k( 372) = ( 0.5000000 0.5000000 0.0454545), wk = 0.0023697 k( 373) = ( 0.5000000 0.5000000 0.0545454), wk = 0.0023697 k( 374) = ( 0.5000000 0.5000000 0.0636364), wk = 0.0023697 k( 375) = ( 0.5000000 0.5000000 0.0727273), wk = 0.0023697 k( 376) = ( 0.5000000 0.5000000 0.0818182), wk = 0.0023697 k( 377) = ( 0.5000000 0.5000000 0.0909091), wk = 0.0023697 k( 378) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0023697 k( 379) = ( 0.5000000 0.5000000 0.1090909), wk = 0.0023697 k( 380) = ( 0.5000000 0.5000000 0.1181818), wk = 0.0023697 k( 381) = ( 0.5000000 0.5000000 0.1272727), wk = 0.0023697 k( 382) = ( 0.5000000 0.5000000 0.1363636), wk = 0.0023697 k( 383) = ( 0.5000000 0.5000000 0.1454545), wk = 0.0023697 k( 384) = ( 0.5000000 0.5000000 0.1545454), wk = 0.0023697 k( 385) = ( 0.5000000 0.5000000 0.1636364), wk = 0.0023697 k( 386) = ( 0.5000000 0.5000000 0.1727273), wk = 0.0023697 k( 387) = ( 0.5000000 0.5000000 0.1818182), wk = 0.0023697 k( 388) = ( 0.5000000 0.5000000 0.1909091), wk = 0.0023697 k( 389) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0023697 k( 390) = ( 0.5000000 0.5000000 0.2090909), wk = 0.0023697 k( 391) = ( 0.5000000 0.5000000 0.2181818), wk = 0.0023697 k( 392) = ( 0.5000000 0.5000000 0.2272727), wk = 0.0023697 k( 393) = ( 0.5000000 0.5000000 0.2363636), wk = 0.0023697 k( 394) = ( 0.5000000 0.5000000 0.2454545), wk = 0.0023697 k( 395) = ( 0.5000000 0.5000000 0.2545454), wk = 0.0023697 k( 396) = ( 0.5000000 0.5000000 0.2636364), wk = 0.0023697 k( 397) = ( 0.5000000 0.5000000 0.2727273), wk = 0.0023697 k( 398) = ( 0.5000000 0.5000000 0.2818182), wk = 0.0023697 k( 399) = ( 0.5000000 0.5000000 0.2909091), wk = 0.0023697 k( 400) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0023697 k( 401) = ( 0.5000000 0.5000000 0.3090909), wk = 0.0023697 k( 402) = ( 0.5000000 0.5000000 0.3181818), wk = 0.0023697 k( 403) = ( 0.5000000 0.5000000 0.3272727), wk = 0.0023697 k( 404) = ( 0.5000000 0.5000000 0.3363636), wk = 0.0023697 k( 405) = ( 0.5000000 0.5000000 0.3454545), wk = 0.0023697 k( 406) = ( 0.5000000 0.5000000 0.3545454), wk = 0.0023697 k( 407) = ( 0.5000000 0.5000000 0.3636364), wk = 0.0023697 k( 408) = ( 0.5000000 0.5000000 0.3727273), wk = 0.0023697 k( 409) = ( 0.5000000 0.5000000 0.3818182), wk = 0.0023697 k( 410) = ( 0.5000000 0.5000000 0.3909091), wk = 0.0023697 k( 411) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0023697 k( 412) = ( 0.5000000 0.5000000 0.4090909), wk = 0.0023697 k( 413) = ( 0.5000000 0.5000000 0.4181818), wk = 0.0023697 k( 414) = ( 0.5000000 0.5000000 0.4272727), wk = 0.0023697 k( 415) = ( 0.5000000 0.5000000 0.4363636), wk = 0.0023697 k( 416) = ( 0.5000000 0.5000000 0.4454545), wk = 0.0023697 k( 417) = ( 0.5000000 0.5000000 0.4545454), wk = 0.0023697 k( 418) = ( 0.5000000 0.5000000 0.4636364), wk = 0.0023697 k( 419) = ( 0.5000000 0.5000000 0.4727273), wk = 0.0023697 k( 420) = ( 0.5000000 0.5000000 0.4818182), wk = 0.0023697 k( 421) = ( 0.5000000 0.5000000 0.4909091), wk = 0.0023697 k( 422) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023697 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023697 k( 2) = ( 0.0000000 0.0090909 0.0000000), wk = 0.0023697 k( 3) = ( 0.0000000 0.0181818 0.0000000), wk = 0.0023697 k( 4) = ( 0.0000000 0.0272727 0.0000000), wk = 0.0023697 k( 5) = ( 0.0000000 0.0363636 0.0000000), wk = 0.0023697 k( 6) = ( 0.0000000 0.0454546 0.0000000), wk = 0.0023697 k( 7) = ( 0.0000000 0.0545455 0.0000000), wk = 0.0023697 k( 8) = ( 0.0000000 0.0636364 0.0000000), wk = 0.0023697 k( 9) = ( 0.0000000 0.0727273 0.0000000), wk = 0.0023697 k( 10) = ( 0.0000000 0.0818182 0.0000000), wk = 0.0023697 k( 11) = ( 0.0000000 0.0909091 0.0000000), wk = 0.0023697 k( 12) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0023697 k( 13) = ( 0.0000000 0.1090909 0.0000000), wk = 0.0023697 k( 14) = ( 0.0000000 0.1181818 0.0000000), wk = 0.0023697 k( 15) = ( 0.0000000 0.1272727 0.0000000), wk = 0.0023697 k( 16) = ( 0.0000000 0.1363636 0.0000000), wk = 0.0023697 k( 17) = ( 0.0000000 0.1454545 0.0000000), wk = 0.0023697 k( 18) = ( 0.0000000 0.1545455 0.0000000), wk = 0.0023697 k( 19) = ( 0.0000000 0.1636364 0.0000000), wk = 0.0023697 k( 20) = ( 0.0000000 0.1727273 0.0000000), wk = 0.0023697 k( 21) = ( 0.0000000 0.1818182 0.0000000), wk = 0.0023697 k( 22) = ( 0.0000000 0.1909091 0.0000000), wk = 0.0023697 k( 23) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0023697 k( 24) = ( 0.0000000 0.2090909 0.0000000), wk = 0.0023697 k( 25) = ( 0.0000000 0.2181818 0.0000000), wk = 0.0023697 k( 26) = ( 0.0000000 0.2272727 0.0000000), wk = 0.0023697 k( 27) = ( 0.0000000 0.2363636 0.0000000), wk = 0.0023697 k( 28) = ( 0.0000000 0.2454545 0.0000000), wk = 0.0023697 k( 29) = ( 0.0000000 0.2545455 0.0000000), wk = 0.0023697 k( 30) = ( 0.0000000 0.2636364 0.0000000), wk = 0.0023697 k( 31) = ( 0.0000000 0.2727273 0.0000000), wk = 0.0023697 k( 32) = ( 0.0000000 0.2818182 0.0000000), wk = 0.0023697 k( 33) = ( 0.0000000 0.2909091 0.0000000), wk = 0.0023697 k( 34) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0023697 k( 35) = ( 0.0000000 0.3090909 0.0000000), wk = 0.0023697 k( 36) = ( 0.0000000 0.3181818 0.0000000), wk = 0.0023697 k( 37) = ( 0.0000000 0.3272727 0.0000000), wk = 0.0023697 k( 38) = ( 0.0000000 0.3363636 0.0000000), wk = 0.0023697 k( 39) = ( 0.0000000 0.3454546 0.0000000), wk = 0.0023697 k( 40) = ( 0.0000000 0.3545454 0.0000000), wk = 0.0023697 k( 41) = ( 0.0000000 0.3636364 0.0000000), wk = 0.0023697 k( 42) = ( 0.0000000 0.3727273 0.0000000), wk = 0.0023697 k( 43) = ( 0.0000000 0.3818182 0.0000000), wk = 0.0023697 k( 44) = ( 0.0000000 0.3909091 0.0000000), wk = 0.0023697 k( 45) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0023697 k( 46) = ( 0.0000000 0.4090909 0.0000000), wk = 0.0023697 k( 47) = ( 0.0000000 0.4181818 0.0000000), wk = 0.0023697 k( 48) = ( 0.0000000 0.4272727 0.0000000), wk = 0.0023697 k( 49) = ( 0.0000000 0.4363636 0.0000000), wk = 0.0023697 k( 50) = ( 0.0000000 0.4454546 0.0000000), wk = 0.0023697 k( 51) = ( 0.0000000 0.4545455 0.0000000), wk = 0.0023697 k( 52) = ( 0.0000000 0.4636364 0.0000000), wk = 0.0023697 k( 53) = ( 0.0000000 0.4727273 0.0000000), wk = 0.0023697 k( 54) = ( 0.0000000 0.4818182 0.0000000), wk = 0.0023697 k( 55) = ( 0.0000000 0.4909091 0.0000000), wk = 0.0023697 k( 56) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023697 k( 57) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023697 k( 58) = ( 0.0090909 0.5000000 0.0000000), wk = 0.0023697 k( 59) = ( 0.0181818 0.5000000 0.0000000), wk = 0.0023697 k( 60) = ( 0.0272727 0.5000000 0.0000000), wk = 0.0023697 k( 61) = ( 0.0363636 0.5000000 0.0000000), wk = 0.0023697 k( 62) = ( 0.0454546 0.5000000 0.0000000), wk = 0.0023697 k( 63) = ( 0.0545455 0.5000000 0.0000000), wk = 0.0023697 k( 64) = ( 0.0636364 0.5000000 0.0000000), wk = 0.0023697 k( 65) = ( 0.0727273 0.5000000 0.0000000), wk = 0.0023697 k( 66) = ( 0.0818182 0.5000000 0.0000000), wk = 0.0023697 k( 67) = ( 0.0909091 0.5000000 0.0000000), wk = 0.0023697 k( 68) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0023697 k( 69) = ( 0.1090909 0.5000000 0.0000000), wk = 0.0023697 k( 70) = ( 0.1181818 0.5000000 0.0000000), wk = 0.0023697 k( 71) = ( 0.1272727 0.5000000 0.0000000), wk = 0.0023697 k( 72) = ( 0.1363636 0.5000000 0.0000000), wk = 0.0023697 k( 73) = ( 0.1454545 0.5000000 0.0000000), wk = 0.0023697 k( 74) = ( 0.1545455 0.5000000 0.0000000), wk = 0.0023697 k( 75) = ( 0.1636364 0.5000000 0.0000000), wk = 0.0023697 k( 76) = ( 0.1727273 0.5000000 0.0000000), wk = 0.0023697 k( 77) = ( 0.1818182 0.5000000 0.0000000), wk = 0.0023697 k( 78) = ( 0.1909091 0.5000000 0.0000000), wk = 0.0023697 k( 79) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0023697 k( 80) = ( 0.2090909 0.5000000 0.0000000), wk = 0.0023697 k( 81) = ( 0.2181818 0.5000000 0.0000000), wk = 0.0023697 k( 82) = ( 0.2272727 0.5000000 0.0000000), wk = 0.0023697 k( 83) = ( 0.2363636 0.5000000 0.0000000), wk = 0.0023697 k( 84) = ( 0.2454545 0.5000000 0.0000000), wk = 0.0023697 k( 85) = ( 0.2545455 0.5000000 0.0000000), wk = 0.0023697 k( 86) = ( 0.2636364 0.5000000 0.0000000), wk = 0.0023697 k( 87) = ( 0.2727273 0.5000000 0.0000000), wk = 0.0023697 k( 88) = ( 0.2818182 0.5000000 0.0000000), wk = 0.0023697 k( 89) = ( 0.2909091 0.5000000 0.0000000), wk = 0.0023697 k( 90) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0023697 k( 91) = ( 0.3090909 0.5000000 0.0000000), wk = 0.0023697 k( 92) = ( 0.3181818 0.5000000 0.0000000), wk = 0.0023697 k( 93) = ( 0.3272727 0.5000000 0.0000000), wk = 0.0023697 k( 94) = ( 0.3363636 0.5000000 -0.0000000), wk = 0.0023697 k( 95) = ( 0.3454546 0.5000000 0.0000000), wk = 0.0023697 k( 96) = ( 0.3545454 0.5000000 0.0000000), wk = 0.0023697 k( 97) = ( 0.3636364 0.5000000 0.0000000), wk = 0.0023697 k( 98) = ( 0.3727273 0.5000000 0.0000000), wk = 0.0023697 k( 99) = ( 0.3818182 0.5000000 0.0000000), wk = 0.0023697 k( 100) = ( 0.3909091 0.5000000 0.0000000), wk = 0.0023697 k( 101) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0023697 k( 102) = ( 0.4090909 0.5000000 0.0000000), wk = 0.0023697 k( 103) = ( 0.4181818 0.5000000 -0.0000000), wk = 0.0023697 k( 104) = ( 0.4272727 0.5000000 0.0000000), wk = 0.0023697 k( 105) = ( 0.4363636 0.5000000 0.0000000), wk = 0.0023697 k( 106) = ( 0.4454546 0.5000000 0.0000000), wk = 0.0023697 k( 107) = ( 0.4545455 0.5000000 0.0000000), wk = 0.0023697 k( 108) = ( 0.4636364 0.5000000 0.0000000), wk = 0.0023697 k( 109) = ( 0.4727273 0.5000000 0.0000000), wk = 0.0023697 k( 110) = ( 0.4818182 0.5000000 0.0000000), wk = 0.0023697 k( 111) = ( 0.4909091 0.5000000 0.0000000), wk = 0.0023697 k( 112) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023697 k( 113) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023697 k( 114) = ( 0.4935897 0.4935897 0.0000000), wk = 0.0023697 k( 115) = ( 0.4871795 0.4871795 0.0000000), wk = 0.0023697 k( 116) = ( 0.4807692 0.4807692 0.0000000), wk = 0.0023697 k( 117) = ( 0.4743590 0.4743590 0.0000000), wk = 0.0023697 k( 118) = ( 0.4679487 0.4679487 0.0000000), wk = 0.0023697 k( 119) = ( 0.4615385 0.4615385 0.0000000), wk = 0.0023697 k( 120) = ( 0.4551282 0.4551282 0.0000000), wk = 0.0023697 k( 121) = ( 0.4487179 0.4487179 0.0000000), wk = 0.0023697 k( 122) = ( 0.4423077 0.4423077 0.0000000), wk = 0.0023697 k( 123) = ( 0.4358974 0.4358974 0.0000000), wk = 0.0023697 k( 124) = ( 0.4294872 0.4294872 0.0000000), wk = 0.0023697 k( 125) = ( 0.4230769 0.4230769 0.0000000), wk = 0.0023697 k( 126) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0023697 k( 127) = ( 0.4102564 0.4102564 0.0000000), wk = 0.0023697 k( 128) = ( 0.4038462 0.4038462 0.0000000), wk = 0.0023697 k( 129) = ( 0.3974359 0.3974359 0.0000000), wk = 0.0023697 k( 130) = ( 0.3910256 0.3910256 0.0000000), wk = 0.0023697 k( 131) = ( 0.3846154 0.3846154 0.0000000), wk = 0.0023697 k( 132) = ( 0.3782051 0.3782051 0.0000000), wk = 0.0023697 k( 133) = ( 0.3717949 0.3717949 0.0000000), wk = 0.0023697 k( 134) = ( 0.3653846 0.3653846 0.0000000), wk = 0.0023697 k( 135) = ( 0.3589744 0.3589744 0.0000000), wk = 0.0023697 k( 136) = ( 0.3525641 0.3525641 0.0000000), wk = 0.0023697 k( 137) = ( 0.3461538 0.3461538 0.0000000), wk = 0.0023697 k( 138) = ( 0.3397436 0.3397436 0.0000000), wk = 0.0023697 k( 139) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0023697 k( 140) = ( 0.3269231 0.3269231 0.0000000), wk = 0.0023697 k( 141) = ( 0.3205128 0.3205128 0.0000000), wk = 0.0023697 k( 142) = ( 0.3141026 0.3141026 0.0000000), wk = 0.0023697 k( 143) = ( 0.3076923 0.3076923 0.0000000), wk = 0.0023697 k( 144) = ( 0.3012821 0.3012821 0.0000000), wk = 0.0023697 k( 145) = ( 0.2948718 0.2948718 0.0000000), wk = 0.0023697 k( 146) = ( 0.2884615 0.2884615 0.0000000), wk = 0.0023697 k( 147) = ( 0.2820513 0.2820513 0.0000000), wk = 0.0023697 k( 148) = ( 0.2756410 0.2756410 0.0000000), wk = 0.0023697 k( 149) = ( 0.2692308 0.2692308 0.0000000), wk = 0.0023697 k( 150) = ( 0.2628205 0.2628205 0.0000000), wk = 0.0023697 k( 151) = ( 0.2564103 0.2564103 0.0000000), wk = 0.0023697 k( 152) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0023697 k( 153) = ( 0.2435897 0.2435897 0.0000000), wk = 0.0023697 k( 154) = ( 0.2371795 0.2371795 0.0000000), wk = 0.0023697 k( 155) = ( 0.2307692 0.2307692 0.0000000), wk = 0.0023697 k( 156) = ( 0.2243590 0.2243590 0.0000000), wk = 0.0023697 k( 157) = ( 0.2179487 0.2179487 0.0000000), wk = 0.0023697 k( 158) = ( 0.2115385 0.2115385 0.0000000), wk = 0.0023697 k( 159) = ( 0.2051282 0.2051282 0.0000000), wk = 0.0023697 k( 160) = ( 0.1987180 0.1987180 0.0000000), wk = 0.0023697 k( 161) = ( 0.1923077 0.1923077 0.0000000), wk = 0.0023697 k( 162) = ( 0.1858974 0.1858974 0.0000000), wk = 0.0023697 k( 163) = ( 0.1794872 0.1794872 0.0000000), wk = 0.0023697 k( 164) = ( 0.1730769 0.1730769 0.0000000), wk = 0.0023697 k( 165) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0023697 k( 166) = ( 0.1602564 0.1602564 0.0000000), wk = 0.0023697 k( 167) = ( 0.1538461 0.1538461 0.0000000), wk = 0.0023697 k( 168) = ( 0.1474359 0.1474359 0.0000000), wk = 0.0023697 k( 169) = ( 0.1410256 0.1410256 0.0000000), wk = 0.0023697 k( 170) = ( 0.1346154 0.1346154 0.0000000), wk = 0.0023697 k( 171) = ( 0.1282051 0.1282051 0.0000000), wk = 0.0023697 k( 172) = ( 0.1217949 0.1217949 0.0000000), wk = 0.0023697 k( 173) = ( 0.1153846 0.1153846 0.0000000), wk = 0.0023697 k( 174) = ( 0.1089744 0.1089744 0.0000000), wk = 0.0023697 k( 175) = ( 0.1025641 0.1025641 0.0000000), wk = 0.0023697 k( 176) = ( 0.0961538 0.0961538 0.0000000), wk = 0.0023697 k( 177) = ( 0.0897436 0.0897436 0.0000000), wk = 0.0023697 k( 178) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0023697 k( 179) = ( 0.0769231 0.0769231 0.0000000), wk = 0.0023697 k( 180) = ( 0.0705128 0.0705128 0.0000000), wk = 0.0023697 k( 181) = ( 0.0641026 0.0641026 0.0000000), wk = 0.0023697 k( 182) = ( 0.0576923 0.0576923 0.0000000), wk = 0.0023697 k( 183) = ( 0.0512821 0.0512821 0.0000000), wk = 0.0023697 k( 184) = ( 0.0448718 0.0448718 0.0000000), wk = 0.0023697 k( 185) = ( 0.0384615 0.0384615 0.0000000), wk = 0.0023697 k( 186) = ( 0.0320513 0.0320513 0.0000000), wk = 0.0023697 k( 187) = ( 0.0256410 0.0256410 0.0000000), wk = 0.0023697 k( 188) = ( 0.0192308 0.0192308 0.0000000), wk = 0.0023697 k( 189) = ( 0.0128205 0.0128205 0.0000000), wk = 0.0023697 k( 190) = ( 0.0064103 0.0064103 0.0000000), wk = 0.0023697 k( 191) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023697 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023697 k( 193) = ( 0.0052632 0.0052632 0.0052632), wk = 0.0023697 k( 194) = ( 0.0105263 0.0105263 0.0105263), wk = 0.0023697 k( 195) = ( 0.0157895 0.0157895 0.0157895), wk = 0.0023697 k( 196) = ( 0.0210526 0.0210526 0.0210526), wk = 0.0023697 k( 197) = ( 0.0263158 0.0263158 0.0263158), wk = 0.0023697 k( 198) = ( 0.0315790 0.0315790 0.0315790), wk = 0.0023697 k( 199) = ( 0.0368421 0.0368421 0.0368421), wk = 0.0023697 k( 200) = ( 0.0421053 0.0421053 0.0421053), wk = 0.0023697 k( 201) = ( 0.0473684 0.0473684 0.0473684), wk = 0.0023697 k( 202) = ( 0.0526316 0.0526316 0.0526316), wk = 0.0023697 k( 203) = ( 0.0578947 0.0578947 0.0578947), wk = 0.0023697 k( 204) = ( 0.0631579 0.0631579 0.0631579), wk = 0.0023697 k( 205) = ( 0.0684210 0.0684210 0.0684210), wk = 0.0023697 k( 206) = ( 0.0736842 0.0736842 0.0736842), wk = 0.0023697 k( 207) = ( 0.0789474 0.0789474 0.0789474), wk = 0.0023697 k( 208) = ( 0.0842105 0.0842105 0.0842105), wk = 0.0023697 k( 209) = ( 0.0894737 0.0894737 0.0894737), wk = 0.0023697 k( 210) = ( 0.0947368 0.0947368 0.0947368), wk = 0.0023697 k( 211) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0023697 k( 212) = ( 0.1052632 0.1052632 0.1052632), wk = 0.0023697 k( 213) = ( 0.1105263 0.1105263 0.1105263), wk = 0.0023697 k( 214) = ( 0.1157895 0.1157895 0.1157895), wk = 0.0023697 k( 215) = ( 0.1210526 0.1210526 0.1210526), wk = 0.0023697 k( 216) = ( 0.1263158 0.1263158 0.1263158), wk = 0.0023697 k( 217) = ( 0.1315790 0.1315790 0.1315790), wk = 0.0023697 k( 218) = ( 0.1368421 0.1368421 0.1368421), wk = 0.0023697 k( 219) = ( 0.1421053 0.1421053 0.1421053), wk = 0.0023697 k( 220) = ( 0.1473684 0.1473684 0.1473684), wk = 0.0023697 k( 221) = ( 0.1526316 0.1526316 0.1526316), wk = 0.0023697 k( 222) = ( 0.1578947 0.1578947 0.1578947), wk = 0.0023697 k( 223) = ( 0.1631579 0.1631579 0.1631579), wk = 0.0023697 k( 224) = ( 0.1684210 0.1684210 0.1684210), wk = 0.0023697 k( 225) = ( 0.1736842 0.1736842 0.1736842), wk = 0.0023697 k( 226) = ( 0.1789474 0.1789474 0.1789474), wk = 0.0023697 k( 227) = ( 0.1842105 0.1842105 0.1842105), wk = 0.0023697 k( 228) = ( 0.1894737 0.1894737 0.1894737), wk = 0.0023697 k( 229) = ( 0.1947368 0.1947368 0.1947368), wk = 0.0023697 k( 230) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0023697 k( 231) = ( 0.2052632 0.2052632 0.2052632), wk = 0.0023697 k( 232) = ( 0.2105263 0.2105263 0.2105263), wk = 0.0023697 k( 233) = ( 0.2157895 0.2157895 0.2157895), wk = 0.0023697 k( 234) = ( 0.2210526 0.2210526 0.2210526), wk = 0.0023697 k( 235) = ( 0.2263158 0.2263158 0.2263158), wk = 0.0023697 k( 236) = ( 0.2315790 0.2315790 0.2315790), wk = 0.0023697 k( 237) = ( 0.2368421 0.2368421 0.2368421), wk = 0.0023697 k( 238) = ( 0.2421053 0.2421053 0.2421053), wk = 0.0023697 k( 239) = ( 0.2473684 0.2473684 0.2473684), wk = 0.0023697 k( 240) = ( 0.2526316 0.2526316 0.2526316), wk = 0.0023697 k( 241) = ( 0.2578947 0.2578947 0.2578947), wk = 0.0023697 k( 242) = ( 0.2631579 0.2631579 0.2631579), wk = 0.0023697 k( 243) = ( 0.2684210 0.2684210 0.2684210), wk = 0.0023697 k( 244) = ( 0.2736842 0.2736842 0.2736842), wk = 0.0023697 k( 245) = ( 0.2789474 0.2789474 0.2789474), wk = 0.0023697 k( 246) = ( 0.2842105 0.2842105 0.2842105), wk = 0.0023697 k( 247) = ( 0.2894737 0.2894737 0.2894737), wk = 0.0023697 k( 248) = ( 0.2947368 0.2947368 0.2947368), wk = 0.0023697 k( 249) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0023697 k( 250) = ( 0.3052632 0.3052632 0.3052632), wk = 0.0023697 k( 251) = ( 0.3105263 0.3105263 0.3105263), wk = 0.0023697 k( 252) = ( 0.3157895 0.3157895 0.3157895), wk = 0.0023697 k( 253) = ( 0.3210526 0.3210526 0.3210526), wk = 0.0023697 k( 254) = ( 0.3263158 0.3263158 0.3263158), wk = 0.0023697 k( 255) = ( 0.3315789 0.3315789 0.3315789), wk = 0.0023697 k( 256) = ( 0.3368421 0.3368421 0.3368421), wk = 0.0023697 k( 257) = ( 0.3421053 0.3421053 0.3421053), wk = 0.0023697 k( 258) = ( 0.3473684 0.3473684 0.3473684), wk = 0.0023697 k( 259) = ( 0.3526316 0.3526316 0.3526316), wk = 0.0023697 k( 260) = ( 0.3578947 0.3578947 0.3578947), wk = 0.0023697 k( 261) = ( 0.3631579 0.3631579 0.3631579), wk = 0.0023697 k( 262) = ( 0.3684211 0.3684211 0.3684211), wk = 0.0023697 k( 263) = ( 0.3736842 0.3736842 0.3736842), wk = 0.0023697 k( 264) = ( 0.3789474 0.3789474 0.3789474), wk = 0.0023697 k( 265) = ( 0.3842105 0.3842105 0.3842105), wk = 0.0023697 k( 266) = ( 0.3894737 0.3894737 0.3894737), wk = 0.0023697 k( 267) = ( 0.3947368 0.3947368 0.3947368), wk = 0.0023697 k( 268) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0023697 k( 269) = ( 0.4052632 0.4052632 0.4052632), wk = 0.0023697 k( 270) = ( 0.4105263 0.4105263 0.4105263), wk = 0.0023697 k( 271) = ( 0.4157895 0.4157895 0.4157895), wk = 0.0023697 k( 272) = ( 0.4210526 0.4210526 0.4210526), wk = 0.0023697 k( 273) = ( 0.4263158 0.4263158 0.4263158), wk = 0.0023697 k( 274) = ( 0.4315790 0.4315790 0.4315790), wk = 0.0023697 k( 275) = ( 0.4368421 0.4368421 0.4368421), wk = 0.0023697 k( 276) = ( 0.4421053 0.4421053 0.4421053), wk = 0.0023697 k( 277) = ( 0.4473684 0.4473684 0.4473684), wk = 0.0023697 k( 278) = ( 0.4526316 0.4526316 0.4526316), wk = 0.0023697 k( 279) = ( 0.4578947 0.4578947 0.4578947), wk = 0.0023697 k( 280) = ( 0.4631579 0.4631579 0.4631579), wk = 0.0023697 k( 281) = ( 0.4684211 0.4684211 0.4684211), wk = 0.0023697 k( 282) = ( 0.4736842 0.4736842 0.4736842), wk = 0.0023697 k( 283) = ( 0.4789474 0.4789474 0.4789474), wk = 0.0023697 k( 284) = ( 0.4842105 0.4842105 0.4842105), wk = 0.0023697 k( 285) = ( 0.4894737 0.4894737 0.4894737), wk = 0.0023697 k( 286) = ( 0.4947368 0.4947368 0.4947368), wk = 0.0023697 k( 287) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023697 k( 288) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023697 k( 289) = ( 0.4935897 0.5000000 0.4935897), wk = 0.0023697 k( 290) = ( 0.4871795 0.5000000 0.4871795), wk = 0.0023697 k( 291) = ( 0.4807692 0.5000000 0.4807692), wk = 0.0023697 k( 292) = ( 0.4743590 0.5000000 0.4743590), wk = 0.0023697 k( 293) = ( 0.4679487 0.5000000 0.4679487), wk = 0.0023697 k( 294) = ( 0.4615385 0.5000000 0.4615385), wk = 0.0023697 k( 295) = ( 0.4551282 0.5000000 0.4551282), wk = 0.0023697 k( 296) = ( 0.4487179 0.5000000 0.4487179), wk = 0.0023697 k( 297) = ( 0.4423077 0.5000000 0.4423077), wk = 0.0023697 k( 298) = ( 0.4358974 0.5000000 0.4358974), wk = 0.0023697 k( 299) = ( 0.4294872 0.5000000 0.4294872), wk = 0.0023697 k( 300) = ( 0.4230769 0.5000000 0.4230769), wk = 0.0023697 k( 301) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0023697 k( 302) = ( 0.4102564 0.5000000 0.4102564), wk = 0.0023697 k( 303) = ( 0.4038462 0.5000000 0.4038462), wk = 0.0023697 k( 304) = ( 0.3974359 0.5000000 0.3974359), wk = 0.0023697 k( 305) = ( 0.3910256 0.5000000 0.3910256), wk = 0.0023697 k( 306) = ( 0.3846154 0.5000000 0.3846154), wk = 0.0023697 k( 307) = ( 0.3782051 0.5000000 0.3782051), wk = 0.0023697 k( 308) = ( 0.3717949 0.5000000 0.3717949), wk = 0.0023697 k( 309) = ( 0.3653846 0.5000000 0.3653846), wk = 0.0023697 k( 310) = ( 0.3589744 0.5000000 0.3589744), wk = 0.0023697 k( 311) = ( 0.3525641 0.5000000 0.3525641), wk = 0.0023697 k( 312) = ( 0.3461538 0.5000000 0.3461538), wk = 0.0023697 k( 313) = ( 0.3397436 0.5000000 0.3397436), wk = 0.0023697 k( 314) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0023697 k( 315) = ( 0.3269231 0.5000000 0.3269231), wk = 0.0023697 k( 316) = ( 0.3205128 0.5000000 0.3205128), wk = 0.0023697 k( 317) = ( 0.3141026 0.5000000 0.3141026), wk = 0.0023697 k( 318) = ( 0.3076923 0.5000000 0.3076923), wk = 0.0023697 k( 319) = ( 0.3012821 0.5000000 0.3012821), wk = 0.0023697 k( 320) = ( 0.2948718 0.5000000 0.2948718), wk = 0.0023697 k( 321) = ( 0.2884615 0.5000000 0.2884615), wk = 0.0023697 k( 322) = ( 0.2820513 0.5000000 0.2820513), wk = 0.0023697 k( 323) = ( 0.2756410 0.5000000 0.2756410), wk = 0.0023697 k( 324) = ( 0.2692308 0.5000000 0.2692308), wk = 0.0023697 k( 325) = ( 0.2628205 0.5000000 0.2628205), wk = 0.0023697 k( 326) = ( 0.2564103 0.5000000 0.2564103), wk = 0.0023697 k( 327) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0023697 k( 328) = ( 0.2435897 0.5000000 0.2435897), wk = 0.0023697 k( 329) = ( 0.2371795 0.5000000 0.2371795), wk = 0.0023697 k( 330) = ( 0.2307692 0.5000000 0.2307692), wk = 0.0023697 k( 331) = ( 0.2243590 0.5000000 0.2243590), wk = 0.0023697 k( 332) = ( 0.2179487 0.5000000 0.2179487), wk = 0.0023697 k( 333) = ( 0.2115385 0.5000000 0.2115385), wk = 0.0023697 k( 334) = ( 0.2051282 0.5000000 0.2051282), wk = 0.0023697 k( 335) = ( 0.1987180 0.5000000 0.1987180), wk = 0.0023697 k( 336) = ( 0.1923077 0.5000000 0.1923077), wk = 0.0023697 k( 337) = ( 0.1858974 0.5000000 0.1858974), wk = 0.0023697 k( 338) = ( 0.1794872 0.5000000 0.1794872), wk = 0.0023697 k( 339) = ( 0.1730769 0.5000000 0.1730769), wk = 0.0023697 k( 340) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0023697 k( 341) = ( 0.1602564 0.5000000 0.1602564), wk = 0.0023697 k( 342) = ( 0.1538461 0.5000000 0.1538461), wk = 0.0023697 k( 343) = ( 0.1474359 0.5000000 0.1474359), wk = 0.0023697 k( 344) = ( 0.1410256 0.5000000 0.1410256), wk = 0.0023697 k( 345) = ( 0.1346154 0.5000000 0.1346154), wk = 0.0023697 k( 346) = ( 0.1282051 0.5000000 0.1282051), wk = 0.0023697 k( 347) = ( 0.1217949 0.5000000 0.1217949), wk = 0.0023697 k( 348) = ( 0.1153846 0.5000000 0.1153846), wk = 0.0023697 k( 349) = ( 0.1089744 0.5000000 0.1089744), wk = 0.0023697 k( 350) = ( 0.1025641 0.5000000 0.1025641), wk = 0.0023697 k( 351) = ( 0.0961538 0.5000000 0.0961538), wk = 0.0023697 k( 352) = ( 0.0897436 0.5000000 0.0897436), wk = 0.0023697 k( 353) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0023697 k( 354) = ( 0.0769231 0.5000000 0.0769231), wk = 0.0023697 k( 355) = ( 0.0705128 0.5000000 0.0705128), wk = 0.0023697 k( 356) = ( 0.0641026 0.5000000 0.0641026), wk = 0.0023697 k( 357) = ( 0.0576923 0.5000000 0.0576923), wk = 0.0023697 k( 358) = ( 0.0512821 0.5000000 0.0512821), wk = 0.0023697 k( 359) = ( 0.0448718 0.5000000 0.0448718), wk = 0.0023697 k( 360) = ( 0.0384615 0.5000000 0.0384615), wk = 0.0023697 k( 361) = ( 0.0320513 0.5000000 0.0320513), wk = 0.0023697 k( 362) = ( 0.0256410 0.5000000 0.0256410), wk = 0.0023697 k( 363) = ( 0.0192308 0.5000000 0.0192308), wk = 0.0023697 k( 364) = ( 0.0128205 0.5000000 0.0128205), wk = 0.0023697 k( 365) = ( 0.0064103 0.5000000 0.0064103), wk = 0.0023697 k( 366) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023697 k( 367) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023697 k( 368) = ( 0.5000000 0.5000000 0.0090909), wk = 0.0023697 k( 369) = ( 0.5000000 0.5000000 0.0181818), wk = 0.0023697 k( 370) = ( 0.5000000 0.5000000 0.0272727), wk = 0.0023697 k( 371) = ( 0.5000000 0.5000000 0.0363636), wk = 0.0023697 k( 372) = ( 0.5000000 0.5000000 0.0454546), wk = 0.0023697 k( 373) = ( 0.5000000 0.5000000 0.0545455), wk = 0.0023697 k( 374) = ( 0.5000000 0.5000000 0.0636364), wk = 0.0023697 k( 375) = ( 0.5000000 0.5000000 0.0727273), wk = 0.0023697 k( 376) = ( 0.5000000 0.5000000 0.0818182), wk = 0.0023697 k( 377) = ( 0.5000000 0.5000000 0.0909091), wk = 0.0023697 k( 378) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0023697 k( 379) = ( 0.5000000 0.5000000 0.1090909), wk = 0.0023697 k( 380) = ( 0.5000000 0.5000000 0.1181818), wk = 0.0023697 k( 381) = ( 0.5000000 0.5000000 0.1272727), wk = 0.0023697 k( 382) = ( 0.5000000 0.5000000 0.1363636), wk = 0.0023697 k( 383) = ( 0.5000000 0.5000000 0.1454545), wk = 0.0023697 k( 384) = ( 0.5000000 0.5000000 0.1545455), wk = 0.0023697 k( 385) = ( 0.5000000 0.5000000 0.1636364), wk = 0.0023697 k( 386) = ( 0.5000000 0.5000000 0.1727273), wk = 0.0023697 k( 387) = ( 0.5000000 0.5000000 0.1818182), wk = 0.0023697 k( 388) = ( 0.5000000 0.5000000 0.1909091), wk = 0.0023697 k( 389) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0023697 k( 390) = ( 0.5000000 0.5000000 0.2090909), wk = 0.0023697 k( 391) = ( 0.5000000 0.5000000 0.2181818), wk = 0.0023697 k( 392) = ( 0.5000000 0.5000000 0.2272727), wk = 0.0023697 k( 393) = ( 0.5000000 0.5000000 0.2363636), wk = 0.0023697 k( 394) = ( 0.5000000 0.5000000 0.2454545), wk = 0.0023697 k( 395) = ( 0.5000000 0.5000000 0.2545455), wk = 0.0023697 k( 396) = ( 0.5000000 0.5000000 0.2636364), wk = 0.0023697 k( 397) = ( 0.5000000 0.5000000 0.2727273), wk = 0.0023697 k( 398) = ( 0.5000000 0.5000000 0.2818182), wk = 0.0023697 k( 399) = ( 0.5000000 0.5000000 0.2909091), wk = 0.0023697 k( 400) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0023697 k( 401) = ( 0.5000000 0.5000000 0.3090909), wk = 0.0023697 k( 402) = ( 0.5000000 0.5000000 0.3181818), wk = 0.0023697 k( 403) = ( 0.5000000 0.5000000 0.3272727), wk = 0.0023697 k( 404) = ( 0.5000000 0.5000000 0.3363636), wk = 0.0023697 k( 405) = ( 0.5000000 0.5000000 0.3454546), wk = 0.0023697 k( 406) = ( 0.5000000 0.5000000 0.3545454), wk = 0.0023697 k( 407) = ( 0.5000000 0.5000000 0.3636364), wk = 0.0023697 k( 408) = ( 0.5000000 0.5000000 0.3727273), wk = 0.0023697 k( 409) = ( 0.5000000 0.5000000 0.3818182), wk = 0.0023697 k( 410) = ( 0.5000000 0.5000000 0.3909091), wk = 0.0023697 k( 411) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0023697 k( 412) = ( 0.5000000 0.5000000 0.4090909), wk = 0.0023697 k( 413) = ( 0.5000000 0.5000000 0.4181818), wk = 0.0023697 k( 414) = ( 0.5000000 0.5000000 0.4272727), wk = 0.0023697 k( 415) = ( 0.5000000 0.5000000 0.4363636), wk = 0.0023697 k( 416) = ( 0.5000000 0.5000000 0.4454546), wk = 0.0023697 k( 417) = ( 0.5000000 0.5000000 0.4545455), wk = 0.0023697 k( 418) = ( 0.5000000 0.5000000 0.4636364), wk = 0.0023697 k( 419) = ( 0.5000000 0.5000000 0.4727273), wk = 0.0023697 k( 420) = ( 0.5000000 0.5000000 0.4818182), wk = 0.0023697 k( 421) = ( 0.5000000 0.5000000 0.4909091), wk = 0.0023697 k( 422) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023697 Dense grid: 13397 G-vectors FFT dimensions: ( 30, 30, 30) Smooth grid: 8709 G-vectors FFT dimensions: ( 25, 25, 25) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.03 Mb ( 68, 26) NL pseudopotentials 0.04 Mb ( 34, 68) Each V/rho on FFT grid 0.01 Mb ( 900) Each G-vector array 0.00 Mb ( 375) G-vector shells 0.00 Mb ( 120) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.11 Mb ( 68, 104) Each subspace H/S matrix 0.01 Mb ( 26, 26) Each matrix 0.05 Mb ( 68, 2, 26) The potential is recalculated from file : ./AlRe.save/charge-density.dat Starting wfc are 28 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.0 secs Computing kpt #: 2 total cpu time spent up to now is 2.1 secs Computing kpt #: 3 total cpu time spent up to now is 2.1 secs Computing kpt #: 4 total cpu time spent up to now is 2.2 secs Computing kpt #: 5 total cpu time spent up to now is 2.3 secs Computing kpt #: 6 total cpu time spent up to now is 2.3 secs Computing kpt #: 7 total cpu time spent up to now is 2.4 secs Computing kpt #: 8 total cpu time spent up to now is 2.4 secs Computing kpt #: 9 total cpu time spent up to now is 2.5 secs Computing kpt #: 10 total cpu time spent up to now is 2.5 secs Computing kpt #: 11 total cpu time spent up to now is 2.6 secs Computing kpt #: 12 total cpu time spent up to now is 2.6 secs Computing kpt #: 13 total cpu time spent up to now is 2.7 secs Computing kpt #: 14 total cpu time spent up to now is 2.8 secs Computing kpt #: 15 total cpu time spent up to now is 2.8 secs Computing kpt #: 16 total cpu time spent up to now is 2.9 secs Computing kpt #: 17 total cpu time spent up to now is 2.9 secs Computing kpt #: 18 total cpu time spent up to now is 3.0 secs Computing kpt #: 19 total cpu time spent up to now is 3.0 secs Computing kpt #: 20 total cpu time spent up to now is 3.1 secs Computing kpt #: 21 total cpu time spent up to now is 3.2 secs Computing kpt #: 22 total cpu time spent up to now is 3.2 secs Computing kpt #: 23 total cpu time spent up to now is 3.3 secs Computing kpt #: 24 total cpu time spent up to now is 3.4 secs Computing kpt #: 25 total cpu time spent up to now is 3.4 secs Computing kpt #: 26 total cpu time spent up to now is 3.5 secs Computing kpt #: 27 total cpu time spent up to now is 3.6 secs Computing kpt #: 28 total cpu time spent up to now is 3.7 secs Computing kpt #: 29 total cpu time spent up to now is 3.8 secs Computing kpt #: 30 total cpu time spent up to now is 3.9 secs Computing kpt #: 31 total cpu time spent up to now is 3.9 secs Computing kpt #: 32 total cpu time spent up to now is 4.0 secs Computing kpt #: 33 total cpu time spent up to now is 4.1 secs Computing kpt #: 34 total cpu time spent up to now is 4.2 secs Computing kpt #: 35 total cpu time spent up to now is 4.3 secs Computing kpt #: 36 total cpu time spent up to now is 4.4 secs Computing kpt #: 37 total cpu time spent up to now is 4.5 secs Computing kpt #: 38 total cpu time spent up to now is 4.5 secs Computing kpt #: 39 total cpu time spent up to now is 4.6 secs Computing kpt #: 40 total cpu time spent up to now is 4.7 secs Computing kpt #: 41 total cpu time spent up to now is 4.8 secs Computing kpt #: 42 total cpu time spent up to now is 4.9 secs Computing kpt #: 43 total cpu time spent up to now is 4.9 secs Computing kpt #: 44 total cpu time spent up to now is 5.0 secs Computing kpt #: 45 total cpu time spent up to now is 5.1 secs Computing kpt #: 46 total cpu time spent up to now is 5.2 secs Computing kpt #: 47 total cpu time spent up to now is 5.3 secs Computing kpt #: 48 total cpu time spent up to now is 5.4 secs Computing kpt #: 49 total cpu time spent up to now is 5.5 secs Computing kpt #: 50 total cpu time spent up to now is 5.6 secs Computing kpt #: 51 total cpu time spent up to now is 5.7 secs Computing kpt #: 52 total cpu time spent up to now is 5.7 secs Computing kpt #: 53 total cpu time spent up to now is 5.8 secs Computing kpt #: 54 total cpu time spent up to now is 5.9 secs Computing kpt #: 55 total cpu time spent up to now is 6.0 secs Computing kpt #: 56 total cpu time spent up to now is 6.1 secs Computing kpt #: 57 total cpu time spent up to now is 6.2 secs Computing kpt #: 58 total cpu time spent up to now is 6.3 secs Computing kpt #: 59 total cpu time spent up to now is 6.4 secs Computing kpt #: 60 total cpu time spent up to now is 6.5 secs Computing kpt #: 61 total cpu time spent up to now is 6.6 secs Computing kpt #: 62 total cpu time spent up to now is 6.7 secs Computing kpt #: 63 total cpu time spent up to now is 6.8 secs Computing kpt #: 64 total cpu time spent up to now is 6.8 secs Computing kpt #: 65 total cpu time spent up to now is 6.9 secs Computing kpt #: 66 total cpu time spent up to now is 7.0 secs Computing kpt #: 67 total cpu time spent up to now is 7.1 secs Computing kpt #: 68 total cpu time spent up to now is 7.2 secs Computing kpt #: 69 total cpu time spent up to now is 7.3 secs Computing kpt #: 70 total cpu time spent up to now is 7.4 secs Computing kpt #: 71 total cpu time spent up to now is 7.5 secs Computing kpt #: 72 total cpu time spent up to now is 7.6 secs Computing kpt #: 73 total cpu time spent up to now is 7.7 secs Computing kpt #: 74 total cpu time spent up to now is 7.7 secs Computing kpt #: 75 total cpu time spent up to now is 7.8 secs Computing kpt #: 76 total cpu time spent up to now is 7.9 secs Computing kpt #: 77 total cpu time spent up to now is 7.9 secs Computing kpt #: 78 total cpu time spent up to now is 8.0 secs Computing kpt #: 79 total cpu time spent up to now is 8.1 secs Computing kpt #: 80 total cpu time spent up to now is 8.2 secs Computing kpt #: 81 total cpu time spent up to now is 8.3 secs Computing kpt #: 82 total cpu time spent up to now is 8.3 secs Computing kpt #: 83 total cpu time spent up to now is 8.4 secs Computing kpt #: 84 total cpu time spent up to now is 8.5 secs Computing kpt #: 85 total cpu time spent up to now is 8.6 secs Computing kpt #: 86 total cpu time spent up to now is 8.6 secs Computing kpt #: 87 total cpu time spent up to now is 8.7 secs Computing kpt #: 88 total cpu time spent up to now is 8.8 secs Computing kpt #: 89 total cpu time spent up to now is 8.9 secs Computing kpt #: 90 total cpu time spent up to now is 8.9 secs Computing kpt #: 91 total cpu time spent up to now is 9.0 secs Computing kpt #: 92 total cpu time spent up to now is 9.1 secs Computing kpt #: 93 total cpu time spent up to now is 9.1 secs Computing kpt #: 94 total cpu time spent up to now is 9.2 secs Computing kpt #: 95 total cpu time spent up to now is 9.3 secs Computing kpt #: 96 total cpu time spent up to now is 9.4 secs Computing kpt #: 97 total cpu time spent up to now is 9.4 secs Computing kpt #: 98 total cpu time spent up to now is 9.5 secs Computing kpt #: 99 total cpu time spent up to now is 9.6 secs Computing kpt #: 100 total cpu time spent up to now is 9.7 secs Computing kpt #: 101 total cpu time spent up to now is 9.7 secs Computing kpt #: 102 total cpu time spent up to now is 9.8 secs Computing kpt #: 103 total cpu time spent up to now is 9.9 secs Computing kpt #: 104 total cpu time spent up to now is 9.9 secs Computing kpt #: 105 total cpu time spent up to now is 10.0 secs Computing kpt #: 106 total cpu time spent up to now is 10.1 secs Computing kpt #: 107 total cpu time spent up to now is 10.2 secs Computing kpt #: 108 total cpu time spent up to now is 10.3 secs Computing kpt #: 109 total cpu time spent up to now is 10.4 secs Computing kpt #: 110 total cpu time spent up to now is 10.4 secs Computing kpt #: 111 total cpu time spent up to now is 10.5 secs Computing kpt #: 112 total cpu time spent up to now is 10.6 secs Computing kpt #: 113 total cpu time spent up to now is 10.6 secs Computing kpt #: 114 total cpu time spent up to now is 10.7 secs Computing kpt #: 115 total cpu time spent up to now is 10.7 secs Computing kpt #: 116 total cpu time spent up to now is 10.8 secs Computing kpt #: 117 total cpu time spent up to now is 10.9 secs Computing kpt #: 118 total cpu time spent up to now is 10.9 secs Computing kpt #: 119 total cpu time spent up to now is 11.0 secs Computing kpt #: 120 total cpu time spent up to now is 11.1 secs Computing kpt #: 121 total cpu time spent up to now is 11.1 secs Computing kpt #: 122 total cpu time spent up to now is 11.2 secs Computing kpt #: 123 total cpu time spent up to now is 11.3 secs Computing kpt #: 124 total cpu time spent up to now is 11.3 secs Computing kpt #: 125 total cpu time spent up to now is 11.4 secs Computing kpt #: 126 total cpu time spent up to now is 11.5 secs Computing kpt #: 127 total cpu time spent up to now is 11.5 secs Computing kpt #: 128 total cpu time spent up to now is 11.6 secs Computing kpt #: 129 total cpu time spent up to now is 11.7 secs Computing kpt #: 130 total cpu time spent up to now is 11.7 secs Computing kpt #: 131 total cpu time spent up to now is 11.8 secs Computing kpt #: 132 total cpu time spent up to now is 11.9 secs Computing kpt #: 133 total cpu time spent up to now is 11.9 secs Computing kpt #: 134 total cpu time spent up to now is 12.0 secs Computing kpt #: 135 total cpu time spent up to now is 12.1 secs Computing kpt #: 136 total cpu time spent up to now is 12.2 secs Computing kpt #: 137 total cpu time spent up to now is 12.2 secs Computing kpt #: 138 total cpu time spent up to now is 12.3 secs Computing kpt #: 139 total cpu time spent up to now is 12.4 secs Computing kpt #: 140 total cpu time spent up to now is 12.5 secs Computing kpt #: 141 total cpu time spent up to now is 12.6 secs Computing kpt #: 142 total cpu time spent up to now is 12.7 secs Computing kpt #: 143 total cpu time spent up to now is 12.8 secs Computing kpt #: 144 total cpu time spent up to now is 12.9 secs Computing kpt #: 145 total cpu time spent up to now is 12.9 secs Computing kpt #: 146 total cpu time spent up to now is 13.0 secs Computing kpt #: 147 total cpu time spent up to now is 13.1 secs Computing kpt #: 148 total cpu time spent up to now is 13.2 secs Computing kpt #: 149 total cpu time spent up to now is 13.3 secs Computing kpt #: 150 total cpu time spent up to now is 13.4 secs Computing kpt #: 151 total cpu time spent up to now is 13.5 secs Computing kpt #: 152 total cpu time spent up to now is 13.5 secs Computing kpt #: 153 total cpu time spent up to now is 13.6 secs Computing kpt #: 154 total cpu time spent up to now is 13.7 secs Computing kpt #: 155 total cpu time spent up to now is 13.8 secs Computing kpt #: 156 total cpu time spent up to now is 13.9 secs Computing kpt #: 157 total cpu time spent up to now is 14.0 secs Computing kpt #: 158 total cpu time spent up to now is 14.1 secs Computing kpt #: 159 total cpu time spent up to now is 14.2 secs Computing kpt #: 160 total cpu time spent up to now is 14.2 secs Computing kpt #: 161 total cpu time spent up to now is 14.3 secs Computing kpt #: 162 total cpu time spent up to now is 14.4 secs Computing kpt #: 163 total cpu time spent up to now is 14.5 secs Computing kpt #: 164 total cpu time spent up to now is 14.5 secs Computing kpt #: 165 total cpu time spent up to now is 14.6 secs Computing kpt #: 166 total cpu time spent up to now is 14.7 secs Computing kpt #: 167 total cpu time spent up to now is 14.7 secs Computing kpt #: 168 total cpu time spent up to now is 14.8 secs Computing kpt #: 169 total cpu time spent up to now is 14.9 secs Computing kpt #: 170 total cpu time spent up to now is 14.9 secs Computing kpt #: 171 total cpu time spent up to now is 15.0 secs Computing kpt #: 172 total cpu time spent up to now is 15.0 secs Computing kpt #: 173 total cpu time spent up to now is 15.1 secs Computing kpt #: 174 total cpu time spent up to now is 15.1 secs Computing kpt #: 175 total cpu time spent up to now is 15.2 secs Computing kpt #: 176 total cpu time spent up to now is 15.3 secs Computing kpt #: 177 total cpu time spent up to now is 15.3 secs Computing kpt #: 178 total cpu time spent up to now is 15.4 secs Computing kpt #: 179 total cpu time spent up to now is 15.4 secs Computing kpt #: 180 total cpu time spent up to now is 15.5 secs Computing kpt #: 181 total cpu time spent up to now is 15.5 secs Computing kpt #: 182 total cpu time spent up to now is 15.6 secs Computing kpt #: 183 total cpu time spent up to now is 15.6 secs Computing kpt #: 184 total cpu time spent up to now is 15.7 secs Computing kpt #: 185 total cpu time spent up to now is 15.8 secs Computing kpt #: 186 total cpu time spent up to now is 15.8 secs Computing kpt #: 187 total cpu time spent up to now is 15.9 secs Computing kpt #: 188 total cpu time spent up to now is 15.9 secs Computing kpt #: 189 total cpu time spent up to now is 16.0 secs Computing kpt #: 190 total cpu time spent up to now is 16.0 secs Computing kpt #: 191 total cpu time spent up to now is 16.1 secs Computing kpt #: 192 total cpu time spent up to now is 16.1 secs Computing kpt #: 193 total cpu time spent up to now is 16.2 secs Computing kpt #: 194 total cpu time spent up to now is 16.2 secs Computing kpt #: 195 total cpu time spent up to now is 16.3 secs Computing kpt #: 196 total cpu time spent up to now is 16.4 secs Computing kpt #: 197 total cpu time spent up to now is 16.4 secs Computing kpt #: 198 total cpu time spent up to now is 16.5 secs Computing kpt #: 199 total cpu time spent up to now is 16.5 secs Computing kpt #: 200 total cpu time spent up to now is 16.6 secs Computing kpt #: 201 total cpu time spent up to now is 16.6 secs Computing kpt #: 202 total cpu time spent up to now is 16.7 secs Computing kpt #: 203 total cpu time spent up to now is 16.8 secs Computing kpt #: 204 total cpu time spent up to now is 16.8 secs Computing kpt #: 205 total cpu time spent up to now is 16.9 secs Computing kpt #: 206 total cpu time spent up to now is 16.9 secs Computing kpt #: 207 total cpu time spent up to now is 17.0 secs Computing kpt #: 208 total cpu time spent up to now is 17.0 secs Computing kpt #: 209 total cpu time spent up to now is 17.1 secs Computing kpt #: 210 total cpu time spent up to now is 17.1 secs Computing kpt #: 211 total cpu time spent up to now is 17.2 secs Computing kpt #: 212 total cpu time spent up to now is 17.3 secs Computing kpt #: 213 total cpu time spent up to now is 17.3 secs Computing kpt #: 214 total cpu time spent up to now is 17.4 secs Computing kpt #: 215 total cpu time spent up to now is 17.5 secs Computing kpt #: 216 total cpu time spent up to now is 17.5 secs Computing kpt #: 217 total cpu time spent up to now is 17.6 secs Computing kpt #: 218 total cpu time spent up to now is 17.6 secs Computing kpt #: 219 total cpu time spent up to now is 17.7 secs Computing kpt #: 220 total cpu time spent up to now is 17.8 secs Computing kpt #: 221 total cpu time spent up to now is 17.8 secs Computing kpt #: 222 total cpu time spent up to now is 17.9 secs Computing kpt #: 223 total cpu time spent up to now is 18.0 secs Computing kpt #: 224 total cpu time spent up to now is 18.0 secs Computing kpt #: 225 total cpu time spent up to now is 18.1 secs Computing kpt #: 226 total cpu time spent up to now is 18.2 secs Computing kpt #: 227 total cpu time spent up to now is 18.2 secs Computing kpt #: 228 total cpu time spent up to now is 18.3 secs Computing kpt #: 229 total cpu time spent up to now is 18.4 secs Computing kpt #: 230 total cpu time spent up to now is 18.4 secs Computing kpt #: 231 total cpu time spent up to now is 18.5 secs Computing kpt #: 232 total cpu time spent up to now is 18.6 secs Computing kpt #: 233 total cpu time spent up to now is 18.6 secs Computing kpt #: 234 total cpu time spent up to now is 18.7 secs Computing kpt #: 235 total cpu time spent up to now is 18.8 secs Computing kpt #: 236 total cpu time spent up to now is 18.8 secs Computing kpt #: 237 total cpu time spent up to now is 18.9 secs Computing kpt #: 238 total cpu time spent up to now is 19.0 secs Computing kpt #: 239 total cpu time spent up to now is 19.0 secs Computing kpt #: 240 total cpu time spent up to now is 19.1 secs Computing kpt #: 241 total cpu time spent up to now is 19.2 secs Computing kpt #: 242 total cpu time spent up to now is 19.2 secs Computing kpt #: 243 total cpu time spent up to now is 19.3 secs Computing kpt #: 244 total cpu time spent up to now is 19.4 secs Computing kpt #: 245 total cpu time spent up to now is 19.5 secs Computing kpt #: 246 total cpu time spent up to now is 19.5 secs Computing kpt #: 247 total cpu time spent up to now is 19.6 secs Computing kpt #: 248 total cpu time spent up to now is 19.7 secs Computing kpt #: 249 total cpu time spent up to now is 19.8 secs Computing kpt #: 250 total cpu time spent up to now is 19.8 secs Computing kpt #: 251 total cpu time spent up to now is 19.9 secs Computing kpt #: 252 total cpu time spent up to now is 20.0 secs Computing kpt #: 253 total cpu time spent up to now is 20.0 secs Computing kpt #: 254 total cpu time spent up to now is 20.1 secs Computing kpt #: 255 total cpu time spent up to now is 20.2 secs Computing kpt #: 256 total cpu time spent up to now is 20.3 secs Computing kpt #: 257 total cpu time spent up to now is 20.3 secs Computing kpt #: 258 total cpu time spent up to now is 20.4 secs Computing kpt #: 259 total cpu time spent up to now is 20.5 secs Computing kpt #: 260 total cpu time spent up to now is 20.6 secs Computing kpt #: 261 total cpu time spent up to now is 20.6 secs Computing kpt #: 262 total cpu time spent up to now is 20.7 secs Computing kpt #: 263 total cpu time spent up to now is 20.8 secs Computing kpt #: 264 total cpu time spent up to now is 20.8 secs Computing kpt #: 265 total cpu time spent up to now is 20.9 secs Computing kpt #: 266 total cpu time spent up to now is 21.0 secs Computing kpt #: 267 total cpu time spent up to now is 21.1 secs Computing kpt #: 268 total cpu time spent up to now is 21.1 secs Computing kpt #: 269 total cpu time spent up to now is 21.2 secs Computing kpt #: 270 total cpu time spent up to now is 21.3 secs Computing kpt #: 271 total cpu time spent up to now is 21.3 secs Computing kpt #: 272 total cpu time spent up to now is 21.4 secs Computing kpt #: 273 total cpu time spent up to now is 21.5 secs Computing kpt #: 274 total cpu time spent up to now is 21.6 secs Computing kpt #: 275 total cpu time spent up to now is 21.6 secs Computing kpt #: 276 total cpu time spent up to now is 21.7 secs Computing kpt #: 277 total cpu time spent up to now is 21.8 secs Computing kpt #: 278 total cpu time spent up to now is 21.9 secs Computing kpt #: 279 total cpu time spent up to now is 21.9 secs Computing kpt #: 280 total cpu time spent up to now is 22.0 secs Computing kpt #: 281 total cpu time spent up to now is 22.1 secs Computing kpt #: 282 total cpu time spent up to now is 22.2 secs Computing kpt #: 283 total cpu time spent up to now is 22.2 secs Computing kpt #: 284 total cpu time spent up to now is 22.3 secs Computing kpt #: 285 total cpu time spent up to now is 22.4 secs Computing kpt #: 286 total cpu time spent up to now is 22.5 secs Computing kpt #: 287 total cpu time spent up to now is 22.5 secs Computing kpt #: 288 total cpu time spent up to now is 22.6 secs Computing kpt #: 289 total cpu time spent up to now is 22.7 secs Computing kpt #: 290 total cpu time spent up to now is 22.8 secs Computing kpt #: 291 total cpu time spent up to now is 22.8 secs Computing kpt #: 292 total cpu time spent up to now is 22.9 secs Computing kpt #: 293 total cpu time spent up to now is 23.0 secs Computing kpt #: 294 total cpu time spent up to now is 23.1 secs Computing kpt #: 295 total cpu time spent up to now is 23.1 secs Computing kpt #: 296 total cpu time spent up to now is 23.2 secs Computing kpt #: 297 total cpu time spent up to now is 23.3 secs Computing kpt #: 298 total cpu time spent up to now is 23.3 secs Computing kpt #: 299 total cpu time spent up to now is 23.4 secs Computing kpt #: 300 total cpu time spent up to now is 23.5 secs Computing kpt #: 301 total cpu time spent up to now is 23.5 secs Computing kpt #: 302 total cpu time spent up to now is 23.6 secs Computing kpt #: 303 total cpu time spent up to now is 23.7 secs Computing kpt #: 304 total cpu time spent up to now is 23.7 secs Computing kpt #: 305 total cpu time spent up to now is 23.8 secs Computing kpt #: 306 total cpu time spent up to now is 23.9 secs Computing kpt #: 307 total cpu time spent up to now is 24.0 secs Computing kpt #: 308 total cpu time spent up to now is 24.0 secs Computing kpt #: 309 total cpu time spent up to now is 24.1 secs Computing kpt #: 310 total cpu time spent up to now is 24.2 secs Computing kpt #: 311 total cpu time spent up to now is 24.2 secs Computing kpt #: 312 total cpu time spent up to now is 24.3 secs Computing kpt #: 313 total cpu time spent up to now is 24.4 secs Computing kpt #: 314 total cpu time spent up to now is 24.5 secs Computing kpt #: 315 total cpu time spent up to now is 24.6 secs Computing kpt #: 316 total cpu time spent up to now is 26.6 secs Computing kpt #: 317 total cpu time spent up to now is 26.7 secs Computing kpt #: 318 total cpu time spent up to now is 26.8 secs Computing kpt #: 319 total cpu time spent up to now is 26.9 secs Computing kpt #: 320 total cpu time spent up to now is 26.9 secs Computing kpt #: 321 total cpu time spent up to now is 27.0 secs Computing kpt #: 322 total cpu time spent up to now is 27.1 secs Computing kpt #: 323 total cpu time spent up to now is 27.2 secs Computing kpt #: 324 total cpu time spent up to now is 27.3 secs Computing kpt #: 325 total cpu time spent up to now is 27.4 secs Computing kpt #: 326 total cpu time spent up to now is 27.5 secs Computing kpt #: 327 total cpu time spent up to now is 27.6 secs Computing kpt #: 328 total cpu time spent up to now is 27.7 secs Computing kpt #: 329 total cpu time spent up to now is 27.8 secs Computing kpt #: 330 total cpu time spent up to now is 27.9 secs Computing kpt #: 331 total cpu time spent up to now is 28.0 secs Computing kpt #: 332 total cpu time spent up to now is 28.0 secs Computing kpt #: 333 total cpu time spent up to now is 28.1 secs Computing kpt #: 334 total cpu time spent up to now is 28.2 secs Computing kpt #: 335 total cpu time spent up to now is 28.3 secs Computing kpt #: 336 total cpu time spent up to now is 28.4 secs Computing kpt #: 337 total cpu time spent up to now is 28.5 secs Computing kpt #: 338 total cpu time spent up to now is 28.6 secs Computing kpt #: 339 total cpu time spent up to now is 28.6 secs Computing kpt #: 340 total cpu time spent up to now is 28.7 secs Computing kpt #: 341 total cpu time spent up to now is 28.8 secs Computing kpt #: 342 total cpu time spent up to now is 28.9 secs Computing kpt #: 343 total cpu time spent up to now is 29.0 secs Computing kpt #: 344 total cpu time spent up to now is 29.1 secs Computing kpt #: 345 total cpu time spent up to now is 29.2 secs Computing kpt #: 346 total cpu time spent up to now is 29.3 secs Computing kpt #: 347 total cpu time spent up to now is 29.4 secs Computing kpt #: 348 total cpu time spent up to now is 29.5 secs Computing kpt #: 349 total cpu time spent up to now is 29.6 secs Computing kpt #: 350 total cpu time spent up to now is 29.7 secs Computing kpt #: 351 total cpu time spent up to now is 29.8 secs Computing kpt #: 352 total cpu time spent up to now is 29.9 secs Computing kpt #: 353 total cpu time spent up to now is 30.0 secs Computing kpt #: 354 total cpu time spent up to now is 30.0 secs Computing kpt #: 355 total cpu time spent up to now is 30.1 secs Computing kpt #: 356 total cpu time spent up to now is 30.2 secs Computing kpt #: 357 total cpu time spent up to now is 30.3 secs Computing kpt #: 358 total cpu time spent up to now is 30.4 secs Computing kpt #: 359 total cpu time spent up to now is 30.5 secs Computing kpt #: 360 total cpu time spent up to now is 30.6 secs Computing kpt #: 361 total cpu time spent up to now is 30.7 secs Computing kpt #: 362 total cpu time spent up to now is 30.8 secs Computing kpt #: 363 total cpu time spent up to now is 30.9 secs Computing kpt #: 364 total cpu time spent up to now is 31.0 secs Computing kpt #: 365 total cpu time spent up to now is 31.1 secs Computing kpt #: 366 total cpu time spent up to now is 31.2 secs Computing kpt #: 367 total cpu time spent up to now is 31.2 secs Computing kpt #: 368 total cpu time spent up to now is 31.3 secs Computing kpt #: 369 total cpu time spent up to now is 31.4 secs Computing kpt #: 370 total cpu time spent up to now is 31.5 secs Computing kpt #: 371 total cpu time spent up to now is 31.5 secs Computing kpt #: 372 total cpu time spent up to now is 31.6 secs Computing kpt #: 373 total cpu time spent up to now is 31.7 secs Computing kpt #: 374 total cpu time spent up to now is 31.8 secs Computing kpt #: 375 total cpu time spent up to now is 31.8 secs Computing kpt #: 376 total cpu time spent up to now is 31.9 secs Computing kpt #: 377 total cpu time spent up to now is 32.0 secs Computing kpt #: 378 total cpu time spent up to now is 32.1 secs Computing kpt #: 379 total cpu time spent up to now is 32.1 secs Computing kpt #: 380 total cpu time spent up to now is 32.2 secs Computing kpt #: 381 total cpu time spent up to now is 32.3 secs Computing kpt #: 382 total cpu time spent up to now is 32.3 secs Computing kpt #: 383 total cpu time spent up to now is 32.4 secs Computing kpt #: 384 total cpu time spent up to now is 32.5 secs Computing kpt #: 385 total cpu time spent up to now is 32.6 secs Computing kpt #: 386 total cpu time spent up to now is 32.6 secs Computing kpt #: 387 total cpu time spent up to now is 32.7 secs Computing kpt #: 388 total cpu time spent up to now is 32.8 secs Computing kpt #: 389 total cpu time spent up to now is 32.8 secs Computing kpt #: 390 total cpu time spent up to now is 32.9 secs Computing kpt #: 391 total cpu time spent up to now is 33.0 secs Computing kpt #: 392 total cpu time spent up to now is 33.0 secs Computing kpt #: 393 total cpu time spent up to now is 33.1 secs Computing kpt #: 394 total cpu time spent up to now is 33.2 secs Computing kpt #: 395 total cpu time spent up to now is 33.3 secs Computing kpt #: 396 total cpu time spent up to now is 33.3 secs Computing kpt #: 397 total cpu time spent up to now is 33.4 secs Computing kpt #: 398 total cpu time spent up to now is 33.5 secs Computing kpt #: 399 total cpu time spent up to now is 33.5 secs Computing kpt #: 400 total cpu time spent up to now is 33.6 secs Computing kpt #: 401 total cpu time spent up to now is 33.7 secs Computing kpt #: 402 total cpu time spent up to now is 33.7 secs Computing kpt #: 403 total cpu time spent up to now is 33.8 secs Computing kpt #: 404 total cpu time spent up to now is 33.9 secs Computing kpt #: 405 total cpu time spent up to now is 33.9 secs Computing kpt #: 406 total cpu time spent up to now is 34.0 secs Computing kpt #: 407 total cpu time spent up to now is 34.1 secs Computing kpt #: 408 total cpu time spent up to now is 34.1 secs Computing kpt #: 409 total cpu time spent up to now is 34.2 secs Computing kpt #: 410 total cpu time spent up to now is 34.3 secs Computing kpt #: 411 total cpu time spent up to now is 34.4 secs Computing kpt #: 412 total cpu time spent up to now is 34.4 secs Computing kpt #: 413 total cpu time spent up to now is 34.5 secs Computing kpt #: 414 total cpu time spent up to now is 34.6 secs Computing kpt #: 415 total cpu time spent up to now is 34.7 secs Computing kpt #: 416 total cpu time spent up to now is 34.7 secs Computing kpt #: 417 total cpu time spent up to now is 34.8 secs Computing kpt #: 418 total cpu time spent up to now is 34.9 secs Computing kpt #: 419 total cpu time spent up to now is 34.9 secs Computing kpt #: 420 total cpu time spent up to now is 35.0 secs Computing kpt #: 421 total cpu time spent up to now is 35.1 secs Computing kpt #: 422 total cpu time spent up to now is 35.2 secs ethr = 5.56E-08, avg # of iterations = 10.1 total cpu time spent up to now is 35.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3943 -28.3943 -17.4576 -17.4576 -17.4576 -17.4576 8.6270 8.6270 15.7590 15.7590 15.7590 15.7590 21.7806 21.7806 21.7806 21.7806 22.4008 22.4008 25.7574 25.7574 26.8354 26.8354 26.8354 26.8354 k = 0.0000 0.0091-0.0000 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3943 -28.3943 -17.4580 -17.4580 -17.4576 -17.4576 8.6290 8.6290 15.7599 15.7599 15.7600 15.7600 21.7757 21.7757 21.7794 21.7794 22.3975 22.3975 25.7599 25.7599 26.8316 26.8316 26.8411 26.8411 k = 0.0000 0.0182-0.0000 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3945 -28.3945 -17.4589 -17.4589 -17.4575 -17.4575 8.6350 8.6350 15.7623 15.7623 15.7630 15.7630 21.7612 21.7612 21.7757 21.7757 22.3880 22.3880 25.7668 25.7668 26.8208 26.8208 26.8581 26.8581 k = 0.0000 0.0273-0.0000 ( 1045 PWs) bands (ev): -58.5100 -58.5100 -28.3948 -28.3948 -17.4606 -17.4606 -17.4572 -17.4572 8.6450 8.6450 15.7664 15.7664 15.7680 15.7680 21.7373 21.7373 21.7692 21.7692 22.3726 22.3726 25.7770 25.7770 26.8043 26.8043 26.8862 26.8862 k = 0.0000 0.0364-0.0000 ( 1045 PWs) bands (ev): -58.5098 -58.5098 -28.3952 -28.3952 -17.4628 -17.4628 -17.4569 -17.4569 8.6589 8.6589 15.7720 15.7720 15.7749 15.7749 21.7045 21.7045 21.7595 21.7595 22.3524 22.3524 25.7884 25.7884 26.7845 26.7845 26.9250 26.9250 k = 0.0000 0.0455-0.0000 ( 1049 PWs) bands (ev): -58.5097 -58.5097 -28.3958 -28.3958 -17.4659 -17.4659 -17.4566 -17.4566 8.6767 8.6767 15.7793 15.7793 15.7835 15.7835 21.6632 21.6632 21.7459 21.7459 22.3283 22.3283 25.7980 25.7980 26.7647 26.7647 26.9739 26.9739 k = 0.0000 0.0545-0.0000 ( 1053 PWs) bands (ev): -58.5095 -58.5095 -28.3965 -28.3965 -17.4695 -17.4695 -17.4561 -17.4561 8.6985 8.6985 15.7882 15.7882 15.7940 15.7940 21.6143 21.6143 21.7275 21.7275 22.3019 22.3019 25.8018 25.8018 26.7490 26.7490 27.0324 27.0324 k = 0.0000 0.0636-0.0000 ( 1065 PWs) bands (ev): -58.5094 -58.5094 -28.3974 -28.3974 -17.4738 -17.4738 -17.4557 -17.4557 8.7241 8.7241 15.7986 15.7986 15.8061 15.8061 21.5582 21.5582 21.7034 21.7034 22.2748 22.2748 25.7956 25.7956 26.7424 26.7424 27.0996 27.0996 k = 0.0000 0.0727-0.0000 ( 1065 PWs) bands (ev): -58.5092 -58.5092 -28.3983 -28.3983 -17.4785 -17.4785 -17.4551 -17.4551 8.7537 8.7537 15.8106 15.8106 15.8197 15.8197 21.4960 21.4960 21.6728 21.6728 22.2486 22.2486 25.7756 25.7756 26.7491 26.7491 27.1750 27.1750 k = 0.0000 0.0818-0.0000 ( 1065 PWs) bands (ev): -58.5088 -58.5088 -28.3992 -28.3992 -17.4839 -17.4839 -17.4544 -17.4544 8.7870 8.7870 15.8242 15.8242 15.8346 15.8346 21.4282 21.4282 21.6350 21.6350 22.2248 22.2248 25.7395 25.7395 26.7719 26.7719 27.2577 27.2577 k = 0.0000 0.0909-0.0000 ( 1069 PWs) bands (ev): -58.5085 -58.5085 -28.4004 -28.4004 -17.4898 -17.4898 -17.4536 -17.4536 8.8241 8.8241 15.8392 15.8392 15.8508 15.8508 21.3557 21.3557 21.5894 21.5894 22.2044 22.2044 25.6869 25.6869 26.8116 26.8116 27.3470 27.3470 k = 0.0000 0.1000-0.0000 ( 1069 PWs) bands (ev): -58.5082 -58.5082 -28.4016 -28.4016 -17.4963 -17.4963 -17.4528 -17.4528 8.8650 8.8650 15.8558 15.8558 15.8679 15.8679 21.2792 21.2792 21.5362 21.5362 22.1880 22.1880 25.6197 25.6197 26.8670 26.8670 27.4423 27.4423 k = 0.0000 0.1091-0.0000 ( 1069 PWs) bands (ev): -58.5078 -58.5078 -28.4029 -28.4029 -17.5032 -17.5032 -17.4519 -17.4519 8.9095 8.9095 15.8738 15.8738 15.8858 15.8858 21.1992 21.1992 21.4761 21.4761 22.1758 22.1758 25.5404 25.5404 26.9360 26.9360 27.5428 27.5428 k = 0.0000 0.1182-0.0000 ( 1069 PWs) bands (ev): -58.5073 -58.5073 -28.4043 -28.4043 -17.5106 -17.5106 -17.4509 -17.4509 8.9577 8.9577 15.8932 15.8932 15.9041 15.9041 21.1164 21.1164 21.4096 21.4096 22.1675 22.1675 25.4518 25.4518 27.0163 27.0163 27.6479 27.6479 k = 0.0000 0.1273-0.0000 ( 1073 PWs) bands (ev): -58.5069 -58.5069 -28.4058 -28.4058 -17.5186 -17.5186 -17.4499 -17.4499 9.0094 9.0094 15.9140 15.9140 15.9227 15.9227 21.0313 21.0313 21.3378 21.3378 22.1627 22.1627 25.3566 25.3566 27.1058 27.1058 27.7571 27.7571 k = 0.0000 0.1364-0.0000 ( 1073 PWs) bands (ev): -58.5064 -58.5064 -28.4073 -28.4073 -17.5269 -17.5269 -17.4488 -17.4488 9.0646 9.0646 15.9362 15.9362 15.9412 15.9412 20.9446 20.9446 21.2616 21.2616 22.1610 22.1610 25.2570 25.2570 27.2028 27.2028 27.8698 27.8698 k = 0.0000 0.1455-0.0000 ( 1073 PWs) bands (ev): -58.5059 -58.5059 -28.4090 -28.4090 -17.5356 -17.5356 -17.4476 -17.4476 9.1232 9.1232 15.9594 15.9594 15.9597 15.9597 20.8565 20.8565 21.1820 21.1820 22.1619 22.1619 25.1550 25.1550 27.3058 27.3058 27.9855 27.9855 k = 0.0000 0.1545-0.0000 ( 1081 PWs) bands (ev): -58.5054 -58.5054 -28.4108 -28.4108 -17.5448 -17.5448 -17.4464 -17.4464 9.1852 9.1852 15.9767 15.9767 15.9844 15.9844 20.7676 20.7676 21.0997 21.0997 22.1650 22.1650 25.0522 25.0522 27.4137 27.4137 28.1037 28.1037 k = 0.0000 0.1636-0.0000 ( 1081 PWs) bands (ev): -58.5049 -58.5049 -28.4126 -28.4126 -17.5543 -17.5543 -17.4451 -17.4451 9.2505 9.2505 15.9930 15.9930 16.0103 16.0103 20.6782 20.6782 21.0154 21.0154 22.1700 22.1700 24.9500 24.9500 27.5256 27.5256 28.2241 28.2241 k = 0.0000 0.1727-0.0000 ( 1081 PWs) bands (ev): -58.5043 -58.5043 -28.4144 -28.4144 -17.5640 -17.5640 -17.4438 -17.4438 9.3190 9.3190 16.0078 16.0078 16.0374 16.0374 20.5888 20.5888 20.9299 20.9299 22.1766 22.1766 24.8496 24.8496 27.6406 27.6406 28.3463 28.3463 k = 0.0000 0.1818-0.0000 ( 1081 PWs) bands (ev): -58.5037 -58.5037 -28.4163 -28.4163 -17.5741 -17.5741 -17.4425 -17.4425 9.3906 9.3906 16.0207 16.0207 16.0656 16.0656 20.4995 20.4995 20.8435 20.8435 22.1845 22.1845 24.7522 24.7522 27.7582 27.7582 28.4699 28.4699 k = 0.0000 0.1909-0.0000 ( 1089 PWs) bands (ev): -58.5032 -58.5032 -28.4184 -28.4184 -17.5844 -17.5844 -17.4411 -17.4411 9.4652 9.4652 16.0313 16.0313 16.0948 16.0948 20.4107 20.4107 20.7568 20.7568 22.1936 22.1936 24.6587 24.6587 27.8777 27.8777 28.5946 28.5946 k = 0.0000 0.2000-0.0000 ( 1089 PWs) bands (ev): -58.5025 -58.5025 -28.4204 -28.4204 -17.5949 -17.5949 -17.4397 -17.4397 9.5429 9.5429 16.0391 16.0391 16.1250 16.1250 20.3226 20.3226 20.6702 20.6702 22.2037 22.2037 24.5699 24.5699 27.9989 27.9989 28.7202 28.7202 k = 0.0000 0.2091-0.0000 ( 1085 PWs) bands (ev): -58.5018 -58.5018 -28.4224 -28.4224 -17.6054 -17.6054 -17.4383 -17.4383 9.6234 9.6234 16.0439 16.0439 16.1561 16.1561 20.2355 20.2355 20.5840 20.5840 22.2146 22.2146 24.4867 24.4867 28.1213 28.1213 28.8462 28.8462 k = 0.0000 0.2182-0.0000 ( 1085 PWs) bands (ev): -58.5012 -58.5012 -28.4245 -28.4245 -17.6162 -17.6162 -17.4368 -17.4368 9.7066 9.7066 16.0450 16.0450 16.1879 16.1879 20.1496 20.1496 20.4985 20.4985 22.2262 22.2262 24.4097 24.4097 28.2445 28.2445 28.9724 28.9724 k = 0.0000 0.2273-0.0000 ( 1085 PWs) bands (ev): -58.5005 -58.5005 -28.4266 -28.4266 -17.6270 -17.6270 -17.4353 -17.4353 9.7926 9.7926 16.0422 16.0422 16.2206 16.2206 20.0651 20.0651 20.4141 20.4141 22.2385 22.2385 24.3397 24.3397 28.3682 28.3682 29.0981 29.0981 k = 0.0000 0.2364-0.0000 ( 1085 PWs) bands (ev): -58.4999 -58.4999 -28.4288 -28.4288 -17.6379 -17.6379 -17.4338 -17.4338 9.8811 9.8811 16.0350 16.0350 16.2538 16.2538 19.9822 19.9822 20.3309 20.3309 22.2512 22.2512 24.2770 24.2770 28.4921 28.4921 29.2217 29.2217 k = 0.0000 0.2455-0.0000 ( 1085 PWs) bands (ev): -58.4992 -58.4992 -28.4309 -28.4309 -17.6489 -17.6489 -17.4322 -17.4322 9.9721 9.9721 16.0231 16.0231 16.2876 16.2876 19.9010 19.9010 20.2491 20.2491 22.2643 22.2643 24.2223 24.2223 28.6160 28.6160 29.3040 29.3040 k = 0.0000 0.2545-0.0000 ( 1077 PWs) bands (ev): -58.4984 -58.4984 -28.4330 -28.4330 -17.6596 -17.6596 -17.4307 -17.4307 10.0655 10.0655 16.0062 16.0062 16.3219 16.3219 19.8217 19.8217 20.1691 20.1691 22.2778 22.2778 24.1758 24.1758 28.7397 28.7397 29.1751 29.1751 k = 0.0000 0.2636-0.0000 ( 1081 PWs) bands (ev): -58.4978 -58.4978 -28.4352 -28.4352 -17.6706 -17.6706 -17.4292 -17.4292 10.1611 10.1611 15.9839 15.9839 16.3566 16.3566 19.7443 19.7443 20.0908 20.0908 22.2915 22.2915 24.1379 24.1379 28.8629 28.8629 29.0228 29.0228 k = 0.0000 0.2727-0.0000 ( 1081 PWs) bands (ev): -58.4972 -58.4972 -28.4373 -28.4373 -17.6814 -17.6814 -17.4277 -17.4277 10.2589 10.2589 15.9561 15.9561 16.3915 16.3915 19.6691 19.6691 20.0146 20.0146 22.3054 22.3054 24.1088 24.1088 28.8720 28.8720 28.9853 28.9853 k = 0.0000 0.2818-0.0000 ( 1081 PWs) bands (ev): -58.4965 -58.4965 -28.4394 -28.4394 -17.6920 -17.6920 -17.4262 -17.4262 10.3588 10.3588 15.9227 15.9227 16.4265 16.4265 19.5961 19.5961 19.9405 19.9405 22.3193 22.3193 24.0886 24.0886 28.7244 28.7244 29.1068 29.1068 k = 0.0000 0.2909-0.0000 ( 1085 PWs) bands (ev): -58.4959 -58.4959 -28.4416 -28.4416 -17.7025 -17.7025 -17.4248 -17.4248 10.4606 10.4606 15.8835 15.8835 16.4615 16.4615 19.5256 19.5256 19.8687 19.8687 22.3333 22.3333 24.0772 24.0772 28.5805 28.5805 29.2272 29.2272 k = 0.0000 0.3000-0.0000 ( 1089 PWs) bands (ev): -58.4953 -58.4953 -28.4437 -28.4437 -17.7129 -17.7129 -17.4234 -17.4234 10.5641 10.5641 15.8385 15.8385 16.4965 16.4965 19.4574 19.4574 19.7992 19.7992 22.3473 22.3473 24.0745 24.0745 28.4405 28.4405 29.3462 29.3462 k = 0.0000 0.3091-0.0000 ( 1089 PWs) bands (ev): -58.4947 -58.4947 -28.4458 -28.4458 -17.7230 -17.7230 -17.4219 -17.4219 10.6693 10.6693 15.7878 15.7878 16.5313 16.5313 19.3918 19.3918 19.7323 19.7323 22.3611 22.3611 24.0803 24.0803 28.3048 28.3048 29.4636 29.4636 k = 0.0000 0.3182-0.0000 ( 1089 PWs) bands (ev): -58.4940 -58.4940 -28.4478 -28.4478 -17.7329 -17.7329 -17.4205 -17.4205 10.7760 10.7760 15.7314 15.7314 16.5657 16.5657 19.3289 19.3289 19.6679 19.6679 22.3748 22.3748 24.0943 24.0943 28.1736 28.1736 29.5792 29.5792 k = 0.0000 0.3273-0.0000 ( 1089 PWs) bands (ev): -58.4934 -58.4934 -28.4497 -28.4497 -17.7425 -17.7425 -17.4192 -17.4192 10.8840 10.8840 15.6696 15.6696 16.5996 16.5996 19.2686 19.2686 19.6063 19.6063 22.3883 22.3883 24.1161 24.1161 28.0471 28.0471 29.6927 29.6927 k = 0.0000 0.3364-0.0000 ( 1089 PWs) bands (ev): -58.4929 -58.4929 -28.4516 -28.4516 -17.7518 -17.7518 -17.4178 -17.4178 10.9931 10.9931 15.6027 15.6027 16.6330 16.6330 19.2111 19.2111 19.5474 19.5474 22.4016 22.4016 24.1452 24.1452 27.9255 27.9255 29.8039 29.8039 k = 0.0000 0.3455-0.0000 ( 1089 PWs) bands (ev): -58.4923 -58.4923 -28.4534 -28.4534 -17.7607 -17.7607 -17.4165 -17.4165 11.1032 11.1032 15.5309 15.5309 16.6656 16.6656 19.1565 19.1565 19.4913 19.4913 22.4144 22.4144 24.1808 24.1808 27.8090 27.8090 29.9123 29.9123 k = 0.0000 0.3545-0.0000 ( 1089 PWs) bands (ev): -58.4917 -58.4917 -28.4552 -28.4552 -17.7693 -17.7693 -17.4153 -17.4153 11.2140 11.2140 15.4545 15.4545 16.6973 16.6973 19.1047 19.1047 19.4382 19.4382 22.4269 22.4269 24.2224 24.2224 27.6979 27.6979 30.0179 30.0179 k = 0.0000 0.3636-0.0000 ( 1089 PWs) bands (ev): -58.4912 -58.4912 -28.4569 -28.4569 -17.7775 -17.7775 -17.4141 -17.4141 11.3254 11.3254 15.3742 15.3742 16.7280 16.7280 19.0558 19.0558 19.3881 19.3881 22.4390 22.4390 24.2690 24.2690 27.5923 27.5923 30.1201 30.1201 k = 0.0000 0.3727-0.0000 ( 1088 PWs) bands (ev): -58.4907 -58.4907 -28.4585 -28.4585 -17.7852 -17.7852 -17.4130 -17.4130 11.4369 11.4369 15.2902 15.2902 16.7575 16.7575 19.0099 19.0099 19.3409 19.3409 22.4505 22.4505 24.3200 24.3200 27.4924 27.4924 30.2186 30.2186 k = 0.0000 0.3818-0.0000 ( 1088 PWs) bands (ev): -58.4903 -58.4903 -28.4600 -28.4600 -17.7926 -17.7926 -17.4119 -17.4119 11.5482 11.5482 15.2033 15.2033 16.7858 16.7858 18.9671 18.9671 19.2969 19.2969 22.4615 22.4615 24.3742 24.3742 27.3985 27.3985 30.3131 30.3131 k = 0.0000 0.3909-0.0000 ( 1092 PWs) bands (ev): -58.4899 -58.4899 -28.4615 -28.4615 -17.7995 -17.7995 -17.4109 -17.4109 11.6590 11.6590 15.1139 15.1139 16.8126 16.8126 18.9272 18.9272 19.2559 19.2559 22.4719 22.4719 24.4307 24.4307 27.3107 27.3107 30.4031 30.4031 k = 0.0000 0.4000-0.0000 ( 1084 PWs) bands (ev): -58.4894 -58.4894 -28.4627 -28.4627 -17.8059 -17.8059 -17.4099 -17.4099 11.7688 11.7688 15.0229 15.0229 16.8378 16.8378 18.8905 18.8905 19.2182 19.2182 22.4817 22.4817 24.4884 24.4884 27.2291 27.2291 30.4882 30.4882 k = 0.0000 0.4091-0.0000 ( 1084 PWs) bands (ev): -58.4890 -58.4890 -28.4640 -28.4640 -17.8118 -17.8118 -17.4090 -17.4090 11.8770 11.8770 14.9311 14.9311 16.8613 16.8613 18.8569 18.8569 19.1836 19.1836 22.4907 22.4907 24.5464 24.5464 27.1540 27.1540 30.5678 30.5678 k = 0.0000 0.4182-0.0000 ( 1084 PWs) bands (ev): -58.4886 -58.4886 -28.4651 -28.4651 -17.8172 -17.8172 -17.4082 -17.4082 11.9828 11.9828 14.8393 14.8393 16.8830 16.8830 18.8263 18.8263 19.1523 19.1523 22.4991 22.4991 24.6033 24.6033 27.0855 27.0855 30.6416 30.6416 k = 0.0000 0.4273-0.0000 ( 1084 PWs) bands (ev): -58.4883 -58.4883 -28.4661 -28.4661 -17.8221 -17.8221 -17.4075 -17.4075 12.0854 12.0854 14.7488 14.7488 16.9028 16.9028 18.7990 18.7990 19.1241 19.1241 22.5066 22.5066 24.6582 24.6582 27.0238 27.0238 30.7090 30.7090 k = 0.0000 0.4364-0.0000 ( 1084 PWs) bands (ev): -58.4880 -58.4880 -28.4670 -28.4670 -17.8264 -17.8264 -17.4069 -17.4069 12.1836 12.1836 14.6607 14.6607 16.9205 16.9205 18.7748 18.7748 19.0993 19.0993 22.5134 22.5134 24.7099 24.7099 26.9690 26.9690 30.7697 30.7697 k = 0.0000 0.4455-0.0000 ( 1084 PWs) bands (ev): -58.4878 -58.4878 -28.4678 -28.4678 -17.8302 -17.8302 -17.4063 -17.4063 12.2759 12.2759 14.5768 14.5768 16.9360 16.9360 18.7538 18.7538 19.0777 19.0777 22.5193 22.5193 24.7573 24.7573 26.9212 26.9212 30.8231 30.8231 k = 0.0000 0.4545-0.0000 ( 1092 PWs) bands (ev): -58.4877 -58.4877 -28.4686 -28.4686 -17.8335 -17.8335 -17.4060 -17.4060 12.3607 12.3607 14.4989 14.4989 16.9493 16.9493 18.7359 18.7359 19.0594 19.0594 22.5243 22.5243 24.7994 24.7994 26.8806 26.8806 30.8689 30.8689 k = 0.0000 0.4636-0.0000 ( 1092 PWs) bands (ev): -58.4875 -58.4875 -28.4691 -28.4691 -17.8361 -17.8361 -17.4056 -17.4056 12.4356 12.4356 14.4294 14.4294 16.9603 16.9603 18.7214 18.7214 19.0445 19.0445 22.5284 22.5284 24.8353 24.8353 26.8472 26.8472 30.9067 30.9067 k = 0.0000 0.4727-0.0000 ( 1100 PWs) bands (ev): -58.4874 -58.4874 -28.4696 -28.4696 -17.8383 -17.8383 -17.4053 -17.4053 12.4982 12.4982 14.3709 14.3709 16.9689 16.9689 18.7099 18.7099 19.0328 19.0328 22.5317 22.5317 24.8641 24.8641 26.8211 26.8211 30.9364 30.9364 k = 0.0000 0.4818-0.0000 ( 1108 PWs) bands (ev): -58.4874 -58.4874 -28.4700 -28.4700 -17.8399 -17.8399 -17.4052 -17.4052 12.5457 12.5457 14.3262 14.3262 16.9751 16.9751 18.7018 18.7018 19.0244 19.0244 22.5340 22.5340 24.8852 24.8852 26.8025 26.8025 30.9578 30.9578 k = 0.0000 0.4909-0.0000 ( 1108 PWs) bands (ev): -58.4874 -58.4874 -28.4702 -28.4702 -17.8408 -17.8408 -17.4050 -17.4050 12.5755 12.5755 14.2982 14.2982 16.9788 16.9788 18.6969 18.6969 19.0194 19.0194 22.5354 22.5354 24.8980 24.8980 26.7913 26.7913 30.9706 30.9706 k = 0.0000 0.5000-0.0000 ( 1108 PWs) bands (ev): -58.4874 -58.4874 -28.4703 -28.4703 -17.8411 -17.8411 -17.4050 -17.4050 12.5856 12.5856 14.2886 14.2886 16.9801 16.9801 18.6953 18.6953 19.0178 19.0178 22.5359 22.5359 24.9023 24.9023 26.7875 26.7875 30.9749 30.9749 k = 0.0000 0.5000-0.0000 ( 1108 PWs) bands (ev): -58.4874 -58.4874 -28.4703 -28.4703 -17.8411 -17.8411 -17.4050 -17.4050 12.5856 12.5856 14.2886 14.2886 16.9801 16.9801 18.6953 18.6953 19.0178 19.0178 22.5359 22.5359 24.9023 24.9023 26.7875 26.7875 30.9749 30.9749 k = 0.0091 0.5000-0.0000 ( 1108 PWs) bands (ev): -58.4873 -58.4873 -28.4703 -28.4703 -17.8411 -17.8411 -17.4052 -17.4052 12.5879 12.5879 14.2876 14.2876 16.9814 16.9814 18.6950 18.6950 19.0173 19.0173 22.5321 22.5321 24.9022 24.9022 26.7925 26.7925 30.9739 30.9739 k = 0.0182 0.5000-0.0000 ( 1108 PWs) bands (ev): -58.4873 -58.4873 -28.4705 -28.4705 -17.8412 -17.8412 -17.4059 -17.4059 12.5947 12.5947 14.2846 14.2846 16.9853 16.9853 18.6940 18.6940 19.0159 19.0159 22.5206 22.5206 24.9020 24.9020 26.8074 26.8074 30.9697 30.9697 k = 0.0273 0.5000-0.0000 ( 1100 PWs) bands (ev): -58.4871 -58.4871 -28.4707 -28.4707 -17.8413 -17.8413 -17.4068 -17.4068 12.6060 12.6060 14.2796 14.2796 16.9919 16.9919 18.6924 18.6924 19.0137 19.0137 22.5018 22.5018 24.9015 24.9015 26.8321 26.8321 30.9597 30.9597 k = 0.0364 0.5000-0.0000 ( 1096 PWs) bands (ev): -58.4869 -58.4869 -28.4710 -28.4710 -17.8414 -17.8414 -17.4083 -17.4083 12.6217 12.6217 14.2727 14.2727 17.0009 17.0009 18.6901 18.6901 19.0110 19.0110 22.4756 22.4756 24.9008 24.9008 26.8665 26.8665 30.9398 30.9398 k = 0.0455 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4867 -58.4867 -28.4714 -28.4714 -17.8415 -17.8415 -17.4101 -17.4101 12.6419 12.6419 14.2638 14.2638 17.0126 17.0126 18.6868 18.6868 19.0079 19.0079 22.4425 22.4425 24.9000 24.9000 26.9104 26.9104 30.9052 30.9052 k = 0.0545 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4865 -58.4865 -28.4719 -28.4719 -17.8418 -17.8418 -17.4125 -17.4125 12.6665 12.6665 14.2530 14.2530 17.0268 17.0268 18.6825 18.6825 19.0048 19.0048 22.4026 22.4026 24.8990 24.8990 26.9634 26.9634 30.8521 30.8521 k = 0.0636 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4862 -58.4862 -28.4726 -28.4726 -17.8422 -17.8422 -17.4152 -17.4152 12.6955 12.6955 14.2401 14.2401 17.0435 17.0435 18.6772 18.6772 19.0019 19.0019 22.3565 22.3565 24.8977 24.8977 27.0252 27.0252 30.7793 30.7793 k = 0.0727 0.5000-0.0000 ( 1080 PWs) bands (ev): -58.4859 -58.4859 -28.4733 -28.4733 -17.8426 -17.8426 -17.4181 -17.4181 12.7287 12.7287 14.2254 14.2254 17.0627 17.0627 18.6706 18.6706 18.9997 18.9997 22.3047 22.3047 24.8963 24.8963 27.0955 27.0955 30.6874 30.6874 k = 0.0818 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4857 -58.4857 -28.4742 -28.4742 -17.8432 -17.8432 -17.4217 -17.4217 12.7661 12.7661 14.2088 14.2088 17.0843 17.0843 18.6627 18.6627 18.9983 18.9983 22.2473 22.2473 24.8946 24.8946 27.1739 27.1739 30.5790 30.5790 k = 0.0909 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4853 -58.4853 -28.4752 -28.4752 -17.8439 -17.8439 -17.4254 -17.4254 12.8076 12.8076 14.1903 14.1903 17.1082 17.1082 18.6537 18.6537 18.9982 18.9982 22.1851 22.1851 24.8928 24.8928 27.2600 27.2600 30.4571 30.4571 k = 0.1000 0.5000-0.0000 ( 1092 PWs) bands (ev): -58.4850 -58.4850 -28.4762 -28.4762 -17.8446 -17.8446 -17.4296 -17.4296 12.8532 12.8532 14.1699 14.1699 17.1344 17.1344 18.6435 18.6435 18.9994 18.9994 22.1186 22.1186 24.8906 24.8906 27.3533 27.3533 30.3246 30.3246 k = 0.1091 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4846 -58.4846 -28.4773 -28.4773 -17.8455 -17.8455 -17.4338 -17.4338 12.9026 12.9026 14.1478 14.1478 17.1629 17.1629 18.6323 18.6323 19.0020 19.0020 22.0482 22.0482 24.8882 24.8882 27.4533 27.4533 30.1838 30.1838 k = 0.1182 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4842 -58.4842 -28.4785 -28.4785 -17.8464 -17.8464 -17.4384 -17.4384 12.9559 12.9559 14.1240 14.1240 17.1935 17.1935 18.6203 18.6203 19.0062 19.0062 21.9744 21.9744 24.8855 24.8855 27.5596 27.5596 30.0371 30.0371 k = 0.1273 0.5000-0.0000 ( 1084 PWs) bands (ev): -58.4837 -58.4837 -28.4798 -28.4798 -17.8475 -17.8475 -17.4431 -17.4431 13.0128 13.0128 14.0985 14.0985 17.2261 17.2261 18.6078 18.6078 19.0119 19.0119 21.8978 21.8978 24.8824 24.8824 27.6716 27.6716 29.8861 29.8861 k = 0.1364 0.5000-0.0000 ( 1084 PWs) bands (ev): -58.4832 -58.4832 -28.4811 -28.4811 -17.8487 -17.8487 -17.4481 -17.4481 13.0732 13.0732 14.0714 14.0714 17.2607 17.2607 18.5951 18.5951 19.0191 19.0191 21.8186 21.8186 24.8789 24.8789 27.7889 27.7889 29.7323 29.7323 k = 0.1455 0.5000-0.0000 ( 1084 PWs) bands (ev): -58.4827 -58.4827 -28.4826 -28.4826 -17.8501 -17.8501 -17.4531 -17.4531 13.1370 13.1370 14.0429 14.0429 17.2970 17.2970 18.5824 18.5824 19.0277 19.0277 21.7375 21.7375 24.8748 24.8748 27.9110 27.9110 29.5771 29.5771 k = 0.1545 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4823 -58.4823 -28.4841 -28.4841 -17.8517 -17.8517 -17.4584 -17.4584 13.2039 13.2039 14.0131 14.0131 17.3348 17.3348 18.5702 18.5702 19.0375 19.0375 21.6548 21.6548 24.8702 24.8702 28.0372 28.0372 29.4215 29.4215 k = 0.1636 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4817 -58.4817 -28.4857 -28.4857 -17.8535 -17.8535 -17.4637 -17.4637 13.2736 13.2736 13.9822 13.9822 17.3742 17.3742 18.5586 18.5586 19.0486 19.0486 21.5709 21.5709 24.8650 24.8650 28.1672 28.1672 29.2666 29.2666 k = 0.1727 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4811 -58.4811 -28.4873 -28.4873 -17.8554 -17.8554 -17.4690 -17.4690 13.3460 13.3460 13.9504 13.9504 17.4149 17.4149 18.5480 18.5480 19.0608 19.0608 21.4862 21.4862 24.8591 24.8591 28.3001 28.3001 29.1131 29.1131 k = 0.1818 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4806 -58.4806 -28.4889 -28.4889 -17.8575 -17.8575 -17.4743 -17.4743 13.4203 13.4203 13.9183 13.9183 17.4566 17.4566 18.5386 18.5386 19.0740 19.0740 21.4010 21.4010 24.8524 24.8524 28.4354 28.4354 28.9620 28.9620 k = 0.1909 0.5000-0.0000 ( 1088 PWs) bands (ev): -58.4799 -58.4799 -28.4906 -28.4906 -17.8598 -17.8598 -17.4796 -17.4796 13.4958 13.4958 13.8866 13.8866 17.4991 17.4991 18.5307 18.5307 19.0881 19.0881 21.3158 21.3158 24.8449 24.8449 28.5712 28.5712 28.8152 28.8152 k = 0.2000 0.5000-0.0000 ( 1092 PWs) bands (ev): -58.4794 -58.4794 -28.4924 -28.4924 -17.8624 -17.8624 -17.4848 -17.4848 13.5702 13.5702 13.8576 13.8576 17.5422 17.5422 18.5246 18.5246 19.1029 19.1029 21.2306 21.2306 24.8364 24.8364 28.6519 28.6519 28.7283 28.7283 k = 0.2091 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4787 -58.4787 -28.4942 -28.4942 -17.8651 -17.8651 -17.4900 -17.4900 13.6373 13.6373 13.8374 13.8374 17.5854 17.5854 18.5203 18.5203 19.1185 19.1185 21.1459 21.1459 24.8269 24.8269 28.5221 28.5221 28.8566 28.8566 k = 0.2182 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4781 -58.4781 -28.4960 -28.4960 -17.8680 -17.8680 -17.4950 -17.4950 13.6788 13.6788 13.8443 13.8443 17.6285 17.6285 18.5183 18.5183 19.1348 19.1348 21.0620 21.0620 24.8164 24.8164 28.3864 28.3864 28.9951 28.9951 k = 0.2273 0.5000-0.0000 ( 1086 PWs) bands (ev): -58.4774 -58.4774 -28.4977 -28.4977 -17.8711 -17.8711 -17.4998 -17.4998 13.6783 13.6783 13.8945 13.8945 17.6712 17.6712 18.5186 18.5186 19.1515 19.1515 20.9790 20.9790 24.8047 24.8047 28.2549 28.2549 29.1336 29.1336 k = 0.2364 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4768 -58.4768 -28.4996 -28.4996 -17.8745 -17.8745 -17.5045 -17.5045 13.6539 13.6539 13.9700 13.9700 17.7129 17.7129 18.5213 18.5213 19.1687 19.1687 20.8972 20.8972 24.7919 24.7919 28.1286 28.1286 29.2705 29.2705 k = 0.2455 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4762 -58.4762 -28.5015 -28.5015 -17.8781 -17.8781 -17.5090 -17.5090 13.6212 13.6212 14.0551 14.0551 17.7534 17.7534 18.5268 18.5268 19.1863 19.1863 20.8167 20.8167 24.7780 24.7780 28.0081 28.0081 29.4047 29.4047 k = 0.2545 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4755 -58.4755 -28.5034 -28.5034 -17.8819 -17.8819 -17.5133 -17.5133 13.5852 13.5852 14.1446 14.1446 17.7922 17.7922 18.5351 18.5351 19.2041 19.2041 20.7379 20.7379 24.7629 24.7629 27.8937 27.8937 29.5349 29.5349 k = 0.2636 0.5000-0.0000 ( 1090 PWs) bands (ev): -58.4749 -58.4749 -28.5052 -28.5052 -17.8858 -17.8858 -17.5174 -17.5174 13.5478 13.5478 14.2368 14.2368 17.8290 17.8290 18.5462 18.5462 19.2221 19.2221 20.6609 20.6609 24.7467 24.7467 27.7858 27.7858 29.6601 29.6601 k = 0.2727 0.5000-0.0000 ( 1086 PWs) bands (ev): -58.4742 -58.4742 -28.5071 -28.5071 -17.8898 -17.8898 -17.5212 -17.5212 13.5097 13.5097 14.3306 14.3306 17.8633 17.8633 18.5601 18.5601 19.2402 19.2402 20.5858 20.5858 24.7295 24.7295 27.6847 27.6847 29.7787 29.7787 k = 0.2818 0.5000-0.0000 ( 1086 PWs) bands (ev): -58.4736 -58.4736 -28.5089 -28.5089 -17.8941 -17.8941 -17.5248 -17.5248 13.4715 13.4715 14.4255 14.4255 17.8950 17.8950 18.5768 18.5768 19.2582 19.2582 20.5127 20.5127 24.7114 24.7114 27.5904 27.5904 29.8892 29.8892 k = 0.2909 0.5000-0.0000 ( 1086 PWs) bands (ev): -58.4729 -58.4729 -28.5107 -28.5107 -17.8985 -17.8985 -17.5282 -17.5282 13.4334 13.4334 14.5212 14.5212 17.9238 17.9238 18.5960 18.5960 19.2760 19.2760 20.4419 20.4419 24.6925 24.6925 27.5032 27.5032 29.9902 29.9902 k = 0.3000 0.5000-0.0000 ( 1086 PWs) bands (ev): -58.4723 -58.4723 -28.5125 -28.5125 -17.9029 -17.9029 -17.5313 -17.5313 13.3958 13.3958 14.6173 14.6173 17.9495 17.9495 18.6176 18.6176 19.2937 19.2937 20.3735 20.3735 24.6730 24.6730 27.4232 27.4232 30.0803 30.0803 k = 0.3091 0.5000-0.0000 ( 1086 PWs) bands (ev): -58.4717 -58.4717 -28.5143 -28.5143 -17.9075 -17.9075 -17.5342 -17.5342 13.3586 13.3586 14.7134 14.7134 17.9723 17.9723 18.6411 18.6411 19.3109 19.3109 20.3076 20.3076 24.6533 24.6533 27.3503 27.3503 30.1583 30.1583 k = 0.3182 0.5000-0.0000 ( 1084 PWs) bands (ev): -58.4711 -58.4711 -28.5160 -28.5160 -17.9120 -17.9120 -17.5369 -17.5369 13.3223 13.3223 14.8094 14.8094 17.9921 17.9921 18.6660 18.6660 19.3276 19.3276 20.2444 20.2444 24.6335 24.6335 27.2845 27.2845 30.2236 30.2236 k = 0.3273 0.5000-0.0000 ( 1084 PWs) bands (ev): -58.4705 -58.4705 -28.5177 -28.5177 -17.9166 -17.9166 -17.5393 -17.5393 13.2868 13.2868 14.9048 14.9048 18.0091 18.0091 18.6919 18.6919 19.3436 19.3436 20.1839 20.1839 24.6139 24.6139 27.2256 27.2256 30.2759 30.2759 k = 0.3364 0.5000-0.0000 ( 1084 PWs) bands (ev): -58.4699 -58.4699 -28.5194 -28.5194 -17.9212 -17.9212 -17.5415 -17.5415 13.2524 13.2524 14.9994 14.9994 18.0234 18.0234 18.7183 18.7183 19.3589 19.3589 20.1263 20.1263 24.5948 24.5948 27.1736 27.1736 30.3158 30.3158 k = 0.3455 0.5000-0.0000 ( 1084 PWs) bands (ev): -58.4694 -58.4694 -28.5210 -28.5210 -17.9258 -17.9258 -17.5435 -17.5435 13.2191 13.2191 15.0928 15.0928 18.0352 18.0352 18.7448 18.7448 19.3732 19.3732 20.0717 20.0717 24.5764 24.5764 27.1280 27.1280 30.3442 30.3442 k = 0.3545 0.5000-0.0000 ( 1082 PWs) bands (ev): -58.4689 -58.4689 -28.5225 -28.5225 -17.9302 -17.9302 -17.5453 -17.5453 13.1871 13.1871 15.1847 15.1847 18.0446 18.0446 18.7707 18.7707 19.3863 19.3863 20.0202 20.0202 24.5592 24.5592 27.0887 27.0887 30.3624 30.3624 k = 0.3636 0.5000-0.0000 ( 1082 PWs) bands (ev): -58.4684 -58.4684 -28.5239 -28.5239 -17.9346 -17.9346 -17.5469 -17.5469 13.1565 13.1565 15.2747 15.2747 18.0518 18.0518 18.7959 18.7959 19.3981 19.3981 19.9721 19.9721 24.5433 24.5433 27.0553 27.0553 30.3721 30.3721 k = 0.3727 0.5000-0.0000 ( 1082 PWs) bands (ev): -58.4679 -58.4679 -28.5253 -28.5253 -17.9389 -17.9389 -17.5484 -17.5484 13.1274 13.1274 15.3626 15.3626 18.0570 18.0570 18.8200 18.8200 19.4084 19.4084 19.9275 19.9275 24.5288 24.5288 27.0274 27.0274 30.3748 30.3748 k = 0.3818 0.5000-0.0000 ( 1082 PWs) bands (ev): -58.4674 -58.4674 -28.5267 -28.5267 -17.9429 -17.9429 -17.5496 -17.5496 13.0999 13.0999 15.4477 15.4477 18.0603 18.0603 18.8426 18.8426 19.4169 19.4169 19.8866 19.8866 24.5160 24.5160 27.0045 27.0045 30.3720 30.3720 k = 0.3909 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4669 -58.4669 -28.5278 -28.5278 -17.9467 -17.9467 -17.5507 -17.5507 13.0741 13.0741 15.5299 15.5299 18.0619 18.0619 18.8637 18.8637 19.4235 19.4235 19.8495 19.8495 24.5048 24.5048 26.9863 26.9863 30.3653 30.3653 k = 0.4000 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4665 -58.4665 -28.5290 -28.5290 -17.9504 -17.9504 -17.5517 -17.5517 13.0501 13.0501 15.6084 15.6084 18.0620 18.0620 18.8831 18.8831 19.4280 19.4280 19.8166 19.8166 24.4954 24.4954 26.9723 26.9723 30.3556 30.3556 k = 0.4091 0.5000-0.0000 ( 1078 PWs) bands (ev): -58.4662 -58.4662 -28.5301 -28.5301 -17.9539 -17.9539 -17.5526 -17.5526 13.0279 13.0279 15.6830 15.6830 18.0606 18.0606 18.9008 18.9008 19.4301 19.4301 19.7878 19.7878 24.4876 24.4876 26.9619 26.9619 30.3440 30.3440 k = 0.4182 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4658 -58.4658 -28.5310 -28.5310 -17.9571 -17.9571 -17.5533 -17.5533 13.0076 13.0076 15.7530 15.7530 18.0581 18.0581 18.9166 18.9166 19.4300 19.4300 19.7634 19.7634 24.4814 24.4814 26.9547 26.9547 30.3315 30.3315 k = 0.4273 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4655 -58.4655 -28.5319 -28.5319 -17.9600 -17.9600 -17.5539 -17.5539 12.9893 12.9893 15.8179 15.8179 18.0546 18.0546 18.9308 18.9308 19.4278 19.4278 19.7431 19.7431 24.4767 24.4767 26.9501 26.9501 30.3188 30.3188 k = 0.4364 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4652 -58.4652 -28.5327 -28.5327 -17.9626 -17.9626 -17.5545 -17.5545 12.9730 12.9730 15.8771 15.8771 18.0505 18.0505 18.9432 18.9432 19.4237 19.4237 19.7269 19.7269 24.4732 24.4732 26.9476 26.9476 30.3064 30.3064 k = 0.4455 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4650 -58.4650 -28.5334 -28.5334 -17.9649 -17.9649 -17.5549 -17.5549 12.9588 12.9588 15.9300 15.9300 18.0460 18.0460 18.9538 18.9538 19.4183 19.4183 19.7143 19.7143 24.4707 24.4707 26.9468 26.9468 30.2949 30.2949 k = 0.4545 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4648 -58.4648 -28.5340 -28.5340 -17.9669 -17.9669 -17.5553 -17.5553 12.9467 12.9467 15.9761 15.9761 18.0414 18.0414 18.9629 18.9629 19.4122 19.4122 19.7048 19.7048 24.4691 24.4691 26.9470 26.9470 30.2845 30.2845 k = 0.4636 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4646 -58.4646 -28.5345 -28.5345 -17.9686 -17.9686 -17.5556 -17.5556 12.9367 12.9367 16.0147 16.0147 18.0370 18.0370 18.9702 18.9702 19.4060 19.4060 19.6980 19.6980 24.4681 24.4681 26.9479 26.9479 30.2757 30.2757 k = 0.4727 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4645 -58.4645 -28.5349 -28.5349 -17.9698 -17.9698 -17.5558 -17.5558 12.9289 12.9289 16.0453 16.0453 18.0333 18.0333 18.9760 18.9760 19.4005 19.4005 19.6932 19.6932 24.4676 24.4676 26.9490 26.9490 30.2686 30.2686 k = 0.4818 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4644 -58.4644 -28.5351 -28.5351 -17.9708 -17.9708 -17.5560 -17.5560 12.9234 12.9234 16.0676 16.0676 18.0303 18.0303 18.9801 18.9801 19.3961 19.3961 19.6900 19.6900 24.4673 24.4673 26.9501 26.9501 30.2634 30.2634 k = 0.4909 0.5000-0.0000 ( 1074 PWs) bands (ev): -58.4644 -58.4644 -28.5353 -28.5353 -17.9713 -17.9713 -17.5561 -17.5561 12.9200 12.9200 16.0811 16.0811 18.0285 18.0285 18.9826 18.9826 19.3934 19.3934 19.6883 19.6883 24.4672 24.4672 26.9508 26.9508 30.2602 30.2602 k = 0.5000 0.5000-0.0000 ( 1092 PWs) bands (ev): -58.4645 -58.4645 -28.5355 -28.5355 -17.9717 -17.9717 -17.5563 -17.5563 12.9189 12.9189 16.0855 16.0855 18.0278 18.0278 18.9834 18.9834 19.3923 19.3923 19.6877 19.6877 24.4671 24.4671 26.9510 26.9510 30.2590 30.2590 k = 0.5000 0.5000-0.0000 ( 1092 PWs) bands (ev): -58.4645 -58.4645 -28.5355 -28.5355 -17.9717 -17.9717 -17.5563 -17.5563 12.9189 12.9189 16.0855 16.0855 18.0278 18.0278 18.9834 18.9834 19.3923 19.3923 19.6877 19.6877 24.4671 24.4671 26.9510 26.9510 30.2590 30.2590 k = 0.4936 0.4936-0.0000 ( 1079 PWs) bands (ev): -58.4644 -58.4644 -28.5353 -28.5353 -17.9714 -17.9714 -17.5561 -17.5561 12.9200 12.9200 16.0811 16.0811 18.0285 18.0285 18.9826 18.9826 19.3933 19.3933 19.6883 19.6883 24.4672 24.4672 26.9508 26.9508 30.2602 30.2602 k = 0.4872 0.4872-0.0000 ( 1079 PWs) bands (ev): -58.4645 -58.4645 -28.5352 -28.5352 -17.9708 -17.9708 -17.5560 -17.5560 12.9233 12.9233 16.0677 16.0677 18.0303 18.0303 18.9801 18.9801 19.3962 19.3962 19.6899 19.6899 24.4673 24.4673 26.9500 26.9500 30.2633 30.2633 k = 0.4808 0.4808-0.0000 ( 1079 PWs) bands (ev): -58.4646 -58.4646 -28.5349 -28.5349 -17.9699 -17.9699 -17.5559 -17.5559 12.9288 12.9288 16.0457 16.0457 18.0331 18.0331 18.9761 18.9761 19.4009 19.4009 19.6927 19.6927 24.4674 24.4674 26.9486 26.9486 30.2686 30.2686 k = 0.4744 0.4744-0.0000 ( 1079 PWs) bands (ev): -58.4647 -58.4647 -28.5345 -28.5345 -17.9686 -17.9686 -17.5557 -17.5557 12.9363 12.9363 16.0155 16.0155 18.0366 18.0366 18.9707 18.9707 19.4072 19.4072 19.6967 19.6967 24.4677 24.4677 26.9466 26.9466 30.2759 30.2759 k = 0.4679 0.4679-0.0000 ( 1079 PWs) bands (ev): -58.4649 -58.4649 -28.5341 -28.5341 -17.9669 -17.9669 -17.5554 -17.5554 12.9457 12.9457 15.9778 15.9778 18.0404 18.0404 18.9639 18.9639 19.4152 19.4152 19.7018 19.7018 24.4682 24.4682 26.9439 26.9439 30.2853 30.2853 k = 0.4615 0.4615-0.0000 ( 1079 PWs) bands (ev): -58.4651 -58.4651 -28.5335 -28.5335 -17.9649 -17.9649 -17.5551 -17.5551 12.9568 12.9568 15.9332 15.9332 18.0441 18.0441 18.9558 18.9558 19.4247 19.4247 19.7080 19.7080 24.4689 24.4689 26.9406 26.9406 30.2966 30.2966 k = 0.4551 0.4551-0.0000 ( 1079 PWs) bands (ev): -58.4653 -58.4653 -28.5328 -28.5328 -17.9625 -17.9625 -17.5547 -17.5547 12.9693 12.9693 15.8826 15.8826 18.0471 18.0471 18.9467 18.9467 19.4354 19.4354 19.7155 19.7155 24.4699 24.4699 26.9365 26.9365 30.3098 30.3098 k = 0.4487 0.4487-0.0000 ( 1079 PWs) bands (ev): -58.4656 -58.4656 -28.5320 -28.5320 -17.9598 -17.9598 -17.5542 -17.5542 12.9831 12.9831 15.8269 15.8269 18.0490 18.0490 18.9366 18.9366 19.4473 19.4473 19.7243 19.7243 24.4712 24.4712 26.9315 26.9315 30.3246 30.3246 k = 0.4423 0.4423-0.0000 ( 1081 PWs) bands (ev): -58.4659 -58.4659 -28.5311 -28.5311 -17.9567 -17.9567 -17.5537 -17.5537 12.9976 12.9976 15.7670 15.7670 18.0495 18.0495 18.9257 18.9257 19.4602 19.4602 19.7344 19.7344 24.4730 24.4730 26.9258 26.9258 30.3407 30.3407 k = 0.4359 0.4359-0.0000 ( 1085 PWs) bands (ev): -58.4663 -58.4663 -28.5301 -28.5301 -17.9533 -17.9533 -17.5532 -17.5532 13.0126 13.0126 15.7039 15.7039 18.0480 18.0480 18.9141 18.9141 19.4739 19.4739 19.7458 19.7458 24.4754 24.4754 26.9192 26.9192 30.3580 30.3580 k = 0.4295 0.4295-0.0000 ( 1085 PWs) bands (ev): -58.4667 -58.4667 -28.5290 -28.5290 -17.9495 -17.9495 -17.5525 -17.5525 13.0273 13.0273 15.6386 15.6386 18.0443 18.0443 18.9018 18.9018 19.4884 19.4884 19.7586 19.7586 24.4784 24.4784 26.9118 26.9118 30.3761 30.3761 k = 0.4231 0.4231-0.0000 ( 1089 PWs) bands (ev): -58.4671 -58.4671 -28.5278 -28.5278 -17.9454 -17.9454 -17.5519 -17.5519 13.0412 13.0412 15.5724 15.5724 18.0381 18.0381 18.8889 18.8889 19.5034 19.5034 19.7728 19.7728 24.4821 24.4821 26.9037 26.9037 30.3943 30.3943 k = 0.4167 0.4167-0.0000 ( 1089 PWs) bands (ev): -58.4675 -58.4675 -28.5265 -28.5265 -17.9410 -17.9410 -17.5511 -17.5511 13.0536 13.0536 15.5065 15.5065 18.0291 18.0291 18.8755 18.8755 19.5190 19.5190 19.7885 19.7885 24.4867 24.4867 26.8948 26.8948 30.4124 30.4124 k = 0.4103 0.4103-0.0000 ( 1075 PWs) bands (ev): -58.4679 -58.4679 -28.5250 -28.5250 -17.9360 -17.9360 -17.5501 -17.5501 13.0636 13.0636 15.4420 15.4420 18.0172 18.0172 18.8616 18.8616 19.5350 19.5350 19.8058 19.8058 24.4922 24.4922 26.8853 26.8853 30.4296 30.4296 k = 0.4038 0.4038-0.0000 ( 1075 PWs) bands (ev): -58.4684 -58.4684 -28.5235 -28.5235 -17.9308 -17.9308 -17.5492 -17.5492 13.0703 13.0703 15.3804 15.3804 18.0024 18.0024 18.8473 18.8473 19.5513 19.5513 19.8246 19.8246 24.4988 24.4988 26.8753 26.8753 30.4452 30.4452 k = 0.3974 0.3974-0.0000 ( 1067 PWs) bands (ev): -58.4688 -58.4688 -28.5218 -28.5218 -17.9253 -17.9253 -17.5481 -17.5481 13.0725 13.0725 15.3229 15.3229 17.9845 17.9845 18.8324 18.8324 19.5680 19.5680 19.8450 19.8450 24.5066 24.5066 26.8649 26.8649 30.4588 30.4588 k = 0.3910 0.3910-0.0000 ( 1067 PWs) bands (ev): -58.4694 -58.4694 -28.5201 -28.5201 -17.9195 -17.9195 -17.5471 -17.5471 13.0691 13.0691 15.2711 15.2711 17.9636 17.9636 18.8170 18.8170 19.5850 19.5850 19.8670 19.8670 24.5155 24.5155 26.8542 26.8542 30.4697 30.4697 k = 0.3846 0.3846-0.0000 ( 1069 PWs) bands (ev): -58.4700 -58.4700 -28.5184 -28.5184 -17.9134 -17.9134 -17.5461 -17.5461 13.0591 13.0591 15.2263 15.2263 17.9397 17.9397 18.8012 18.8012 19.6023 19.6023 19.8905 19.8905 24.5257 24.5257 26.8435 26.8435 30.4775 30.4775 k = 0.3782 0.3782-0.0000 ( 1069 PWs) bands (ev): -58.4706 -58.4706 -28.5165 -28.5165 -17.9070 -17.9070 -17.5450 -17.5450 13.0414 13.0414 15.1897 15.1897 17.9129 17.9129 18.7847 18.7847 19.6199 19.6199 19.9156 19.9156 24.5373 24.5373 26.8329 26.8329 30.4818 30.4818 k = 0.3718 0.3718-0.0000 ( 1073 PWs) bands (ev): -58.4713 -58.4713 -28.5146 -28.5146 -17.9004 -17.9004 -17.5439 -17.5439 13.0151 13.0151 15.1625 15.1625 17.8834 17.8834 18.7678 18.7678 19.6379 19.6379 19.9422 19.9422 24.5503 24.5503 26.8225 26.8225 30.4823 30.4823 k = 0.3654 0.3654-0.0000 ( 1073 PWs) bands (ev): -58.4720 -58.4720 -28.5126 -28.5126 -17.8934 -17.8934 -17.5426 -17.5426 12.9795 12.9795 15.1453 15.1453 17.8512 17.8512 18.7503 18.7503 19.6564 19.6564 19.9703 19.9703 24.5648 24.5648 26.8125 26.8125 30.4790 30.4790 k = 0.3590 0.3590-0.0000 ( 1073 PWs) bands (ev): -58.4727 -58.4727 -28.5105 -28.5105 -17.8861 -17.8861 -17.5413 -17.5413 12.9345 12.9345 15.1387 15.1387 17.8165 17.8165 18.7324 18.7324 19.6754 19.6754 19.9999 19.9999 24.5809 24.5809 26.8030 26.8030 30.4721 30.4721 k = 0.3526 0.3526-0.0000 ( 1079 PWs) bands (ev): -58.4735 -58.4735 -28.5084 -28.5084 -17.8786 -17.8786 -17.5401 -17.5401 12.8799 12.8799 15.1427 15.1427 17.7795 17.7795 18.7140 18.7140 19.6949 19.6949 20.0310 20.0310 24.5985 24.5985 26.7942 26.7942 30.4618 30.4618 k = 0.3462 0.3462-0.0000 ( 1079 PWs) bands (ev): -58.4742 -58.4742 -28.5062 -28.5062 -17.8708 -17.8708 -17.5387 -17.5387 12.8162 12.8162 15.1569 15.1569 17.7404 17.7404 18.6953 18.6953 19.7151 19.7151 20.0635 20.0635 24.6178 24.6178 26.7862 26.7862 30.4485 30.4485 k = 0.3397 0.3397-0.0000 ( 1079 PWs) bands (ev): -58.4750 -58.4750 -28.5038 -28.5038 -17.8628 -17.8628 -17.5373 -17.5373 12.7440 12.7440 15.1808 15.1808 17.6993 17.6993 18.6764 18.6764 19.7361 19.7361 20.0974 20.0974 24.6388 24.6388 26.7789 26.7789 30.4327 30.4327 k = 0.3333 0.3333-0.0000 ( 1075 PWs) bands (ev): -58.4757 -58.4757 -28.5014 -28.5014 -17.8544 -17.8544 -17.5357 -17.5357 12.6639 12.6639 15.2136 15.2136 17.6564 17.6564 18.6575 18.6575 19.7579 19.7579 20.1327 20.1327 24.6614 24.6614 26.7726 26.7726 30.4150 30.4150 k = 0.3269 0.3269-0.0000 ( 1081 PWs) bands (ev): -58.4766 -58.4766 -28.4991 -28.4991 -17.8460 -17.8460 -17.5342 -17.5342 12.5770 12.5770 15.2542 15.2542 17.6118 17.6118 18.6389 18.6389 19.7807 19.7807 20.1692 20.1692 24.6856 24.6856 26.7671 26.7671 30.3960 30.3960 k = 0.3205 0.3205-0.0000 ( 1081 PWs) bands (ev): -58.4774 -58.4774 -28.4966 -28.4966 -17.8373 -17.8373 -17.5326 -17.5326 12.4840 12.4840 15.3016 15.3016 17.5658 17.5658 18.6208 18.6208 19.8043 19.8043 20.2069 20.2069 24.7116 24.7116 26.7624 26.7624 30.3764 30.3764 k = 0.3141 0.3141-0.0000 ( 1077 PWs) bands (ev): -58.4782 -58.4782 -28.4940 -28.4940 -17.8282 -17.8282 -17.5310 -17.5310 12.3860 12.3860 15.3549 15.3549 17.5184 17.5184 18.6036 18.6036 19.8291 19.8291 20.2458 20.2458 24.7392 24.7392 26.7586 26.7586 30.3567 30.3567 k = 0.3077 0.3077-0.0000 ( 1077 PWs) bands (ev): -58.4791 -58.4791 -28.4914 -28.4914 -17.8191 -17.8191 -17.5293 -17.5293 12.2836 12.2836 15.4129 15.4129 17.4699 17.4699 18.5876 18.5876 19.8549 19.8549 20.2858 20.2858 24.7685 24.7685 26.7556 26.7556 30.3377 30.3377 k = 0.3013 0.3013-0.0000 ( 1077 PWs) bands (ev): -58.4800 -58.4800 -28.4888 -28.4888 -17.8098 -17.8098 -17.5276 -17.5276 12.1777 12.1777 15.4746 15.4746 17.4204 17.4204 18.5734 18.5734 19.8819 19.8819 20.3269 20.3269 24.7994 24.7994 26.7531 26.7531 30.3200 30.3200 k = 0.2949 0.2949-0.0000 ( 1077 PWs) bands (ev): -58.4809 -58.4809 -28.4862 -28.4862 -17.8003 -17.8003 -17.5258 -17.5258 12.0689 12.0689 15.5389 15.5389 17.3701 17.3701 18.5614 18.5614 19.9102 19.9102 20.3691 20.3691 24.8318 24.8318 26.7512 26.7512 30.3040 30.3040 k = 0.2885 0.2885-0.0000 ( 1077 PWs) bands (ev): -58.4818 -58.4818 -28.4834 -28.4834 -17.7906 -17.7906 -17.5240 -17.5240 11.9578 11.9578 15.6049 15.6049 17.3190 17.3190 18.5523 18.5523 19.9397 19.9397 20.4122 20.4122 24.8658 24.8658 26.7497 26.7497 30.2904 30.2904 k = 0.2821 0.2821-0.0000 ( 1077 PWs) bands (ev): -58.4827 -58.4827 -28.4807 -28.4807 -17.7808 -17.7808 -17.5222 -17.5222 11.8451 11.8451 15.6714 15.6714 17.2674 17.2674 18.5467 18.5467 19.9705 19.9705 20.4562 20.4562 24.9013 24.9013 26.7484 26.7484 30.2797 30.2797 k = 0.2756 0.2756-0.0000 ( 1081 PWs) bands (ev): -58.4836 -58.4836 -28.4780 -28.4780 -17.7709 -17.7709 -17.5204 -17.5204 11.7310 11.7310 15.7376 15.7376 17.2153 17.2153 18.5453 18.5453 20.0026 20.0026 20.5011 20.5011 24.9381 24.9381 26.7472 26.7472 30.2724 30.2724 k = 0.2692 0.2692-0.0000 ( 1079 PWs) bands (ev): -58.4845 -58.4845 -28.4752 -28.4752 -17.7609 -17.7609 -17.5184 -17.5184 11.6162 11.6162 15.8022 15.8022 17.1629 17.1629 18.5489 18.5489 20.0362 20.0362 20.5469 20.5469 24.9764 24.9764 26.7459 26.7459 30.2689 30.2689 k = 0.2628 0.2628-0.0000 ( 1079 PWs) bands (ev): -58.4854 -58.4854 -28.4724 -28.4724 -17.7508 -17.7508 -17.5165 -17.5165 11.5010 11.5010 15.8645 15.8645 17.1103 17.1103 18.5581 18.5581 20.0711 20.0711 20.5933 20.5933 25.0159 25.0159 26.7443 26.7443 30.2695 30.2695 k = 0.2564 0.2564-0.0000 ( 1073 PWs) bands (ev): -58.4863 -58.4863 -28.4695 -28.4695 -17.7405 -17.7405 -17.5145 -17.5145 11.3857 11.3857 15.9234 15.9234 17.0577 17.0577 18.5739 18.5739 20.1075 20.1075 20.6404 20.6404 25.0567 25.0567 26.7423 26.7423 30.2748 30.2748 k = 0.2500 0.2500-0.0000 ( 1073 PWs) bands (ev): -58.4872 -58.4872 -28.4667 -28.4667 -17.7302 -17.7302 -17.5126 -17.5126 11.2706 11.2706 15.9781 15.9781 17.0051 17.0051 18.5967 18.5967 20.1452 20.1452 20.6881 20.6881 25.0986 25.0986 26.7396 26.7396 30.2848 30.2848 k = 0.2436 0.2436-0.0000 ( 1073 PWs) bands (ev): -58.4881 -58.4881 -28.4638 -28.4638 -17.7198 -17.7198 -17.5106 -17.5106 11.1561 11.1561 16.0277 16.0277 16.9526 16.9526 18.6274 18.6274 20.1845 20.1845 20.7364 20.7364 25.1415 25.1415 26.7363 26.7363 30.2999 30.2999 k = 0.2372 0.2372-0.0000 ( 1083 PWs) bands (ev): -58.4892 -58.4892 -28.4611 -28.4611 -17.7096 -17.7096 -17.5087 -17.5087 11.0423 11.0423 16.0717 16.0717 16.9003 16.9003 18.6662 18.6662 20.2251 20.2251 20.7852 20.7852 25.1853 25.1853 26.7322 26.7322 30.3202 30.3202 k = 0.2308 0.2308-0.0000 ( 1083 PWs) bands (ev): -58.4901 -58.4901 -28.4582 -28.4582 -17.6992 -17.6992 -17.5067 -17.5067 10.9294 10.9294 16.1095 16.1095 16.8484 16.8484 18.7138 18.7138 20.2672 20.2672 20.8344 20.8344 25.2300 25.2300 26.7271 26.7271 30.3460 30.3460 k = 0.2244 0.2244-0.0000 ( 1083 PWs) bands (ev): -58.4910 -58.4910 -28.4554 -28.4554 -17.6889 -17.6889 -17.5047 -17.5047 10.8178 10.8178 16.1409 16.1409 16.7970 16.7970 18.7700 18.7700 20.3107 20.3107 20.8840 20.8840 25.2754 25.2754 26.7212 26.7212 30.3772 30.3772 k = 0.2179 0.2179-0.0000 ( 1079 PWs) bands (ev): -58.4919 -58.4919 -28.4526 -28.4526 -17.6784 -17.6784 -17.5026 -17.5026 10.7076 10.7076 16.1658 16.1658 16.7461 16.7461 18.8350 18.8350 20.3557 20.3557 20.9339 20.9339 25.3214 25.3214 26.7142 26.7142 30.4135 30.4135 k = 0.2115 0.2115-0.0000 ( 1077 PWs) bands (ev): -58.4928 -58.4928 -28.4498 -28.4498 -17.6681 -17.6681 -17.5006 -17.5006 10.5990 10.5990 16.1843 16.1843 16.6958 16.6958 18.9085 18.9085 20.4021 20.4021 20.9840 20.9840 25.3677 25.3677 26.7063 26.7063 30.4531 30.4531 k = 0.2051 0.2051-0.0000 ( 1077 PWs) bands (ev): -58.4937 -58.4937 -28.4470 -28.4470 -17.6578 -17.6578 -17.4985 -17.4985 10.4921 10.4921 16.1966 16.1966 16.6461 16.6461 18.9900 18.9900 20.4499 20.4499 21.0343 21.0343 25.4144 25.4144 26.6975 26.6975 30.4314 30.4314 k = 0.1987 0.1987-0.0000 ( 1077 PWs) bands (ev): -58.4946 -58.4946 -28.4442 -28.4442 -17.6476 -17.6476 -17.4965 -17.4965 10.3872 10.3872 16.2031 16.2031 16.5973 16.5973 19.0790 19.0790 20.4989 20.4989 21.0847 21.0847 25.4611 25.4611 26.6879 26.6879 30.2558 30.2558 k = 0.1923 0.1923-0.0000 ( 1073 PWs) bands (ev): -58.4954 -58.4954 -28.4415 -28.4415 -17.6375 -17.6375 -17.4945 -17.4945 10.2843 10.2843 16.2044 16.2044 16.5493 16.5493 19.1749 19.1749 20.5493 20.5493 21.1352 21.1352 25.5077 25.5077 26.6776 26.6776 30.0726 30.0726 k = 0.1859 0.1859-0.0000 ( 1073 PWs) bands (ev): -58.4963 -58.4963 -28.4388 -28.4388 -17.6275 -17.6275 -17.4925 -17.4925 10.1836 10.1836 16.2010 16.2010 16.5022 16.5022 19.2768 19.2768 20.6009 20.6009 21.1857 21.1857 25.5540 25.5540 26.6668 26.6668 29.8902 29.8902 k = 0.1795 0.1795-0.0000 ( 1073 PWs) bands (ev): -58.4971 -58.4971 -28.4362 -28.4362 -17.6176 -17.6176 -17.4905 -17.4905 10.0852 10.0852 16.1933 16.1933 16.4561 16.4561 19.3840 19.3840 20.6536 20.6536 21.2362 21.2362 25.5998 25.5998 26.6556 26.6556 29.7096 29.7096 k = 0.1731 0.1731-0.0000 ( 1081 PWs) bands (ev): -58.4981 -58.4981 -28.4337 -28.4337 -17.6080 -17.6080 -17.4886 -17.4886 9.9892 9.9892 16.1821 16.1821 16.4110 16.4110 19.4957 19.4957 20.7074 20.7074 21.2865 21.2865 25.6447 25.6447 26.6443 26.6443 29.5314 29.5314 k = 0.1667 0.1667-0.0000 ( 1081 PWs) bands (ev): -58.4989 -58.4989 -28.4311 -28.4311 -17.5984 -17.5984 -17.4867 -17.4867 9.8958 9.8958 16.1679 16.1679 16.3670 16.3670 19.6112 19.6112 20.7622 20.7622 21.3368 21.3368 25.6885 25.6885 26.6331 26.6331 29.3560 29.3560 k = 0.1603 0.1603-0.0000 ( 1081 PWs) bands (ev): -58.4997 -58.4997 -28.4286 -28.4286 -17.5890 -17.5890 -17.4848 -17.4848 9.8051 9.8051 16.1512 16.1512 16.3243 16.3243 19.7295 19.7295 20.8178 20.8178 21.3869 21.3869 25.7309 25.7309 26.6224 26.6224 29.1836 29.1836 k = 0.1538 0.1538-0.0000 ( 1081 PWs) bands (ev): -58.5005 -58.5005 -28.4262 -28.4262 -17.5798 -17.5798 -17.4830 -17.4830 9.7172 9.7172 16.1325 16.1325 16.2827 16.2827 19.8500 19.8500 20.8742 20.8742 21.4368 21.4368 25.7714 25.7714 26.6124 26.6124 29.0147 29.0147 k = 0.1474 0.1474-0.0000 ( 1077 PWs) bands (ev): -58.5012 -58.5012 -28.4238 -28.4238 -17.5708 -17.5708 -17.4811 -17.4811 9.6321 9.6321 16.1122 16.1122 16.2424 16.2424 19.9719 19.9719 20.9312 20.9312 21.4866 21.4866 25.8096 25.8096 26.6036 26.6036 28.8495 28.8495 k = 0.1410 0.1410-0.0000 ( 1077 PWs) bands (ev): -58.5019 -58.5019 -28.4215 -28.4215 -17.5621 -17.5621 -17.4793 -17.4793 9.5500 9.5500 16.0907 16.0907 16.2034 16.2034 20.0944 20.0944 20.9885 20.9885 21.5362 21.5362 25.8451 25.8451 26.5963 26.5963 28.6883 28.6883 k = 0.1346 0.1346-0.0000 ( 1077 PWs) bands (ev): -58.5026 -58.5026 -28.4193 -28.4193 -17.5536 -17.5536 -17.4776 -17.4776 9.4709 9.4709 16.0684 16.0684 16.1658 16.1658 20.2168 20.2168 21.0460 21.0460 21.5856 21.5856 25.8772 25.8772 26.5910 26.5910 28.5314 28.5314 k = 0.1282 0.1282-0.0000 ( 1077 PWs) bands (ev): -58.5033 -58.5033 -28.4171 -28.4171 -17.5453 -17.5453 -17.4759 -17.4759 9.3950 9.3950 16.0456 16.0456 16.1297 16.1297 20.3385 20.3385 21.1034 21.1034 21.6350 21.6350 25.9054 25.9054 26.5882 26.5882 28.3793 28.3793 k = 0.1218 0.1218-0.0000 ( 1073 PWs) bands (ev): -58.5039 -58.5039 -28.4150 -28.4150 -17.5374 -17.5374 -17.4742 -17.4742 9.3223 9.3223 16.0226 16.0226 16.0950 16.0950 20.4587 20.4587 21.1605 21.1605 21.6843 21.6843 25.9293 25.9293 26.5882 26.5882 28.2323 28.2323 k = 0.1154 0.1154-0.0000 ( 1077 PWs) bands (ev): -58.5046 -58.5046 -28.4131 -28.4131 -17.5297 -17.5297 -17.4728 -17.4728 9.2529 9.2529 15.9996 15.9996 16.0618 16.0618 20.5768 20.5768 21.2168 21.2168 21.7335 21.7335 25.9482 25.9482 26.5913 26.5913 28.0907 28.0907 k = 0.1090 0.1090-0.0000 ( 1077 PWs) bands (ev): -58.5052 -58.5052 -28.4112 -28.4112 -17.5224 -17.5224 -17.4713 -17.4713 9.1869 9.1869 15.9769 15.9769 16.0301 16.0301 20.6921 20.6921 21.2722 21.2722 21.7828 21.7828 25.9620 25.9620 26.5978 26.5978 27.9550 27.9550 k = 0.1026 0.1026-0.0000 ( 1077 PWs) bands (ev): -58.5058 -58.5058 -28.4093 -28.4093 -17.5154 -17.5154 -17.4698 -17.4698 9.1242 9.1242 15.9546 15.9546 16.0000 16.0000 20.8041 20.8041 21.3262 21.3262 21.8322 21.8322 25.9703 25.9703 26.6076 26.6076 27.8255 27.8255 k = 0.0962 0.0962-0.0000 ( 1077 PWs) bands (ev): -58.5064 -58.5064 -28.4076 -28.4076 -17.5087 -17.5087 -17.4685 -17.4685 9.0651 9.0651 15.9331 15.9331 15.9716 15.9716 20.9120 20.9120 21.3783 21.3783 21.8816 21.8816 25.9733 25.9733 26.6204 26.6204 27.7028 27.7028 k = 0.0897 0.0897-0.0000 ( 1077 PWs) bands (ev): -58.5069 -58.5069 -28.4060 -28.4060 -17.5024 -17.5024 -17.4672 -17.4672 9.0095 9.0095 15.9123 15.9123 15.9448 15.9448 21.0155 21.0155 21.4283 21.4283 21.9311 21.9311 25.9712 25.9712 26.6359 26.6359 27.5873 27.5873 k = 0.0833 0.0833-0.0000 ( 1077 PWs) bands (ev): -58.5074 -58.5074 -28.4045 -28.4045 -17.4965 -17.4965 -17.4660 -17.4660 8.9575 8.9575 15.8925 15.8925 15.9197 15.9197 21.1140 21.1140 21.4758 21.4758 21.9805 21.9805 25.9643 25.9643 26.6536 26.6536 27.4794 27.4794 k = 0.0769 0.0769-0.0000 ( 1069 PWs) bands (ev): -58.5077 -58.5077 -28.4029 -28.4029 -17.4909 -17.4909 -17.4647 -17.4647 8.9092 8.9092 15.8738 15.8738 15.8963 15.8963 21.2070 21.2070 21.5204 21.5204 22.0295 22.0295 25.9532 25.9532 26.6727 26.6727 27.3795 27.3795 k = 0.0705 0.0705-0.0000 ( 1069 PWs) bands (ev): -58.5081 -58.5081 -28.4016 -28.4016 -17.4857 -17.4857 -17.4636 -17.4636 8.8646 8.8646 15.8563 15.8563 15.8747 15.8747 21.2941 21.2941 21.5619 21.5619 22.0779 22.0779 25.9383 25.9383 26.6927 26.6927 27.2880 27.2880 k = 0.0641 0.0641-0.0000 ( 1069 PWs) bands (ev): -58.5085 -58.5085 -28.4004 -28.4004 -17.4810 -17.4810 -17.4627 -17.4627 8.8237 8.8237 15.8399 15.8399 15.8548 15.8548 21.3750 21.3750 21.5999 21.5999 22.1251 22.1251 25.9204 25.9204 26.7130 26.7130 27.2052 27.2052 k = 0.0577 0.0577-0.0000 ( 1063 PWs) bands (ev): -58.5088 -58.5088 -28.3992 -28.3992 -17.4766 -17.4766 -17.4617 -17.4617 8.7865 8.7865 15.8250 15.8250 15.8368 15.8368 21.4493 21.4493 21.6345 21.6345 22.1707 22.1707 25.9001 25.9001 26.7330 26.7330 27.1311 27.1311 k = 0.0513 0.0513-0.0000 ( 1063 PWs) bands (ev): -58.5091 -58.5091 -28.3982 -28.3982 -17.4727 -17.4727 -17.4609 -17.4609 8.7532 8.7532 15.8114 15.8114 15.8206 15.8206 21.5168 21.5168 21.6653 21.6653 22.2139 22.2139 25.8783 25.8783 26.7522 26.7522 27.0659 27.0659 k = 0.0449 0.0449-0.0000 ( 1055 PWs) bands (ev): -58.5093 -58.5093 -28.3973 -28.3973 -17.4692 -17.4692 -17.4601 -17.4601 8.7238 8.7238 15.7993 15.7993 15.8063 15.8063 21.5771 21.5771 21.6926 21.6926 22.2542 22.2542 25.8559 25.8559 26.7701 26.7701 27.0095 27.0095 k = 0.0385 0.0385-0.0000 ( 1059 PWs) bands (ev): -58.5096 -58.5096 -28.3965 -28.3965 -17.4662 -17.4662 -17.4595 -17.4595 8.6982 8.6982 15.7887 15.7887 15.7938 15.7938 21.6301 21.6301 21.7160 21.7160 22.2908 22.2908 25.8337 25.8337 26.7864 26.7864 26.9616 26.9616 k = 0.0321 0.0321-0.0000 ( 1053 PWs) bands (ev): -58.5098 -58.5098 -28.3958 -28.3958 -17.4636 -17.4636 -17.4589 -17.4589 8.6765 8.6765 15.7797 15.7797 15.7832 15.7832 21.6755 21.6755 21.7359 21.7359 22.3230 22.3230 25.8129 25.8129 26.8008 26.8008 26.9220 26.9220 k = 0.0256 0.0256-0.0000 ( 1045 PWs) bands (ev): -58.5098 -58.5098 -28.3952 -28.3952 -17.4614 -17.4614 -17.4584 -17.4584 8.6587 8.6587 15.7723 15.7723 15.7745 15.7745 21.7130 21.7130 21.7521 21.7521 22.3503 22.3503 25.7943 25.7943 26.8130 26.8130 26.8902 26.8902 k = 0.0192 0.0192-0.0000 ( 1045 PWs) bands (ev): -58.5100 -58.5100 -28.3948 -28.3948 -17.4597 -17.4597 -17.4581 -17.4581 8.6449 8.6449 15.7665 15.7665 15.7678 15.7678 21.7424 21.7424 21.7646 21.7646 22.3720 22.3720 25.7788 25.7788 26.8226 26.8226 26.8659 26.8659 k = 0.0128 0.0128-0.0000 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3945 -28.3945 -17.4586 -17.4586 -17.4578 -17.4578 8.6350 8.6350 15.7624 15.7624 15.7629 15.7629 21.7636 21.7636 21.7735 21.7735 22.3879 22.3879 25.7671 25.7671 26.8297 26.8297 26.8489 26.8489 k = 0.0064 0.0064-0.0000 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3943 -28.3943 -17.4579 -17.4579 -17.4577 -17.4577 8.6290 8.6290 15.7599 15.7599 15.7600 15.7600 21.7764 21.7764 21.7788 21.7788 22.3975 22.3975 25.7599 25.7599 26.8339 26.8339 26.8387 26.8387 k = 0.0000 0.0000 0.0000 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3943 -28.3943 -17.4576 -17.4576 -17.4576 -17.4576 8.6270 8.6270 15.7590 15.7590 15.7590 15.7590 21.7806 21.7806 21.7806 21.7806 22.4008 22.4008 25.7574 25.7574 26.8354 26.8354 26.8354 26.8354 k = 0.0000 0.0000 0.0000 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3943 -28.3943 -17.4576 -17.4576 -17.4576 -17.4576 8.6270 8.6270 15.7590 15.7590 15.7590 15.7590 21.7806 21.7806 21.7806 21.7806 22.4008 22.4008 25.7574 25.7574 26.8354 26.8354 26.8354 26.8354 k = 0.0053 0.0053 0.0053 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3943 -28.3943 -17.4578 -17.4578 -17.4578 -17.4578 8.6290 8.6290 15.7599 15.7599 15.7600 15.7600 21.7766 21.7766 21.7785 21.7785 22.3975 22.3975 25.7599 25.7599 26.8359 26.8359 26.8368 26.8368 k = 0.0105 0.0105 0.0105 ( 1045 PWs) bands (ev): -58.5101 -58.5101 -28.3945 -28.3945 -17.4583 -17.4583 -17.4582 -17.4582 8.6350 8.6350 15.7625 15.7625 15.7629 15.7629 21.7645 21.7645 21.7723 21.7723 22.3877 22.3877 25.7673 25.7673 26.8374 26.8374 26.8411 26.8411 k = 0.0158 0.0158 0.0158 ( 1045 PWs) bands (ev): -58.5100 -58.5100 -28.3948 -28.3948 -17.4590 -17.4590 -17.4588 -17.4588 8.6451 8.6451 15.7667 15.7667 15.7678 15.7678 21.7445 21.7445 21.7620 21.7620 22.3715 22.3715 25.7796 25.7796 26.8400 26.8400 26.8482 26.8482 k = 0.0211 0.0211 0.0211 ( 1045 PWs) bands (ev): -58.5098 -58.5098 -28.3952 -28.3952 -17.4601 -17.4601 -17.4597 -17.4597 8.6591 8.6591 15.7727 15.7727 15.7745 15.7745 21.7167 21.7167 21.7475 21.7475 22.3489 22.3489 25.7965 25.7965 26.8436 26.8436 26.8581 26.8581 k = 0.0263 0.0263 0.0263 ( 1048 PWs) bands (ev): -58.5097 -58.5097 -28.3958 -28.3958 -17.4616 -17.4616 -17.4609 -17.4609 8.6770 8.6770 15.7804 15.7804 15.7832 15.7832 21.6813 21.6813 21.7289 21.7289 22.3202 22.3202 25.8179 25.8179 26.8482 26.8482 26.8707 26.8707 k = 0.0316 0.0316 0.0316 ( 1060 PWs) bands (ev): -58.5096 -58.5096 -28.3966 -28.3966 -17.4635 -17.4635 -17.4624 -17.4624 8.6990 8.6990 15.7897 15.7897 15.7938 15.7938 21.6386 21.6386 21.7062 21.7062 22.2855 22.2855 25.8435 25.8435 26.8537 26.8537 26.8860 26.8860 k = 0.0368 0.0368 0.0368 ( 1060 PWs) bands (ev): -58.5094 -58.5094 -28.3974 -28.3974 -17.4655 -17.4655 -17.4641 -17.4641 8.7249 8.7249 15.8008 15.8008 15.8062 15.8062 21.5890 21.5890 21.6795 21.6795 22.2452 22.2452 25.8730 25.8730 26.8603 26.8603 26.9040 26.9040 k = 0.0421 0.0421 0.0421 ( 1060 PWs) bands (ev): -58.5091 -58.5091 -28.3983 -28.3983 -17.4677 -17.4677 -17.4660 -17.4660 8.7547 8.7547 15.8135 15.8135 15.8206 15.8206 21.5328 21.5328 21.6488 21.6488 22.1994 22.1994 25.9061 25.9061 26.8679 26.8679 26.9246 26.9246 k = 0.0474 0.0474 0.0474 ( 1060 PWs) bands (ev): -58.5088 -58.5088 -28.3993 -28.3993 -17.4703 -17.4703 -17.4682 -17.4682 8.7884 8.7884 15.8279 15.8279 15.8368 15.8368 21.4705 21.4705 21.6142 21.6142 22.1484 22.1484 25.9425 25.9425 26.8764 26.8764 26.9476 26.9476 k = 0.0526 0.0526 0.0526 ( 1069 PWs) bands (ev): -58.5085 -58.5085 -28.4005 -28.4005 -17.4733 -17.4733 -17.4708 -17.4708 8.8260 8.8260 15.8439 15.8439 15.8548 15.8548 21.4024 21.4024 21.5755 21.5755 22.0923 22.0923 25.9818 25.9818 26.8859 26.8859 26.9731 26.9731 k = 0.0579 0.0579 0.0579 ( 1069 PWs) bands (ev): -58.5081 -58.5081 -28.4017 -28.4017 -17.4764 -17.4764 -17.4735 -17.4735 8.8675 8.8675 15.8615 15.8615 15.8746 15.8746 21.3290 21.3290 21.5331 21.5331 22.0315 22.0315 26.0239 26.0239 26.8963 26.8963 27.0009 27.0009 k = 0.0632 0.0632 0.0632 ( 1063 PWs) bands (ev): -58.5076 -58.5076 -28.4030 -28.4030 -17.4798 -17.4798 -17.4763 -17.4763 8.9128 8.9128 15.8809 15.8809 15.8962 15.8962 21.2508 21.2508 21.4870 21.4870 21.9663 21.9663 26.0682 26.0682 26.9076 26.9076 27.0310 27.0310 k = 0.0684 0.0684 0.0684 ( 1063 PWs) bands (ev): -58.5072 -58.5072 -28.4045 -28.4045 -17.4835 -17.4835 -17.4795 -17.4795 8.9618 8.9618 15.9017 15.9017 15.9195 15.9195 21.1682 21.1682 21.4372 21.4372 21.8969 21.8969 26.1147 26.1147 26.9199 26.9199 27.0633 27.0633 k = 0.0737 0.0737 0.0737 ( 1063 PWs) bands (ev): -58.5067 -58.5067 -28.4060 -28.4060 -17.4874 -17.4874 -17.4829 -17.4829 9.0145 9.0145 15.9242 15.9242 15.9445 15.9445 21.0817 21.0817 21.3838 21.3838 21.8235 21.8235 26.1629 26.1629 26.9330 26.9330 27.0977 27.0977 k = 0.0789 0.0789 0.0789 ( 1069 PWs) bands (ev): -58.5062 -58.5062 -28.4078 -28.4078 -17.4917 -17.4917 -17.4865 -17.4865 9.0710 9.0710 15.9482 15.9482 15.9711 15.9711 20.9917 20.9917 21.3269 21.3269 21.7463 21.7463 26.2126 26.2126 26.9471 26.9471 27.1341 27.1341 k = 0.0842 0.0842 0.0842 ( 1069 PWs) bands (ev): -58.5056 -58.5056 -28.4095 -28.4095 -17.4962 -17.4962 -17.4904 -17.4904 9.1310 9.1310 15.9737 15.9737 15.9994 15.9994 20.8987 20.8987 21.2668 21.2668 21.6656 21.6656 26.2637 26.2637 26.9620 26.9620 27.1725 27.1725 k = 0.0895 0.0895 0.0895 ( 1081 PWs) bands (ev): -58.5052 -58.5052 -28.4115 -28.4115 -17.5009 -17.5009 -17.4947 -17.4947 9.1947 9.1947 16.0006 16.0006 16.0290 16.0290 20.8032 20.8032 21.2035 21.2035 21.5816 21.5816 26.3158 26.3158 26.9778 26.9778 27.2128 27.2128 k = 0.0947 0.0947 0.0947 ( 1087 PWs) bands (ev): -58.5046 -58.5046 -28.4136 -28.4136 -17.5059 -17.5059 -17.4990 -17.4990 9.2618 9.2618 16.0290 16.0290 16.0602 16.0602 20.7055 20.7055 21.1372 21.1372 21.4947 21.4947 26.3688 26.3688 26.9944 26.9944 27.2549 27.2549 k = 0.1000 0.1000 0.1000 ( 1087 PWs) bands (ev): -58.5039 -58.5039 -28.4156 -28.4156 -17.5110 -17.5110 -17.5035 -17.5035 9.3324 9.3324 16.0588 16.0588 16.0928 16.0928 20.6061 20.6061 21.0681 21.0681 21.4051 21.4051 26.4225 26.4225 27.0119 27.0119 27.2988 27.2988 k = 0.1053 0.1053 0.1053 ( 1087 PWs) bands (ev): -58.5032 -58.5032 -28.4178 -28.4178 -17.5163 -17.5163 -17.5082 -17.5082 9.4064 9.4064 16.0900 16.0900 16.1266 16.1266 20.5054 20.5054 20.9964 20.9964 21.3130 21.3130 26.4768 26.4768 27.0302 27.0302 27.3443 27.3443 k = 0.1105 0.1105 0.1105 ( 1087 PWs) bands (ev): -58.5025 -58.5025 -28.4200 -28.4200 -17.5218 -17.5218 -17.5131 -17.5131 9.4837 9.4837 16.1224 16.1224 16.1617 16.1617 20.4037 20.4037 20.9224 20.9224 21.2187 21.2187 26.5315 26.5315 27.0494 27.0494 27.3913 27.3913 k = 0.1158 0.1158 0.1158 ( 1090 PWs) bands (ev): -58.5018 -58.5018 -28.4224 -28.4224 -17.5276 -17.5276 -17.5181 -17.5181 9.5643 9.5643 16.1561 16.1561 16.1979 16.1979 20.3014 20.3014 20.8462 20.8462 21.1224 21.1224 26.5864 26.5864 27.0694 27.0694 27.4399 27.4399 k = 0.1211 0.1211 0.1211 ( 1090 PWs) bands (ev): -58.5010 -58.5010 -28.4248 -28.4248 -17.5335 -17.5335 -17.5234 -17.5234 9.6480 9.6480 16.1909 16.1909 16.2350 16.2350 20.1988 20.1988 20.7682 20.7682 21.0245 21.0245 26.6414 26.6414 27.0902 27.0902 27.4898 27.4898 k = 0.1263 0.1263 0.1263 ( 1084 PWs) bands (ev): -58.5001 -58.5001 -28.4272 -28.4272 -17.5394 -17.5394 -17.5288 -17.5288 9.7348 9.7348 16.2268 16.2268 16.2730 16.2730 20.0964 20.0964 20.6886 20.6886 20.9252 20.9252 26.6964 26.6964 27.1119 27.1119 27.5411 27.5411 k = 0.1316 0.1316 0.1316 ( 1084 PWs) bands (ev): -58.4993 -58.4993 -28.4298 -28.4298 -17.5456 -17.5456 -17.5344 -17.5344 9.8245 9.8245 16.2637 16.2637 16.3117 16.3117 19.9944 19.9944 20.6077 20.6077 20.8248 20.8248 26.7514 26.7514 27.1343 27.1343 27.5935 27.5935 k = 0.1368 0.1368 0.1368 ( 1084 PWs) bands (ev): -58.4985 -58.4985 -28.4324 -28.4324 -17.5519 -17.5519 -17.5401 -17.5401 9.9171 9.9171 16.3015 16.3015 16.3509 16.3509 19.8930 19.8930 20.5258 20.5258 20.7237 20.7237 26.8062 26.8062 27.1576 27.1576 27.6470 27.6470 k = 0.1421 0.1421 0.1421 ( 1084 PWs) bands (ev): -58.4976 -58.4976 -28.4351 -28.4351 -17.5584 -17.5584 -17.5460 -17.5460 10.0125 10.0125 16.3400 16.3400 16.3905 16.3905 19.7926 19.7926 20.4434 20.4434 20.6221 20.6221 26.8607 26.8607 27.1816 27.1816 27.7013 27.7013 k = 0.1474 0.1474 0.1474 ( 1084 PWs) bands (ev): -58.4967 -58.4967 -28.4379 -28.4379 -17.5650 -17.5650 -17.5521 -17.5521 10.1106 10.1106 16.3792 16.3792 16.4301 16.4301 19.6935 19.6935 20.3607 20.3607 20.5204 20.5204 26.9148 26.9148 27.2063 27.2063 27.7565 27.7565 k = 0.1526 0.1526 0.1526 ( 1084 PWs) bands (ev): -58.4957 -58.4957 -28.4407 -28.4407 -17.5717 -17.5717 -17.5583 -17.5583 10.2111 10.2111 16.4187 16.4187 16.4696 16.4696 19.5960 19.5960 20.2783 20.2783 20.4190 20.4190 26.9685 26.9685 27.2319 27.2319 27.8122 27.8122 k = 0.1579 0.1579 0.1579 ( 1081 PWs) bands (ev): -58.4948 -58.4948 -28.4436 -28.4436 -17.5785 -17.5785 -17.5646 -17.5646 10.3141 10.3141 16.4586 16.4586 16.5087 16.5087 19.5004 19.5004 20.1965 20.1965 20.3182 20.3182 27.0218 27.0218 27.2581 27.2581 27.8683 27.8683 k = 0.1632 0.1632 0.1632 ( 1081 PWs) bands (ev): -58.4938 -58.4938 -28.4466 -28.4466 -17.5854 -17.5854 -17.5710 -17.5710 10.4194 10.4194 16.4985 16.4985 16.5470 16.5470 19.4069 19.4069 20.1158 20.1158 20.2185 20.2185 27.0744 27.0744 27.2850 27.2850 27.9246 27.9246 k = 0.1684 0.1684 0.1684 ( 1081 PWs) bands (ev): -58.4928 -58.4928 -28.4496 -28.4496 -17.5924 -17.5924 -17.5776 -17.5776 10.5267 10.5267 16.5382 16.5382 16.5843 16.5843 19.3158 19.3158 20.0368 20.0368 20.1202 20.1202 27.1265 27.1265 27.3125 27.3125 27.9809 27.9809 k = 0.1737 0.1737 0.1737 ( 1081 PWs) bands (ev): -58.4918 -58.4918 -28.4526 -28.4526 -17.5995 -17.5995 -17.5843 -17.5843 10.6361 10.6361 16.5774 16.5774 16.6200 16.6200 19.2273 19.2273 19.9601 19.9601 20.0239 20.0239 27.1779 27.1779 27.3407 27.3407 28.0369 28.0369 k = 0.1789 0.1789 0.1789 ( 1081 PWs) bands (ev): -58.4908 -58.4908 -28.4557 -28.4557 -17.6066 -17.6066 -17.5910 -17.5910 10.7472 10.7472 16.6158 16.6158 16.6538 16.6538 19.1418 19.1418 19.8862 19.8862 19.9300 19.9300 27.2285 27.2285 27.3694 27.3694 28.0922 28.0922 k = 0.1842 0.1842 0.1842 ( 1084 PWs) bands (ev): -58.4898 -58.4898 -28.4588 -28.4588 -17.6138 -17.6138 -17.5979 -17.5979 10.8599 10.8599 16.6529 16.6529 16.6852 16.6852 19.0595 19.0595 19.8158 19.8158 19.8391 19.8391 27.2783 27.2783 27.3986 27.3986 28.1465 28.1465 k = 0.1895 0.1895 0.1895 ( 1084 PWs) bands (ev): -58.4887 -58.4887 -28.4620 -28.4620 -17.6211 -17.6211 -17.6048 -17.6048 10.9740 10.9740 16.6884 16.6884 16.7136 16.7136 18.9806 18.9806 19.7496 19.7496 19.7519 19.7519 27.3272 27.3272 27.4282 27.4282 28.1996 28.1996 k = 0.1947 0.1947 0.1947 ( 1084 PWs) bands (ev): -58.4876 -58.4876 -28.4652 -28.4652 -17.6283 -17.6283 -17.6118 -17.6118 11.0894 11.0894 16.7218 16.7218 16.7384 16.7384 18.9056 18.9056 19.6689 19.6689 19.6884 19.6884 27.3752 27.3752 27.4583 27.4583 28.2508 28.2508 k = 0.2000 0.2000 0.2000 ( 1072 PWs) bands (ev): -58.4864 -58.4864 -28.4683 -28.4683 -17.6355 -17.6355 -17.6188 -17.6188 11.2058 11.2058 16.7524 16.7524 16.7591 16.7591 18.8347 18.8347 19.5910 19.5910 19.6329 19.6329 27.4221 27.4221 27.4886 27.4886 28.2997 28.2997 k = 0.2053 0.2053 0.2053 ( 1072 PWs) bands (ev): -58.4853 -58.4853 -28.4716 -28.4716 -17.6428 -17.6428 -17.6259 -17.6259 11.3229 11.3229 16.7751 16.7751 16.7796 16.7796 18.7681 18.7681 19.5186 19.5186 19.5837 19.5837 27.4679 27.4679 27.5192 27.5192 28.3456 28.3456 k = 0.2105 0.2105 0.2105 ( 1078 PWs) bands (ev): -58.4843 -58.4843 -28.4749 -28.4749 -17.6502 -17.6502 -17.6331 -17.6331 11.4406 11.4406 16.7857 16.7857 16.8028 16.8028 18.7063 18.7063 19.4527 19.4527 19.5416 19.5416 27.5124 27.5124 27.5499 27.5499 28.3878 28.3878 k = 0.2158 0.2158 0.2158 ( 1078 PWs) bands (ev): -58.4832 -58.4832 -28.4782 -28.4782 -17.6576 -17.6576 -17.6403 -17.6403 11.5585 11.5585 16.7905 16.7905 16.8212 16.8212 18.6497 18.6497 19.3940 19.3940 19.5073 19.5073 27.5556 27.5556 27.5807 27.5807 28.4257 28.4257 k = 0.2211 0.2211 0.2211 ( 1075 PWs) bands (ev): -58.4820 -58.4820 -28.4815 -28.4815 -17.6648 -17.6648 -17.6476 -17.6476 11.6764 11.6764 16.7889 16.7889 16.8342 16.8342 18.5988 18.5988 19.3433 19.3433 19.4813 19.4813 27.5972 27.5972 27.6114 27.6114 28.4581 28.4581 k = 0.2263 0.2263 0.2263 ( 1075 PWs) bands (ev): -58.4809 -58.4809 -28.4848 -28.4848 -17.6721 -17.6721 -17.6549 -17.6549 11.7940 11.7940 16.7808 16.7808 16.8409 16.8409 18.5538 18.5538 19.3012 19.3012 19.4642 19.4642 27.6373 27.6373 27.6420 27.6420 28.4839 28.4839 k = 0.2316 0.2316 0.2316 ( 1075 PWs) bands (ev): -58.4798 -58.4798 -28.4881 -28.4881 -17.6794 -17.6794 -17.6622 -17.6622 11.9110 11.9110 16.7658 16.7658 16.8408 16.8408 18.5152 18.5152 19.2685 19.2685 19.4562 19.4562 27.6722 27.6722 27.6756 27.6756 28.5020 28.5020 k = 0.2368 0.2368 0.2368 ( 1075 PWs) bands (ev): -58.4787 -58.4787 -28.4914 -28.4914 -17.6866 -17.6866 -17.6695 -17.6695 12.0271 12.0271 16.7440 16.7440 16.8334 16.8334 18.4835 18.4835 19.2455 19.2455 19.4574 19.4574 27.7020 27.7020 27.7119 27.7119 28.5107 28.5107 k = 0.2421 0.2421 0.2421 ( 1069 PWs) bands (ev): -58.4775 -58.4775 -28.4947 -28.4947 -17.6937 -17.6937 -17.6767 -17.6767 12.1421 12.1421 16.7155 16.7155 16.8184 16.8184 18.4591 18.4591 19.2327 19.2327 19.4679 19.4679 27.7313 27.7313 27.7462 27.7462 28.5086 28.5086 k = 0.2474 0.2474 0.2474 ( 1069 PWs) bands (ev): -58.4763 -58.4763 -28.4980 -28.4980 -17.7009 -17.7009 -17.6840 -17.6840 12.2554 12.2554 16.6806 16.6806 16.7958 16.7958 18.4421 18.4421 19.2301 19.2301 19.4874 19.4874 27.7599 27.7599 27.7781 27.7781 28.4940 28.4940 k = 0.2526 0.2526 0.2526 ( 1069 PWs) bands (ev): -58.4752 -58.4752 -28.5014 -28.5014 -17.7080 -17.7080 -17.6913 -17.6913 12.3669 12.3669 16.6396 16.6396 16.7658 16.7658 18.4329 18.4329 19.2379 19.2379 19.5157 19.5157 27.7876 27.7876 27.8074 27.8074 28.4654 28.4654 k = 0.2579 0.2579 0.2579 ( 1069 PWs) bands (ev): -58.4741 -58.4741 -28.5047 -28.5047 -17.7150 -17.7150 -17.6985 -17.6985 12.4762 12.4762 16.5932 16.5932 16.7287 16.7287 18.4318 18.4318 19.2557 19.2557 19.5522 19.5522 27.8143 27.8143 27.8339 27.8339 28.4215 28.4215 k = 0.2632 0.2632 0.2632 ( 1075 PWs) bands (ev): -58.4730 -58.4730 -28.5080 -28.5080 -17.7221 -17.7221 -17.7058 -17.7058 12.5830 12.5830 16.5418 16.5418 16.6851 16.6851 18.4387 18.4387 19.2832 19.2832 19.5965 19.5965 27.8397 27.8397 27.8570 27.8570 28.3613 28.3613 k = 0.2684 0.2684 0.2684 ( 1075 PWs) bands (ev): -58.4719 -58.4719 -28.5113 -28.5113 -17.7290 -17.7290 -17.7130 -17.7130 12.6870 12.6870 16.4860 16.4860 16.6356 16.6356 18.4538 18.4538 19.3201 19.3201 19.6482 19.6482 27.8638 27.8638 27.8763 27.8763 28.2849 28.2849 k = 0.2737 0.2737 0.2737 ( 1081 PWs) bands (ev): -58.4708 -58.4708 -28.5146 -28.5146 -17.7359 -17.7359 -17.7202 -17.7202 12.7879 12.7879 16.4265 16.4265 16.5811 16.5811 18.4773 18.4773 19.3658 19.3658 19.7067 19.7067 27.8862 27.8862 27.8904 27.8904 28.1934 28.1934 k = 0.2789 0.2789 0.2789 ( 1081 PWs) bands (ev): -58.4697 -58.4697 -28.5178 -28.5178 -17.7426 -17.7426 -17.7273 -17.7273 12.8854 12.8854 16.3638 16.3638 16.5223 16.5223 18.5092 18.5092 19.4198 19.4198 19.7714 19.7714 27.8954 27.8954 27.9068 27.9068 28.0914 28.0914 k = 0.2842 0.2842 0.2842 ( 1072 PWs) bands (ev): -58.4685 -58.4685 -28.5210 -28.5210 -17.7492 -17.7492 -17.7342 -17.7342 12.9794 12.9794 16.2986 16.2986 16.4599 16.4599 18.5495 18.5495 19.4816 19.4816 19.8420 19.8420 27.8720 27.8720 27.9254 27.9254 27.9994 27.9994 k = 0.2895 0.2895 0.2895 ( 1078 PWs) bands (ev): -58.4674 -58.4674 -28.5242 -28.5242 -17.7559 -17.7559 -17.7412 -17.7412 13.0695 13.0695 16.2312 16.2312 16.3946 16.3946 18.5981 18.5981 19.5506 19.5506 19.9178 19.9178 27.7778 27.7778 27.9416 27.9416 27.9610 27.9610 k = 0.2947 0.2947 0.2947 ( 1072 PWs) bands (ev): -58.4663 -58.4663 -28.5273 -28.5273 -17.7622 -17.7622 -17.7480 -17.7480 13.1559 13.1559 16.1622 16.1622 16.3271 16.3271 18.6551 18.6551 19.6264 19.6264 19.9986 19.9986 27.6399 27.6399 27.9511 27.9511 27.9554 27.9554 k = 0.3000 0.3000 0.3000 ( 1072 PWs) bands (ev): -58.4652 -58.4652 -28.5304 -28.5304 -17.7686 -17.7686 -17.7548 -17.7548 13.2382 13.2382 16.0921 16.0921 16.2579 16.2579 18.7203 18.7203 19.7086 19.7086 20.0839 20.0839 27.4856 27.4856 27.9439 27.9439 27.9663 27.9663 k = 0.3053 0.3053 0.3053 ( 1072 PWs) bands (ev): -58.4641 -58.4641 -28.5335 -28.5335 -17.7748 -17.7748 -17.7615 -17.7615 13.3164 13.3164 16.0212 16.0212 16.1876 16.1876 18.7936 18.7936 19.7968 19.7968 20.1734 20.1734 27.3219 27.3219 27.9341 27.9341 27.9742 27.9742 k = 0.3105 0.3105 0.3105 ( 1072 PWs) bands (ev): -58.4631 -58.4631 -28.5365 -28.5365 -17.7810 -17.7810 -17.7682 -17.7682 13.3905 13.3905 15.9498 15.9498 16.1165 16.1165 18.8747 18.8747 19.8909 19.8909 20.2668 20.2668 27.1518 27.1518 27.9201 27.9201 27.9787 27.9787 k = 0.3158 0.3158 0.3158 ( 1075 PWs) bands (ev): -58.4621 -58.4621 -28.5395 -28.5395 -17.7870 -17.7870 -17.7747 -17.7747 13.4607 13.4607 15.8783 15.8783 16.0451 16.0451 18.9634 18.9634 19.9904 19.9904 20.3636 20.3636 26.9774 26.9774 27.9012 27.9012 27.9796 27.9796 k = 0.3211 0.3211 0.3211 ( 1069 PWs) bands (ev): -58.4610 -58.4610 -28.5424 -28.5424 -17.7928 -17.7928 -17.7811 -17.7811 13.5270 13.5270 15.8070 15.8070 15.9738 15.9738 19.0593 19.0593 20.0954 20.0954 20.4639 20.4639 26.8000 26.8000 27.8770 27.8770 27.9767 27.9767 k = 0.3263 0.3263 0.3263 ( 1070 PWs) bands (ev): -58.4600 -58.4600 -28.5453 -28.5453 -17.7986 -17.7986 -17.7873 -17.7873 13.5894 13.5894 15.7362 15.7362 15.9027 15.9027 19.1618 19.1618 20.2057 20.2057 20.5673 20.5673 26.6209 26.6209 27.8472 27.8472 27.9696 27.9696 k = 0.3316 0.3316 0.3316 ( 1070 PWs) bands (ev): -58.4590 -58.4590 -28.5481 -28.5481 -17.8043 -17.8043 -17.7935 -17.7935 13.6482 13.6482 15.6659 15.6659 15.8323 15.8323 19.2707 19.2707 20.3212 20.3212 20.6736 20.6736 26.4411 26.4411 27.8116 27.8116 27.9581 27.9581 k = 0.3368 0.3368 0.3368 ( 1070 PWs) bands (ev): -58.4580 -58.4580 -28.5509 -28.5509 -17.8098 -17.8098 -17.7995 -17.7995 13.7036 13.7036 15.5966 15.5966 15.7628 15.7628 19.3852 19.3852 20.4419 20.4419 20.7827 20.7827 26.2615 26.2615 27.7700 27.7700 27.9419 27.9419 k = 0.3421 0.3421 0.3421 ( 1070 PWs) bands (ev): -58.4571 -58.4571 -28.5536 -28.5536 -17.8152 -17.8152 -17.8054 -17.8054 13.7556 13.7556 15.5282 15.5282 15.6942 15.6942 19.5049 19.5049 20.5678 20.5678 20.8943 20.8943 26.0828 26.0828 27.7225 27.7225 27.9207 27.9207 k = 0.3474 0.3474 0.3474 ( 1070 PWs) bands (ev): -58.4562 -58.4562 -28.5562 -28.5562 -17.8204 -17.8204 -17.8112 -17.8112 13.8047 13.8047 15.4611 15.4611 15.6270 15.6270 19.6291 19.6291 20.6989 20.6989 21.0084 21.0084 25.9056 25.9056 27.6689 27.6689 27.8943 27.8943 k = 0.3526 0.3526 0.3526 ( 1070 PWs) bands (ev): -58.4553 -58.4553 -28.5588 -28.5588 -17.8255 -17.8255 -17.8168 -17.8168 13.8509 13.8509 15.3953 15.3953 15.5611 15.5611 19.7572 19.7572 20.8352 20.8352 21.1248 21.1248 25.7304 25.7304 27.6094 27.6094 27.8625 27.8625 k = 0.3579 0.3579 0.3579 ( 1070 PWs) bands (ev): -58.4544 -58.4544 -28.5613 -28.5613 -17.8304 -17.8304 -17.8223 -17.8223 13.8946 13.8946 15.3310 15.3310 15.4967 15.4967 19.8886 19.8886 20.9767 20.9767 21.2433 21.2433 25.5578 25.5578 27.5439 27.5439 27.8252 27.8252 k = 0.3632 0.3632 0.3632 ( 1070 PWs) bands (ev): -58.4535 -58.4535 -28.5638 -28.5638 -17.8352 -17.8352 -17.8276 -17.8276 13.9358 13.9358 15.2683 15.2683 15.4340 15.4340 20.0227 20.0227 21.1235 21.1235 21.3639 21.3639 25.3881 25.3881 27.4727 27.4727 27.7822 27.7822 k = 0.3684 0.3684 0.3684 ( 1070 PWs) bands (ev): -58.4527 -58.4527 -28.5662 -28.5662 -17.8399 -17.8399 -17.8328 -17.8328 13.9748 13.9748 15.2073 15.2073 15.3731 15.3731 20.1589 20.1589 21.2755 21.2755 21.4864 21.4864 25.2218 25.2218 27.3958 27.3958 27.7333 27.7333 k = 0.3737 0.3737 0.3737 ( 1070 PWs) bands (ev): -58.4519 -58.4519 -28.5685 -28.5685 -17.8444 -17.8444 -17.8377 -17.8377 14.0117 14.0117 15.1481 15.1481 15.3141 15.3141 20.2967 20.2967 21.4325 21.4325 21.6108 21.6108 25.0592 25.0592 27.3136 27.3136 27.6786 27.6786 k = 0.3789 0.3789 0.3789 ( 1070 PWs) bands (ev): -58.4511 -58.4511 -28.5707 -28.5707 -17.8487 -17.8487 -17.8426 -17.8426 14.0468 14.0468 15.0908 15.0908 15.2571 15.2571 20.4357 20.4357 21.5944 21.5944 21.7369 21.7369 24.9006 24.9006 27.2263 27.2263 27.6179 27.6179 k = 0.3842 0.3842 0.3842 ( 1064 PWs) bands (ev): -58.4502 -58.4502 -28.5728 -28.5728 -17.8528 -17.8528 -17.8472 -17.8472 14.0802 14.0802 15.0355 15.0355 15.2022 15.2022 20.5753 20.5753 21.7609 21.7609 21.8647 21.8647 24.7464 24.7464 27.1342 27.1342 27.5514 27.5514 k = 0.3895 0.3895 0.3895 ( 1064 PWs) bands (ev): -58.4495 -58.4495 -28.5749 -28.5749 -17.8568 -17.8568 -17.8516 -17.8516 14.1119 14.1119 14.9822 14.9822 15.1494 15.1494 20.7153 20.7153 21.9316 21.9316 21.9940 21.9940 24.5967 24.5967 27.0376 27.0376 27.4791 27.4791 k = 0.3947 0.3947 0.3947 ( 1058 PWs) bands (ev): -58.4488 -58.4488 -28.5768 -28.5768 -17.8605 -17.8605 -17.8559 -17.8559 14.1421 14.1421 14.9310 14.9310 15.0989 15.0989 20.8553 20.8553 22.1062 22.1062 22.1248 22.1248 24.4520 24.4520 26.9369 26.9369 27.4011 27.4011 k = 0.4000 0.4000 0.4000 ( 1058 PWs) bands (ev): -58.4481 -58.4481 -28.5787 -28.5787 -17.8641 -17.8641 -17.8600 -17.8600 14.1708 14.1708 14.8820 14.8820 15.0507 15.0507 20.9952 20.9952 22.2570 22.2570 22.2840 22.2840 24.3125 24.3125 26.8326 26.8326 27.3175 27.3175 k = 0.4053 0.4053 0.4053 ( 1058 PWs) bands (ev): -58.4474 -58.4474 -28.5805 -28.5805 -17.8676 -17.8676 -17.8639 -17.8639 14.1980 14.1980 14.8353 14.8353 15.0050 15.0050 21.1346 21.1346 22.3905 22.3905 22.4645 22.4645 24.1784 24.1784 26.7250 26.7250 27.2287 27.2287 k = 0.4105 0.4105 0.4105 ( 1064 PWs) bands (ev): -58.4469 -58.4469 -28.5823 -28.5823 -17.8711 -17.8711 -17.8677 -17.8677 14.2238 14.2238 14.7908 14.7908 14.9616 14.9616 21.2733 21.2733 22.5251 22.5251 22.6468 22.6468 24.0501 24.0501 26.6147 26.6147 27.1347 27.1347 k = 0.4158 0.4158 0.4158 ( 1064 PWs) bands (ev): -58.4463 -58.4463 -28.5839 -28.5839 -17.8742 -17.8742 -17.8712 -17.8712 14.2482 14.2482 14.7486 14.7486 14.9209 14.9209 21.4112 21.4112 22.6608 22.6608 22.8300 22.8300 23.9279 23.9279 26.5020 26.5020 27.0358 27.0358 k = 0.4211 0.4211 0.4211 ( 1070 PWs) bands (ev): -58.4458 -58.4458 -28.5856 -28.5856 -17.8773 -17.8773 -17.8745 -17.8745 14.2711 14.2711 14.7088 14.7088 14.8827 14.8827 21.5481 21.5481 22.7975 22.7975 23.0128 23.0128 23.8124 23.8124 26.3876 26.3876 26.9325 26.9325 k = 0.4263 0.4263 0.4263 ( 1070 PWs) bands (ev): -58.4453 -58.4453 -28.5870 -28.5870 -17.8801 -17.8801 -17.8777 -17.8777 14.2926 14.2926 14.6714 14.6714 14.8472 14.8472 21.6838 21.6838 22.9351 22.9351 23.1934 23.1934 23.7046 23.7046 26.2721 26.2721 26.8248 26.8248 k = 0.4316 0.4316 0.4316 ( 1070 PWs) bands (ev): -58.4448 -58.4448 -28.5884 -28.5884 -17.8827 -17.8827 -17.8806 -17.8806 14.3124 14.3124 14.6365 14.6365 14.8145 14.8145 21.8180 21.8180 23.0734 23.0734 23.3655 23.3655 23.6097 23.6097 26.1561 26.1561 26.7133 26.7133 k = 0.4368 0.4368 0.4368 ( 1070 PWs) bands (ev): -58.4444 -58.4444 -28.5896 -28.5896 -17.8851 -17.8851 -17.8833 -17.8833 14.3307 14.3307 14.6040 14.6040 14.7847 14.7847 21.9504 21.9504 23.2123 23.2123 23.4585 23.4585 23.5973 23.5973 26.0405 26.0405 26.5982 26.5982 k = 0.4421 0.4421 0.4421 ( 1070 PWs) bands (ev): -58.4440 -58.4440 -28.5908 -28.5908 -17.8874 -17.8874 -17.8858 -17.8858 14.3471 14.3471 14.5741 14.5741 14.7577 14.7577 22.0805 22.0805 23.3516 23.3516 23.3942 23.3942 23.7440 23.7440 25.9261 25.9261 26.4799 26.4799 k = 0.4474 0.4474 0.4474 ( 1070 PWs) bands (ev): -58.4436 -58.4436 -28.5919 -28.5919 -17.8894 -17.8894 -17.8881 -17.8881 14.3618 14.3618 14.5466 14.5466 14.7338 14.7338 22.2078 22.2078 23.3157 23.3157 23.4911 23.4911 23.9052 23.9052 25.8142 25.8142 26.3587 26.3587 k = 0.4526 0.4526 0.4526 ( 1070 PWs) bands (ev): -58.4433 -58.4433 -28.5929 -28.5929 -17.8913 -17.8913 -17.8902 -17.8902 14.3745 14.3745 14.5217 14.5217 14.7128 14.7128 22.3316 22.3316 23.2416 23.2416 23.6307 23.6307 24.0601 24.0601 25.7063 25.7063 26.2353 26.2353 k = 0.4579 0.4579 0.4579 ( 1070 PWs) bands (ev): -58.4429 -58.4429 -28.5937 -28.5937 -17.8929 -17.8929 -17.8921 -17.8921 14.3852 14.3852 14.4994 14.4994 14.6949 14.6949 22.4511 22.4511 23.1741 23.1741 23.7699 23.7699 24.2041 24.2041 25.6041 25.6041 26.1099 26.1099 k = 0.4632 0.4632 0.4632 ( 1070 PWs) bands (ev): -58.4427 -58.4427 -28.5945 -28.5945 -17.8944 -17.8944 -17.8937 -17.8937 14.3940 14.3940 14.4796 14.4796 14.6799 14.6799 22.5650 22.5650 23.1139 23.1139 23.9083 23.9083 24.3335 24.3335 25.5104 25.5104 25.9834 25.9834 k = 0.4684 0.4684 0.4684 ( 1070 PWs) bands (ev): -58.4424 -58.4424 -28.5952 -28.5952 -17.8957 -17.8957 -17.8951 -17.8951 14.4010 14.4010 14.4625 14.4625 14.6678 14.6678 22.6718 22.6718 23.0613 23.0613 24.0453 24.0453 24.4445 24.4445 25.4285 25.4285 25.8563 25.8563 k = 0.4737 0.4737 0.4737 ( 1070 PWs) bands (ev): -58.4422 -58.4422 -28.5958 -28.5958 -17.8967 -17.8967 -17.8964 -17.8964 14.4061 14.4061 14.4480 14.4480 14.6582 14.6582 22.7697 22.7697 23.0165 23.0165 24.1798 24.1798 24.5329 24.5329 25.3621 25.3621 25.7300 25.7300 k = 0.4789 0.4789 0.4789 ( 1070 PWs) bands (ev): -58.4421 -58.4421 -28.5962 -28.5962 -17.8976 -17.8976 -17.8974 -17.8974 14.4098 14.4098 14.4361 14.4361 14.6511 14.6511 22.8561 22.8561 22.9796 22.9796 24.3101 24.3101 24.5956 24.5956 25.3147 25.3147 25.6062 25.6062 k = 0.4842 0.4842 0.4842 ( 1070 PWs) bands (ev): -58.4419 -58.4419 -28.5966 -28.5966 -17.8983 -17.8983 -17.8981 -17.8981 14.4123 14.4123 14.4268 14.4268 14.6460 14.6460 22.9281 22.9281 22.9510 22.9510 24.4331 24.4331 24.6328 24.6328 25.2871 25.2871 25.4882 25.4882 k = 0.4895 0.4895 0.4895 ( 1064 PWs) bands (ev): -58.4418 -58.4418 -28.5968 -28.5968 -17.8987 -17.8987 -17.8987 -17.8987 14.4138 14.4138 14.4202 14.4202 14.6426 14.6426 22.9301 22.9301 22.9831 22.9831 24.5421 24.5421 24.6496 24.6496 25.2753 25.2753 25.3828 25.3828 k = 0.4947 0.4947 0.4947 ( 1064 PWs) bands (ev): -58.4417 -58.4417 -28.5969 -28.5969 -17.8990 -17.8990 -17.8990 -17.8990 14.4147 14.4147 14.4162 14.4162 14.6407 14.6407 22.9177 22.9177 23.0175 23.0175 24.6236 24.6236 24.6547 24.6547 25.2724 25.2724 25.3034 25.3034 k = 0.5000 0.5000 0.5000 ( 1064 PWs) bands (ev): -58.4417 -58.4417 -28.5970 -28.5970 -17.8991 -17.8991 -17.8991 -17.8991 14.4149 14.4149 14.4149 14.4149 14.6400 14.6400 22.9136 22.9136 23.0292 23.0292 24.6554 24.6554 24.6554 24.6554 25.2722 25.2722 25.2722 25.2722 k = 0.5000 0.5000 0.5000 ( 1064 PWs) bands (ev): -58.4417 -58.4417 -28.5970 -28.5970 -17.8991 -17.8991 -17.8991 -17.8991 14.4149 14.4149 14.4149 14.4149 14.6400 14.6400 22.9136 22.9136 23.0292 23.0292 24.6554 24.6554 24.6554 24.6554 25.2722 25.2722 25.2722 25.2722 k = 0.4936 0.5000 0.4936 ( 1064 PWs) bands (ev): -58.4417 -58.4417 -28.5969 -28.5969 -17.8991 -17.8991 -17.8989 -17.8989 14.4146 14.4146 14.4163 14.4163 14.6407 14.6407 22.9177 22.9177 23.0176 23.0176 24.6238 24.6238 24.6550 24.6550 25.2714 25.2714 25.3039 25.3039 k = 0.4872 0.5000 0.4872 ( 1064 PWs) bands (ev): -58.4418 -58.4418 -28.5968 -28.5968 -17.8990 -17.8990 -17.8984 -17.8984 14.4135 14.4135 14.4205 14.4205 14.6426 14.6426 22.9299 22.9299 22.9833 22.9833 24.5422 24.5422 24.6531 24.6531 25.2692 25.2692 25.3856 25.3856 k = 0.4808 0.5000 0.4808 ( 1066 PWs) bands (ev): -58.4419 -58.4419 -28.5965 -28.5965 -17.8989 -17.8989 -17.8975 -17.8975 14.4115 14.4115 14.4274 14.4274 14.6460 14.6460 22.9279 22.9279 22.9505 22.9505 24.4314 24.4314 24.6486 24.6486 25.2660 25.2660 25.4962 25.4962 k = 0.4744 0.5000 0.4744 ( 1070 PWs) bands (ev): -58.4421 -58.4421 -28.5962 -28.5962 -17.8988 -17.8988 -17.8962 -17.8962 14.4083 14.4083 14.4370 14.4370 14.6514 14.6514 22.8542 22.8542 22.9789 22.9789 24.3037 24.3037 24.6399 24.6399 25.2628 25.2628 25.6231 25.6231 k = 0.4679 0.5000 0.4679 ( 1074 PWs) bands (ev): -58.4423 -58.4423 -28.5958 -28.5958 -17.8987 -17.8987 -17.8946 -17.8946 14.4036 14.4036 14.4492 14.4492 14.6591 14.6591 22.7646 22.7646 23.0153 23.0153 24.1649 24.1649 24.6252 24.6252 25.2602 25.2602 25.7602 25.7602 k = 0.4615 0.5000 0.4615 ( 1074 PWs) bands (ev): -58.4425 -58.4425 -28.5952 -28.5952 -17.8984 -17.8984 -17.8926 -17.8926 14.3971 14.3971 14.4641 14.4641 14.6695 14.6695 22.6616 22.6616 23.0596 23.0596 24.0175 24.0175 24.6034 24.6034 25.2588 25.2588 25.9044 25.9044 k = 0.4551 0.5000 0.4551 ( 1074 PWs) bands (ev): -58.4427 -58.4427 -28.5946 -28.5946 -17.8982 -17.8982 -17.8902 -17.8902 14.3886 14.3886 14.4814 14.4814 14.6830 14.6830 22.5477 22.5477 23.1117 23.1117 23.8632 23.8632 24.5738 24.5738 25.2590 25.2590 26.0542 26.0542 k = 0.4487 0.5000 0.4487 ( 1074 PWs) bands (ev): -58.4430 -58.4430 -28.5938 -28.5938 -17.8978 -17.8978 -17.8874 -17.8874 14.3779 14.3779 14.5010 14.5010 14.6999 14.6999 22.4250 22.4250 23.1714 23.1714 23.7028 23.7028 24.5364 24.5364 25.2606 25.2606 26.2084 26.2084 k = 0.4423 0.5000 0.4423 ( 1074 PWs) bands (ev): -58.4433 -58.4433 -28.5930 -28.5930 -17.8975 -17.8975 -17.8843 -17.8843 14.3651 14.3651 14.5230 14.5230 14.7202 14.7202 22.2950 22.2950 23.2385 23.2385 23.5376 23.5376 24.4913 24.4913 25.2634 25.2634 26.3663 26.3663 k = 0.4359 0.5000 0.4359 ( 1074 PWs) bands (ev): -58.4436 -58.4436 -28.5920 -28.5920 -17.8971 -17.8971 -17.8809 -17.8809 14.3502 14.3502 14.5471 14.5471 14.7441 14.7441 22.1593 22.1593 23.3121 23.3121 23.3688 23.3688 24.4393 24.4393 25.2670 25.2670 26.5271 26.5271 k = 0.4295 0.5000 0.4295 ( 1074 PWs) bands (ev): -58.4440 -58.4440 -28.5910 -28.5910 -17.8966 -17.8966 -17.8771 -17.8771 14.3334 14.3334 14.5733 14.5733 14.7716 14.7716 22.0188 22.0188 23.1948 23.1948 23.3948 23.3948 24.3811 24.3811 25.2710 25.2710 26.6903 26.6903 k = 0.4231 0.5000 0.4231 ( 1074 PWs) bands (ev): -58.4444 -58.4444 -28.5898 -28.5898 -17.8961 -17.8961 -17.8729 -17.8729 14.3149 14.3149 14.6016 14.6016 14.8025 14.8025 21.8745 21.8745 23.0198 23.0198 23.4830 23.4830 24.3172 24.3172 25.2750 25.2750 26.8555 26.8555 k = 0.4167 0.5000 0.4167 ( 1074 PWs) bands (ev): -58.4448 -58.4448 -28.5886 -28.5886 -17.8956 -17.8956 -17.8685 -17.8685 14.2950 14.2950 14.6318 14.6318 14.8366 14.8366 21.7271 21.7271 22.8433 22.8433 23.5777 23.5777 24.2486 24.2486 25.2787 25.2787 27.0222 27.0222 k = 0.4103 0.5000 0.4103 ( 1074 PWs) bands (ev): -58.4453 -58.4453 -28.5873 -28.5873 -17.8950 -17.8950 -17.8636 -17.8636 14.2737 14.2737 14.6640 14.6640 14.8739 14.8739 21.5771 21.5771 22.6660 22.6660 23.6786 23.6786 24.1759 24.1759 25.2819 25.2819 27.1901 27.1901 k = 0.4038 0.5000 0.4038 ( 1074 PWs) bands (ev): -58.4458 -58.4458 -28.5859 -28.5859 -17.8944 -17.8944 -17.8585 -17.8585 14.2515 14.2515 14.6980 14.6980 14.9141 14.9141 21.4252 21.4252 22.4889 22.4889 23.7845 23.7845 24.1005 24.1005 25.2845 25.2845 27.3588 27.3588 k = 0.3974 0.5000 0.3974 ( 1074 PWs) bands (ev): -58.4463 -58.4463 -28.5844 -28.5844 -17.8937 -17.8937 -17.8530 -17.8530 14.2283 14.2283 14.7339 14.7339 14.9569 14.9569 21.2716 21.2716 22.3127 22.3127 23.8893 23.8893 24.0285 24.0285 25.2864 25.2864 27.5279 27.5279 k = 0.3910 0.5000 0.3910 ( 1066 PWs) bands (ev): -58.4468 -58.4468 -28.5827 -28.5827 -17.8930 -17.8930 -17.8472 -17.8472 14.2046 14.2046 14.7716 14.7716 15.0021 15.0021 21.1170 21.1170 22.1381 22.1381 23.9115 23.9115 24.0419 24.0419 25.2876 25.2876 27.6971 27.6971 k = 0.3846 0.5000 0.3846 ( 1066 PWs) bands (ev): -58.4474 -58.4474 -28.5810 -28.5810 -17.8923 -17.8923 -17.8411 -17.8411 14.1805 14.1805 14.8111 14.8111 15.0494 15.0494 20.9617 20.9617 21.9657 21.9657 23.8349 23.8349 24.1565 24.1565 25.2882 25.2882 27.8661 27.8661 k = 0.3782 0.5000 0.3782 ( 1066 PWs) bands (ev): -58.4480 -58.4480 -28.5793 -28.5793 -17.8915 -17.8915 -17.8347 -17.8347 14.1561 14.1561 14.8524 14.8524 15.0983 15.0983 20.8062 20.8062 21.7959 21.7959 23.7473 23.7473 24.2847 24.2847 25.2882 25.2882 28.0346 28.0346 k = 0.3718 0.5000 0.3718 ( 1064 PWs) bands (ev): -58.4486 -58.4486 -28.5775 -28.5775 -17.8907 -17.8907 -17.8281 -17.8281 14.1316 14.1316 14.8955 14.8955 15.1485 15.1485 20.6511 20.6511 21.6293 21.6293 23.6559 23.6559 24.4191 24.4191 25.2879 25.2879 28.2024 28.2024 k = 0.3654 0.5000 0.3654 ( 1064 PWs) bands (ev): -58.4493 -58.4493 -28.5756 -28.5756 -17.8899 -17.8899 -17.8211 -17.8211 14.1072 14.1072 14.9403 14.9403 15.1996 15.1996 20.4968 20.4968 21.4662 21.4662 23.5619 23.5619 24.5581 24.5581 25.2877 25.2877 28.3690 28.3690 k = 0.3590 0.5000 0.3590 ( 1064 PWs) bands (ev): -58.4500 -58.4500 -28.5737 -28.5737 -17.8890 -17.8890 -17.8140 -17.8140 14.0831 14.0831 14.9868 14.9868 15.2511 15.2511 20.3442 20.3442 21.3067 21.3067 23.4657 23.4657 24.7004 24.7004 25.2886 25.2886 28.5342 28.5342 k = 0.3526 0.5000 0.3526 ( 1064 PWs) bands (ev): -58.4507 -58.4507 -28.5717 -28.5717 -17.8881 -17.8881 -17.8065 -17.8065 14.0593 14.0593 15.0350 15.0350 15.3024 15.3024 20.1941 20.1941 21.1512 21.1512 23.3676 23.3676 24.8438 24.8438 25.2926 25.2926 28.6977 28.6977 k = 0.3462 0.5000 0.3462 ( 1064 PWs) bands (ev): -58.4514 -58.4514 -28.5696 -28.5696 -17.8872 -17.8872 -17.7988 -17.7988 14.0361 14.0361 15.0846 15.0846 15.3531 15.3531 20.0471 20.0471 20.9998 20.9998 23.2679 23.2679 24.9825 24.9825 25.3051 25.3051 28.8593 28.8593 k = 0.3397 0.5000 0.3397 ( 1064 PWs) bands (ev): -58.4522 -58.4522 -28.5675 -28.5675 -17.8863 -17.8863 -17.7909 -17.7909 14.0135 14.0135 15.1356 15.1356 15.4023 15.4023 19.9045 19.9045 20.8525 20.8525 23.1666 23.1666 25.0995 25.0995 25.3432 25.3432 29.0185 29.0185 k = 0.3333 0.5000 0.3333 ( 1068 PWs) bands (ev): -58.4530 -58.4530 -28.5653 -28.5653 -17.8853 -17.8853 -17.7828 -17.7828 13.9917 13.9917 15.1877 15.1877 15.4497 15.4497 19.7671 19.7671 20.7094 20.7094 23.0641 23.0641 25.1659 25.1659 25.4354 25.4354 29.1751 29.1751 k = 0.3269 0.5000 0.3269 ( 1068 PWs) bands (ev): -58.4538 -58.4538 -28.5631 -28.5631 -17.8843 -17.8843 -17.7744 -17.7744 13.9707 13.9707 15.2405 15.2405 15.4944 15.4944 19.6361 19.6361 20.5707 20.5707 22.9604 22.9604 25.1889 25.1889 25.5745 25.5745 29.3287 29.3287 k = 0.3205 0.5000 0.3205 ( 1068 PWs) bands (ev): -58.4546 -58.4546 -28.5608 -28.5608 -17.8833 -17.8833 -17.7658 -17.7658 13.9508 13.9508 15.2935 15.2935 15.5362 15.5362 19.5126 19.5126 20.4363 20.4363 22.8557 22.8557 25.1941 25.1941 25.7347 25.7347 29.4792 29.4792 k = 0.3141 0.5000 0.3141 ( 1068 PWs) bands (ev): -58.4554 -58.4554 -28.5585 -28.5585 -17.8823 -17.8823 -17.7571 -17.7571 13.9318 13.9318 15.3455 15.3455 15.5748 15.5748 19.3978 19.3978 20.3064 20.3064 22.7501 22.7501 25.1923 25.1923 25.9051 25.9051 29.6260 29.6260 k = 0.3077 0.5000 0.3077 ( 1068 PWs) bands (ev): -58.4563 -58.4563 -28.5561 -28.5561 -17.8812 -17.8812 -17.7481 -17.7481 13.9140 13.9140 15.3947 15.3947 15.6111 15.6111 19.2927 19.2927 20.1812 20.1812 22.6437 22.6437 25.1873 25.1873 26.0819 26.0819 29.7689 29.7689 k = 0.3013 0.5000 0.3013 ( 1080 PWs) bands (ev): -58.4573 -58.4573 -28.5538 -28.5538 -17.8803 -17.8803 -17.7391 -17.7391 13.8974 13.8974 15.4380 15.4380 15.6469 15.6469 19.1984 19.1984 20.0610 20.0610 22.5367 22.5367 25.1803 25.1803 26.2635 26.2635 29.9074 29.9074 k = 0.2949 0.5000 0.2949 ( 1080 PWs) bands (ev): -58.4581 -58.4581 -28.5514 -28.5514 -17.8792 -17.8792 -17.7299 -17.7299 13.8821 13.8821 15.4710 15.4710 15.6855 15.6855 19.1154 19.1154 19.9462 19.9462 22.4292 22.4292 25.1722 25.1722 26.4491 26.4491 30.0414 30.0414 k = 0.2885 0.5000 0.2885 ( 1072 PWs) bands (ev): -58.4589 -58.4589 -28.5488 -28.5488 -17.8779 -17.8779 -17.7204 -17.7204 13.8681 13.8681 15.4893 15.4893 15.7304 15.7304 19.0441 19.0441 19.8378 19.8378 22.3215 22.3215 25.1633 25.1633 26.6383 26.6383 30.1703 30.1703 k = 0.2821 0.5000 0.2821 ( 1072 PWs) bands (ev): -58.4598 -58.4598 -28.5463 -28.5463 -17.8768 -17.8768 -17.7109 -17.7109 13.8555 13.8555 15.4907 15.4907 15.7831 15.7831 18.9841 18.9841 19.7366 19.7366 22.2133 22.2133 25.1537 25.1537 26.8307 26.8307 30.2937 30.2937 k = 0.2756 0.5000 0.2756 ( 1072 PWs) bands (ev): -58.4607 -58.4607 -28.5438 -28.5438 -17.8757 -17.8757 -17.7012 -17.7012 13.8443 13.8443 15.4758 15.4758 15.8426 15.8426 18.9341 18.9341 19.6443 19.6443 22.1050 22.1050 25.1437 25.1437 27.0260 27.0260 30.4109 30.4109 k = 0.2692 0.5000 0.2692 ( 1068 PWs) bands (ev): -58.4616 -58.4616 -28.5412 -28.5412 -17.8745 -17.8745 -17.6914 -17.6914 13.8345 13.8345 15.4460 15.4460 15.9074 15.9074 18.8916 18.8916 19.5636 19.5636 21.9966 21.9966 25.1333 25.1333 27.2239 27.2239 30.5208 30.5208 k = 0.2628 0.5000 0.2628 ( 1074 PWs) bands (ev): -58.4626 -58.4626 -28.5387 -28.5387 -17.8734 -17.8734 -17.6817 -17.6817 13.8262 13.8262 15.4029 15.4029 15.9762 15.9762 18.8530 18.8530 19.4975 19.4975 21.8883 21.8883 25.1226 25.1226 27.4243 27.4243 30.6204 30.6204 k = 0.2564 0.5000 0.2564 ( 1078 PWs) bands (ev): -58.4635 -58.4635 -28.5362 -28.5362 -17.8723 -17.8723 -17.6719 -17.6719 13.8193 13.8193 15.3482 15.3482 16.0481 16.0481 18.8138 18.8138 19.4500 19.4500 21.7801 21.7801 25.1117 25.1117 27.6269 27.6269 30.7001 30.7001 k = 0.2500 0.5000 0.2500 ( 1078 PWs) bands (ev): -58.4644 -58.4644 -28.5337 -28.5337 -17.8711 -17.8711 -17.6619 -17.6619 13.8140 13.8140 15.2831 15.2831 16.1225 16.1225 18.7697 18.7697 19.4245 19.4245 21.6722 21.6722 25.1007 25.1007 27.8316 27.8316 30.7239 30.7239 k = 0.2436 0.5000 0.2436 ( 1078 PWs) bands (ev): -58.4653 -58.4653 -28.5311 -28.5311 -17.8699 -17.8699 -17.6520 -17.6520 13.8101 13.8101 15.2091 15.2091 16.1990 16.1990 18.7179 18.7179 19.4226 19.4226 21.5647 21.5647 25.0896 25.0896 28.0380 28.0380 30.6697 30.6697 k = 0.2372 0.5000 0.2372 ( 1076 PWs) bands (ev): -58.4662 -58.4662 -28.5285 -28.5285 -17.8687 -17.8687 -17.6420 -17.6420 13.8078 13.8078 15.1276 15.1276 16.2773 16.2773 18.6583 18.6583 19.4432 19.4432 21.4577 21.4577 25.0785 25.0785 28.2460 28.2460 30.5807 30.5807 k = 0.2308 0.5000 0.2308 ( 1076 PWs) bands (ev): -58.4671 -58.4671 -28.5260 -28.5260 -17.8676 -17.8676 -17.6320 -17.6320 13.8068 13.8068 15.0399 15.0399 16.3573 16.3573 18.5921 18.5921 19.4837 19.4837 21.3513 21.3513 25.0674 25.0674 28.4554 28.4554 30.4781 30.4781 k = 0.2244 0.5000 0.2244 ( 1080 PWs) bands (ev): -58.4681 -58.4681 -28.5235 -28.5235 -17.8664 -17.8664 -17.6221 -17.6221 13.8072 13.8072 14.9473 14.9473 16.4387 16.4387 18.5216 18.5216 19.5408 19.5408 21.2456 21.2456 25.0564 25.0564 28.6658 28.6658 30.3677 30.3677 k = 0.2179 0.5000 0.2179 ( 1080 PWs) bands (ev): -58.4690 -58.4690 -28.5210 -28.5210 -17.8652 -17.8652 -17.6122 -17.6122 13.8090 13.8090 14.8510 14.8510 16.5214 16.5214 18.4484 18.4484 19.6114 19.6114 21.1408 21.1408 25.0455 25.0455 28.8770 28.8770 30.2518 30.2518 k = 0.2115 0.5000 0.2115 ( 1080 PWs) bands (ev): -58.4698 -58.4698 -28.5185 -28.5185 -17.8641 -17.8641 -17.6023 -17.6023 13.8119 13.8119 14.7521 14.7521 16.6052 16.6052 18.3741 18.3741 19.6930 19.6930 21.0371 21.0371 25.0348 25.0348 29.0886 29.0886 30.1318 30.1318 k = 0.2051 0.5000 0.2051 ( 1080 PWs) bands (ev): -58.4707 -58.4707 -28.5160 -28.5160 -17.8629 -17.8629 -17.5925 -17.5925 13.8160 13.8160 14.6516 14.6516 16.6900 16.6900 18.2997 18.2997 19.7833 19.7833 20.9347 20.9347 25.0242 25.0242 29.2998 29.2998 30.0088 30.0088 k = 0.1987 0.5000 0.1987 ( 1076 PWs) bands (ev): -58.4716 -58.4716 -28.5135 -28.5135 -17.8617 -17.8617 -17.5827 -17.5827 13.8208 13.8208 14.5505 14.5505 16.7755 16.7755 18.2261 18.2261 19.8804 19.8804 20.8341 20.8341 25.0139 25.0139 29.5085 29.5085 29.8854 29.8854 k = 0.1923 0.5000 0.1923 ( 1080 PWs) bands (ev): -58.4725 -58.4725 -28.5111 -28.5111 -17.8607 -17.8607 -17.5731 -17.5731 13.8262 13.8262 14.4498 14.4498 16.8616 16.8616 18.1537 18.1537 19.9823 19.9823 20.7357 20.7357 25.0039 25.0039 29.6824 29.6824 29.7938 29.7938 k = 0.1859 0.5000 0.1859 ( 1080 PWs) bands (ev): -58.4733 -58.4733 -28.5088 -28.5088 -17.8596 -17.8596 -17.5636 -17.5636 13.8315 13.8315 14.3507 14.3507 16.9480 16.9480 18.0831 18.0831 20.0867 20.0867 20.6410 20.6410 24.9941 24.9941 29.6061 29.6061 29.9493 29.9493 k = 0.1795 0.5000 0.1795 ( 1090 PWs) bands (ev): -58.4742 -58.4742 -28.5065 -28.5065 -17.8585 -17.8585 -17.5544 -17.5544 13.8354 13.8354 14.2548 14.2548 17.0345 17.0345 18.0147 18.0147 20.1883 20.1883 20.5544 20.5544 24.9847 24.9847 29.4768 29.4768 30.1542 30.1542 k = 0.1731 0.5000 0.1731 ( 1090 PWs) bands (ev): -58.4751 -58.4751 -28.5042 -28.5042 -17.8575 -17.8575 -17.5452 -17.5452 13.8358 13.8358 14.1650 14.1650 17.1205 17.1205 17.9489 17.9489 20.2681 20.2681 20.4940 20.4940 24.9756 24.9756 29.3431 29.3431 30.3587 30.3587 k = 0.1667 0.5000 0.1667 ( 1090 PWs) bands (ev): -58.4759 -58.4759 -28.5020 -28.5020 -17.8564 -17.8564 -17.5361 -17.5361 13.8273 13.8273 14.0868 14.0868 17.2055 17.2055 17.8865 17.8865 20.2700 20.2700 20.5153 20.5153 24.9670 24.9670 29.2078 29.2078 30.5508 30.5508 k = 0.1603 0.5000 0.1603 ( 1090 PWs) bands (ev): -58.4766 -58.4766 -28.4998 -28.4998 -17.8553 -17.8553 -17.5272 -17.5272 13.8007 13.8007 14.0296 14.0296 17.2882 17.2882 17.8285 17.8285 20.2050 20.2050 20.6067 20.6067 24.9588 24.9588 29.0716 29.0716 30.6284 30.6284 k = 0.1538 0.5000 0.1538 ( 1086 PWs) bands (ev): -58.4774 -58.4774 -28.4976 -28.4976 -17.8543 -17.8543 -17.5185 -17.5185 13.7494 13.7494 14.0004 14.0004 17.3662 17.3662 17.7773 17.7773 20.1232 20.1232 20.7177 20.7177 24.9510 24.9510 28.9351 28.9351 30.6325 30.6325 k = 0.1474 0.5000 0.1474 ( 1082 PWs) bands (ev): -58.4780 -58.4780 -28.4955 -28.4955 -17.8532 -17.8532 -17.5100 -17.5100 13.6797 13.6797 13.9930 13.9930 17.4337 17.4337 17.7387 17.7387 20.0381 20.0381 20.8340 20.8340 24.9438 24.9438 28.7988 28.7988 30.6345 30.6345 k = 0.1410 0.5000 0.1410 ( 1082 PWs) bands (ev): -58.4788 -58.4788 -28.4935 -28.4935 -17.8523 -17.8523 -17.5017 -17.5017 13.6018 13.6018 13.9974 13.9974 17.4775 17.4775 17.7255 17.7255 19.9531 19.9531 20.9520 20.9520 24.9370 24.9370 28.6631 28.6631 30.6387 30.6387 k = 0.1346 0.5000 0.1346 ( 1084 PWs) bands (ev): -58.4795 -58.4795 -28.4915 -28.4915 -17.8513 -17.8513 -17.4938 -17.4938 13.5214 13.5214 14.0079 14.0079 17.4835 17.4835 17.7517 17.7517 19.8694 19.8694 21.0698 21.0698 24.9308 24.9308 28.5285 28.5285 30.6459 30.6459 k = 0.1282 0.5000 0.1282 ( 1084 PWs) bands (ev): -58.4802 -58.4802 -28.4897 -28.4897 -17.8504 -17.8504 -17.4861 -17.4861 13.4415 13.4415 14.0217 14.0217 17.4601 17.4601 17.8087 17.8087 19.7877 19.7877 21.1866 21.1866 24.9251 24.9251 28.3955 28.3955 30.6560 30.6560 k = 0.1218 0.5000 0.1218 ( 1084 PWs) bands (ev): -58.4808 -58.4808 -28.4878 -28.4878 -17.8495 -17.8495 -17.4786 -17.4786 13.3633 13.3633 14.0376 14.0376 17.4242 17.4242 17.8793 17.8793 19.7083 19.7083 21.3016 21.3016 24.9199 24.9199 28.2645 28.2645 30.6692 30.6692 k = 0.1154 0.5000 0.1154 ( 1084 PWs) bands (ev): -58.4814 -58.4814 -28.4861 -28.4861 -17.8487 -17.8487 -17.4715 -17.4715 13.2876 13.2876 14.0548 14.0548 17.3844 17.3844 17.9546 17.9546 19.6316 19.6316 21.4141 21.4141 24.9154 24.9154 28.1360 28.1360 30.6851 30.6851 k = 0.1090 0.5000 0.1090 ( 1080 PWs) bands (ev): -58.4820 -58.4820 -28.4844 -28.4844 -17.8478 -17.8478 -17.4645 -17.4645 13.2149 13.2149 14.0727 14.0727 17.3441 17.3441 18.0311 18.0311 19.5578 19.5578 21.5236 21.5236 24.9114 24.9114 28.0103 28.0103 30.7035 30.7035 k = 0.1026 0.5000 0.1026 ( 1080 PWs) bands (ev): -58.4825 -58.4825 -28.4828 -28.4828 -17.8471 -17.8471 -17.4580 -17.4580 13.1455 13.1455 14.0912 14.0912 17.3046 17.3046 18.1070 18.1070 19.4872 19.4872 21.6296 21.6296 24.9080 24.9080 27.8881 27.8881 30.7241 30.7241 k = 0.0962 0.5000 0.0962 ( 1080 PWs) bands (ev): -58.4831 -58.4831 -28.4813 -28.4813 -17.8463 -17.8463 -17.4518 -17.4518 13.0796 13.0796 14.1099 14.1099 17.2667 17.2667 18.1811 18.1811 19.4201 19.4201 21.7314 21.7314 24.9052 24.9052 27.7698 27.7698 30.7464 30.7464 k = 0.0897 0.5000 0.0897 ( 1080 PWs) bands (ev): -58.4836 -58.4836 -28.4799 -28.4799 -17.8456 -17.8456 -17.4459 -17.4459 13.0174 13.0174 14.1286 14.1286 17.2307 17.2307 18.2527 18.2527 19.3568 19.3568 21.8287 21.8287 24.9029 24.9029 27.6559 27.6559 30.7700 30.7700 k = 0.0833 0.5000 0.0833 ( 1084 PWs) bands (ev): -58.4841 -58.4841 -28.4786 -28.4786 -17.8450 -17.8450 -17.4405 -17.4405 12.9591 12.9591 14.1471 14.1471 17.1967 17.1967 18.3212 18.3212 19.2975 19.2975 21.9211 21.9211 24.9011 24.9011 27.5469 27.5469 30.7943 30.7943 k = 0.0769 0.5000 0.0769 ( 1084 PWs) bands (ev): -58.4845 -58.4845 -28.4774 -28.4774 -17.8444 -17.8444 -17.4353 -17.4353 12.9047 12.9047 14.1651 14.1651 17.1651 17.1651 18.3858 18.3858 19.2427 19.2427 22.0082 22.0082 24.8999 24.8999 27.4432 27.4432 30.8187 30.8187 k = 0.0705 0.5000 0.0705 ( 1084 PWs) bands (ev): -58.4849 -58.4849 -28.4762 -28.4762 -17.8438 -17.8438 -17.4305 -17.4305 12.8544 12.8544 14.1825 14.1825 17.1359 17.1359 18.4460 18.4460 19.1928 19.1928 22.0895 22.0895 24.8991 24.8991 27.3455 27.3455 30.8426 30.8426 k = 0.0641 0.5000 0.0641 ( 1096 PWs) bands (ev): -58.4854 -58.4854 -28.4753 -28.4753 -17.8435 -17.8435 -17.4262 -17.4262 12.8083 12.8083 14.1991 14.1991 17.1090 17.1090 18.5007 18.5007 19.1483 19.1483 22.1647 22.1647 24.8986 24.8986 27.2541 27.2541 30.8654 30.8654 k = 0.0577 0.5000 0.0577 ( 1096 PWs) bands (ev): -58.4858 -58.4858 -28.4743 -28.4743 -17.8430 -17.8430 -17.4222 -17.4222 12.7663 12.7663 14.2148 14.2148 17.0847 17.0847 18.5496 18.5496 19.1096 19.1096 22.2337 22.2337 24.8985 24.8985 27.1696 27.1696 30.8866 30.8866 k = 0.0513 0.5000 0.0513 ( 1092 PWs) bands (ev): -58.4860 -58.4860 -28.4734 -28.4734 -17.8425 -17.8425 -17.4186 -17.4186 12.7287 12.7287 14.2293 14.2293 17.0629 17.0629 18.5917 18.5917 19.0774 19.0774 22.2960 22.2960 24.8988 24.8988 27.0924 27.0924 30.9057 30.9057 k = 0.0449 0.5000 0.0449 ( 1092 PWs) bands (ev): -58.4863 -58.4863 -28.4727 -28.4727 -17.8421 -17.8421 -17.4154 -17.4154 12.6953 12.6953 14.2425 14.2425 17.0435 17.0435 18.6262 18.6262 19.0522 19.0522 22.3515 22.3515 24.8992 24.8992 27.0230 27.0230 30.9226 30.9226 k = 0.0385 0.5000 0.0385 ( 1088 PWs) bands (ev): -58.4865 -58.4865 -28.4719 -28.4719 -17.8418 -17.8418 -17.4125 -17.4125 12.6663 12.6663 14.2543 14.2543 17.0268 17.0268 18.6528 18.6528 19.0342 19.0342 22.4001 22.4001 24.8998 24.8998 26.9619 26.9619 30.9371 30.9371 k = 0.0321 0.5000 0.0321 ( 1096 PWs) bands (ev): -58.4868 -58.4868 -28.4715 -28.4715 -17.8416 -17.8416 -17.4102 -17.4102 12.6417 12.6417 14.2645 14.2645 17.0125 17.0125 18.6716 18.6716 19.0229 19.0229 22.4413 22.4413 24.9004 24.9004 26.9095 26.9095 30.9490 30.9490 k = 0.0256 0.5000 0.0256 ( 1096 PWs) bands (ev): -58.4869 -58.4869 -28.4710 -28.4710 -17.8414 -17.8414 -17.4083 -17.4083 12.6216 12.6216 14.2730 14.2730 17.0009 17.0009 18.6836 18.6836 19.0174 19.0174 22.4753 22.4753 24.9010 24.9010 26.8660 26.8660 30.9586 30.9586 k = 0.0192 0.5000 0.0192 ( 1100 PWs) bands (ev): -58.4871 -58.4871 -28.4707 -28.4707 -17.8413 -17.8413 -17.4068 -17.4068 12.6059 12.6059 14.2798 14.2798 16.9918 16.9918 18.6904 18.6904 19.0158 19.0158 22.5018 22.5018 24.9016 24.9016 26.8319 26.8319 30.9659 30.9659 k = 0.0128 0.5000 0.0128 ( 1108 PWs) bands (ev): -58.4873 -58.4873 -28.4705 -28.4705 -17.8412 -17.8412 -17.4059 -17.4059 12.5946 12.5946 14.2846 14.2846 16.9853 16.9853 18.6936 18.6936 19.0163 19.0163 22.5207 22.5207 24.9020 24.9020 26.8073 26.8073 30.9709 30.9709 k = 0.0064 0.5000 0.0064 ( 1108 PWs) bands (ev): -58.4873 -58.4873 -28.4703 -28.4703 -17.8411 -17.8411 -17.4052 -17.4052 12.5879 12.5879 14.2876 14.2876 16.9814 16.9814 18.6950 18.6950 19.0173 19.0173 22.5321 22.5321 24.9022 24.9022 26.7925 26.7925 30.9739 30.9739 k = 0.0000 0.5000-0.0000 ( 1108 PWs) bands (ev): -58.4874 -58.4874 -28.4703 -28.4703 -17.8411 -17.8411 -17.4050 -17.4050 12.5856 12.5856 14.2886 14.2886 16.9801 16.9801 18.6953 18.6953 19.0178 19.0178 22.5359 22.5359 24.9023 24.9023 26.7875 26.7875 30.9749 30.9749 k = 0.5000 0.5000-0.0000 ( 1092 PWs) bands (ev): -58.4645 -58.4645 -28.5355 -28.5355 -17.9717 -17.9717 -17.5563 -17.5563 12.9189 12.9189 16.0855 16.0855 18.0278 18.0278 18.9834 18.9834 19.3923 19.3923 19.6877 19.6877 24.4671 24.4671 26.9510 26.9510 30.2590 30.2590 k = 0.5000 0.5000 0.0091 ( 1076 PWs) bands (ev): -58.4643 -58.4643 -28.5354 -28.5354 -17.9715 -17.9715 -17.5564 -17.5564 12.9199 12.9199 16.0890 16.0890 18.0161 18.0161 18.9548 18.9548 19.4047 19.4047 19.7170 19.7170 24.4673 24.4673 26.9513 26.9513 30.2294 30.2294 k = 0.5000 0.5000 0.0182 ( 1076 PWs) bands (ev): -58.4643 -58.4643 -28.5356 -28.5356 -17.9713 -17.9713 -17.5573 -17.5573 12.9229 12.9229 16.0994 16.0994 17.9819 17.9819 18.8798 18.8798 19.4404 19.4404 19.7940 19.7940 24.4678 24.4678 26.9519 26.9519 30.1486 30.1486 k = 0.5000 0.5000 0.0273 ( 1076 PWs) bands (ev): -58.4642 -58.4642 -28.5358 -28.5358 -17.9710 -17.9710 -17.5587 -17.5587 12.9278 12.9278 16.1166 16.1166 17.9286 17.9286 18.7775 18.7775 19.4964 19.4964 19.8997 19.8997 24.4686 24.4686 26.9528 26.9528 30.0325 30.0325 k = 0.5000 0.5000 0.0364 ( 1076 PWs) bands (ev): -58.4641 -58.4641 -28.5362 -28.5362 -17.9706 -17.9706 -17.5608 -17.5608 12.9347 12.9347 16.1406 16.1406 17.8600 17.8600 18.6608 18.6608 19.5688 19.5688 20.0213 20.0213 24.4697 24.4697 26.9541 26.9541 29.8935 29.8935 k = 0.5000 0.5000 0.0455 ( 1076 PWs) bands (ev): -58.4639 -58.4639 -28.5366 -28.5366 -17.9701 -17.9701 -17.5634 -17.5634 12.9436 12.9436 16.1716 16.1716 17.7798 17.7798 18.5366 18.5366 19.6538 19.6538 20.1516 20.1516 24.4711 24.4711 26.9558 26.9558 29.7393 29.7393 k = 0.5000 0.5000 0.0545 ( 1076 PWs) bands (ev): -58.4637 -58.4637 -28.5371 -28.5371 -17.9694 -17.9694 -17.5665 -17.5665 12.9544 12.9544 16.2093 16.2093 17.6911 17.6911 18.4085 18.4085 19.7482 19.7482 20.2873 20.2873 24.4728 24.4728 26.9578 26.9578 29.5744 29.5744 k = 0.5000 0.5000 0.0636 ( 1076 PWs) bands (ev): -58.4635 -58.4635 -28.5378 -28.5378 -17.9687 -17.9687 -17.5702 -17.5702 12.9671 12.9671 16.2538 16.2538 17.5965 17.5965 18.2784 18.2784 19.8498 19.8498 20.4262 20.4262 24.4748 24.4748 26.9601 26.9601 29.4017 29.4017 k = 0.5000 0.5000 0.0727 ( 1076 PWs) bands (ev): -58.4632 -58.4632 -28.5385 -28.5385 -17.9678 -17.9678 -17.5745 -17.5745 12.9817 12.9817 16.3051 16.3051 17.4976 17.4976 18.1476 18.1476 19.9566 19.9566 20.5672 20.5672 24.4771 24.4771 26.9626 26.9626 29.2232 29.2232 k = 0.5000 0.5000 0.0818 ( 1076 PWs) bands (ev): -58.4629 -58.4629 -28.5393 -28.5393 -17.9669 -17.9669 -17.5792 -17.5792 12.9982 12.9982 16.3630 16.3630 17.3959 17.3959 18.0168 18.0168 20.0674 20.0674 20.7094 20.7094 24.4797 24.4797 26.9654 26.9654 29.0401 29.0401 k = 0.5000 0.5000 0.0909 ( 1076 PWs) bands (ev): -58.4626 -58.4626 -28.5402 -28.5402 -17.9658 -17.9658 -17.5845 -17.5845 13.0166 13.0166 16.4276 16.4276 17.2924 17.2924 17.8865 17.8865 20.1810 20.1810 20.8525 20.8525 24.4826 24.4826 26.9684 26.9684 28.8536 28.8536 k = 0.5000 0.5000 0.1000 ( 1076 PWs) bands (ev): -58.4622 -58.4622 -28.5411 -28.5411 -17.9647 -17.9647 -17.5902 -17.5902 13.0368 13.0368 16.4986 16.4986 17.1878 17.1878 17.7571 17.7571 20.2968 20.2968 20.9960 20.9960 24.4857 24.4857 26.9716 26.9716 28.6645 28.6645 k = 0.5000 0.5000 0.1091 ( 1068 PWs) bands (ev): -58.4617 -58.4617 -28.5421 -28.5421 -17.9634 -17.9634 -17.5963 -17.5963 13.0589 13.0589 16.5760 16.5760 17.0831 17.0831 17.6288 17.6288 20.4142 20.4142 21.1397 21.1397 24.4892 24.4892 26.9750 26.9750 28.4736 28.4736 k = 0.5000 0.5000 0.1182 ( 1068 PWs) bands (ev): -58.4613 -58.4613 -28.5432 -28.5432 -17.9620 -17.9620 -17.6029 -17.6029 13.0826 13.0826 16.6591 16.6591 16.9790 16.9790 17.5019 17.5019 20.5325 20.5325 21.2831 21.2831 24.4928 24.4928 26.9783 26.9783 28.2815 28.2815 k = 0.5000 0.5000 0.1273 ( 1064 PWs) bands (ev): -58.4608 -58.4608 -28.5444 -28.5444 -17.9605 -17.9605 -17.6099 -17.6099 13.1082 13.1082 16.7446 16.7446 16.8794 16.8794 17.3765 17.3765 20.6516 20.6516 21.4263 21.4263 24.4967 24.4967 26.9816 26.9816 28.0887 28.0887 k = 0.5000 0.5000 0.1364 ( 1064 PWs) bands (ev): -58.4603 -58.4603 -28.5457 -28.5457 -17.9590 -17.9590 -17.6174 -17.6174 13.1354 13.1354 16.7541 16.7541 16.8627 16.8627 17.2528 17.2528 20.7709 20.7709 21.5689 21.5689 24.5008 24.5008 26.9849 26.9849 27.8956 27.8956 k = 0.5000 0.5000 0.1455 ( 1064 PWs) bands (ev): -58.4598 -58.4598 -28.5470 -28.5470 -17.9574 -17.9574 -17.6252 -17.6252 13.1642 13.1642 16.6584 16.6584 16.9584 16.9584 17.1310 17.1310 20.8904 20.8904 21.7109 21.7109 24.5051 24.5051 26.9880 26.9880 27.7028 27.7028 k = 0.5000 0.5000 0.1545 ( 1064 PWs) bands (ev): -58.4593 -58.4593 -28.5484 -28.5484 -17.9557 -17.9557 -17.6333 -17.6333 13.1946 13.1946 16.5576 16.5576 17.0110 17.0110 17.0666 17.0666 21.0097 21.0097 21.8520 21.8520 24.5095 24.5095 26.9908 26.9908 27.5105 27.5105 k = 0.5000 0.5000 0.1636 ( 1064 PWs) bands (ev): -58.4588 -58.4588 -28.5498 -28.5498 -17.9540 -17.9540 -17.6417 -17.6417 13.2266 13.2266 16.4571 16.4571 16.8932 16.8932 17.1818 17.1818 21.1286 21.1286 21.9921 21.9921 24.5142 24.5142 26.9934 26.9934 27.3191 27.3191 k = 0.5000 0.5000 0.1727 ( 1072 PWs) bands (ev): -58.4583 -58.4583 -28.5514 -28.5514 -17.9523 -17.9523 -17.6505 -17.6505 13.2600 13.2600 16.3577 16.3577 16.7775 16.7775 17.3033 17.3033 21.2469 21.2469 22.1310 22.1310 24.5190 24.5190 26.9956 26.9956 27.1289 27.1289 k = 0.5000 0.5000 0.1818 ( 1072 PWs) bands (ev): -58.4577 -58.4577 -28.5530 -28.5530 -17.9505 -17.9505 -17.6595 -17.6595 13.2948 13.2948 16.2598 16.2598 16.6641 16.6641 17.4308 17.4308 21.3646 21.3646 22.2688 22.2688 24.5239 24.5239 26.9403 26.9403 26.9972 26.9972 k = 0.5000 0.5000 0.1909 ( 1072 PWs) bands (ev): -58.4571 -58.4571 -28.5546 -28.5546 -17.9486 -17.9486 -17.6686 -17.6686 13.3310 13.3310 16.1636 16.1636 16.5530 16.5530 17.5643 17.5643 21.4815 21.4815 22.4052 22.4052 24.5290 24.5290 26.7534 26.7534 26.9982 26.9982 k = 0.5000 0.5000 0.2000 ( 1072 PWs) bands (ev): -58.4565 -58.4565 -28.5563 -28.5563 -17.9466 -17.9466 -17.6780 -17.6780 13.3685 13.3685 16.0691 16.0691 16.4443 16.4443 17.7034 17.7034 21.5974 21.5974 22.5401 22.5401 24.5341 24.5341 26.5687 26.5687 26.9985 26.9985 k = 0.5000 0.5000 0.2091 ( 1072 PWs) bands (ev): -58.4559 -58.4559 -28.5579 -28.5579 -17.9447 -17.9447 -17.6875 -17.6875 13.4071 13.4071 15.9766 15.9766 16.3382 16.3382 17.8481 17.8481 21.7122 21.7122 22.6733 22.6733 24.5392 24.5392 26.3862 26.3862 26.9978 26.9978 k = 0.5000 0.5000 0.2182 ( 1072 PWs) bands (ev): -58.4553 -58.4553 -28.5596 -28.5596 -17.9426 -17.9426 -17.6972 -17.6972 13.4468 13.4468 15.8861 15.8861 16.2346 16.2346 17.9983 17.9983 21.8258 21.8258 22.8047 22.8047 24.5444 24.5444 26.2063 26.2063 26.9961 26.9961 k = 0.5000 0.5000 0.2273 ( 1072 PWs) bands (ev): -58.4546 -58.4546 -28.5614 -28.5614 -17.9406 -17.9406 -17.7069 -17.7069 13.4876 13.4876 15.7977 15.7977 16.1337 16.1337 18.1537 18.1537 21.9380 21.9380 22.9343 22.9343 24.5495 24.5495 26.0293 26.0293 26.9933 26.9933 k = 0.5000 0.5000 0.2364 ( 1072 PWs) bands (ev): -58.4540 -58.4540 -28.5631 -28.5631 -17.9386 -17.9386 -17.7167 -17.7167 13.5292 13.5292 15.7115 15.7115 16.0355 16.0355 18.3142 18.3142 22.0488 22.0488 23.0617 23.0617 24.5544 24.5544 25.8554 25.8554 26.9890 26.9890 k = 0.5000 0.5000 0.2455 ( 1064 PWs) bands (ev): -58.4533 -58.4533 -28.5648 -28.5648 -17.9364 -17.9364 -17.7264 -17.7264 13.5717 13.5717 15.6277 15.6277 15.9402 15.9402 18.4797 18.4797 22.1581 22.1581 23.1870 23.1870 24.5592 24.5592 25.6850 25.6850 26.9833 26.9833 k = 0.5000 0.5000 0.2545 ( 1064 PWs) bands (ev): -58.4526 -58.4526 -28.5666 -28.5666 -17.9343 -17.9343 -17.7362 -17.7362 13.6149 13.6149 15.5462 15.5462 15.8476 15.8476 18.6499 18.6499 22.2657 22.2657 23.3099 23.3099 24.5634 24.5634 25.5184 25.5184 26.9757 26.9757 k = 0.5000 0.5000 0.2636 ( 1072 PWs) bands (ev): -58.4521 -58.4521 -28.5684 -28.5684 -17.9324 -17.9324 -17.7460 -17.7460 13.6586 13.6586 15.4671 15.4671 15.7580 15.7580 18.8247 18.8247 22.3715 22.3715 23.4301 23.4301 24.5669 24.5669 25.3563 25.3563 26.9662 26.9662 k = 0.5000 0.5000 0.2727 ( 1072 PWs) bands (ev): -58.4514 -58.4514 -28.5702 -28.5702 -17.9303 -17.9303 -17.7557 -17.7557 13.7027 13.7027 15.3905 15.3905 15.6714 15.6714 19.0038 19.0038 22.4755 22.4755 23.5477 23.5477 24.5690 24.5690 25.1994 25.1994 26.9545 26.9545 k = 0.5000 0.5000 0.2818 ( 1072 PWs) bands (ev): -58.4508 -58.4508 -28.5719 -28.5719 -17.9283 -17.9283 -17.7653 -17.7653 13.7472 13.7472 15.3164 15.3164 15.5878 15.5878 19.1870 19.1870 22.5776 22.5776 23.6623 23.6623 24.5684 24.5684 25.0495 25.0495 26.9403 26.9403 k = 0.5000 0.5000 0.2909 ( 1072 PWs) bands (ev): -58.4502 -58.4502 -28.5736 -28.5736 -17.9263 -17.9263 -17.7747 -17.7747 13.7918 13.7918 15.2450 15.2450 15.5073 15.5073 19.3740 19.3740 22.6777 22.6777 23.7736 23.7736 24.5615 24.5615 24.9104 24.9104 26.9234 26.9234 k = 0.5000 0.5000 0.3000 ( 1060 PWs) bands (ev): -58.4494 -58.4494 -28.5752 -28.5752 -17.9242 -17.9242 -17.7838 -17.7838 13.8364 13.8364 15.1764 15.1764 15.4300 15.4300 19.5647 19.5647 22.7757 22.7757 23.8810 23.8810 24.5387 24.5387 24.7923 24.7923 26.9035 26.9035 k = 0.5000 0.5000 0.3091 ( 1068 PWs) bands (ev): -58.4489 -58.4489 -28.5770 -28.5770 -17.9223 -17.9223 -17.7930 -17.7930 13.8808 13.8808 15.1103 15.1103 15.3558 15.3558 19.7585 19.7585 22.8716 22.8716 23.9838 23.9838 24.4808 24.4808 24.7152 24.7152 26.8801 26.8801 k = 0.5000 0.5000 0.3182 ( 1068 PWs) bands (ev): -58.4483 -58.4483 -28.5786 -28.5786 -17.9204 -17.9204 -17.8019 -17.8019 13.9250 13.9250 15.0471 15.0471 15.2849 15.2849 19.9553 19.9553 22.9653 22.9653 24.0791 24.0791 24.3867 24.3867 24.6831 24.6831 26.8529 26.8529 k = 0.5000 0.5000 0.3273 ( 1064 PWs) bands (ev): -58.4477 -58.4477 -28.5802 -28.5802 -17.9186 -17.9186 -17.8104 -17.8104 13.9686 13.9686 14.9866 14.9866 15.2174 15.2174 20.1546 20.1546 23.0569 23.0569 24.1505 24.1505 24.2942 24.2942 24.6747 24.6747 26.8218 26.8218 k = 0.5000 0.5000 0.3364 ( 1064 PWs) bands (ev): -58.4471 -58.4471 -28.5817 -28.5817 -17.9167 -17.9167 -17.8188 -17.8188 14.0114 14.0114 14.9290 14.9290 15.1532 15.1532 20.3559 20.3559 23.1462 23.1462 24.1100 24.1100 24.3042 24.3042 24.6770 24.6770 26.7859 26.7859 k = 0.5000 0.5000 0.3455 ( 1072 PWs) bands (ev): -58.4467 -58.4467 -28.5833 -28.5833 -17.9150 -17.9150 -17.8270 -17.8270 14.0534 14.0534 14.8743 14.8743 15.0925 15.0925 20.5587 20.5587 23.2333 23.2333 24.0028 24.0028 24.3756 24.3756 24.6862 24.6862 26.7451 26.7451 k = 0.5000 0.5000 0.3545 ( 1072 PWs) bands (ev): -58.4462 -58.4462 -28.5848 -28.5848 -17.9134 -17.9134 -17.8347 -17.8347 14.0942 14.0942 14.8226 14.8226 15.0353 15.0353 20.7625 20.7625 23.3183 23.3183 23.8904 23.8904 24.4464 24.4464 24.7024 24.7024 26.6989 26.6989 k = 0.5000 0.5000 0.3636 ( 1072 PWs) bands (ev): -58.4457 -58.4457 -28.5862 -28.5862 -17.9117 -17.9117 -17.8421 -17.8421 14.1337 14.1337 14.7738 14.7738 14.9816 14.9816 20.9666 20.9666 23.4014 23.4014 23.7806 23.7806 24.5066 24.5066 24.7282 24.7282 26.6469 26.6469 k = 0.5000 0.5000 0.3727 ( 1072 PWs) bands (ev): -58.4452 -58.4452 -28.5875 -28.5875 -17.9102 -17.9102 -17.8491 -17.8491 14.1715 14.1715 14.7280 14.7280 14.9317 14.9317 21.1701 21.1701 23.4827 23.4827 23.6754 23.6754 24.5517 24.5517 24.7660 24.7660 26.5886 26.5886 k = 0.5000 0.5000 0.3818 ( 1072 PWs) bands (ev): -58.4448 -58.4448 -28.5887 -28.5887 -17.9088 -17.9088 -17.8557 -17.8557 14.2075 14.2075 14.6852 14.6852 14.8854 14.8854 21.3722 21.3722 23.5626 23.5626 23.5756 23.5756 24.5821 24.5821 24.8146 24.8146 26.5236 26.5236 k = 0.5000 0.5000 0.3909 ( 1072 PWs) bands (ev): -58.4443 -58.4443 -28.5899 -28.5899 -17.9074 -17.9074 -17.8619 -17.8619 14.2413 14.2413 14.6456 14.6456 14.8430 14.8430 21.5715 21.5715 23.4816 23.4816 23.6415 23.6415 24.6020 24.6020 24.8694 24.8694 26.4516 26.4516 k = 0.5000 0.5000 0.4000 ( 1072 PWs) bands (ev): -58.4439 -58.4439 -28.5910 -28.5910 -17.9061 -17.9061 -17.8677 -17.8677 14.2727 14.2727 14.6089 14.6089 14.8046 14.8046 21.7668 21.7668 23.3940 23.3940 23.7200 23.7200 24.6154 24.6154 24.9258 24.9258 26.3721 26.3721 k = 0.5000 0.5000 0.4091 ( 1072 PWs) bands (ev): -58.4436 -58.4436 -28.5920 -28.5920 -17.9050 -17.9050 -17.8731 -17.8731 14.3014 14.3014 14.5754 14.5754 14.7702 14.7702 21.9564 21.9564 23.3130 23.3130 23.7989 23.7989 24.6250 24.6250 24.9809 24.9809 26.2851 26.2851 k = 0.5000 0.5000 0.4182 ( 1072 PWs) bands (ev): -58.4433 -58.4433 -28.5930 -28.5930 -17.9039 -17.9039 -17.8779 -17.8779 14.3270 14.3270 14.5450 14.5450 14.7400 14.7400 22.1382 22.1382 23.2388 23.2388 23.8792 23.8792 24.6322 24.6322 25.0331 25.0331 26.1904 26.1904 k = 0.5000 0.5000 0.4273 ( 1072 PWs) bands (ev): -58.4430 -58.4430 -28.5938 -28.5938 -17.9029 -17.9029 -17.8823 -17.8823 14.3494 14.3494 14.5178 14.5178 14.7141 14.7141 22.3099 22.3099 23.1718 23.1718 23.9621 23.9621 24.6379 24.6379 25.0812 25.0812 26.0883 26.0883 k = 0.5000 0.5000 0.4364 ( 1072 PWs) bands (ev): -58.4427 -58.4427 -28.5946 -28.5946 -17.9020 -17.9020 -17.8862 -17.8862 14.3682 14.3682 14.4937 14.4937 14.6925 14.6925 22.4688 22.4688 23.1121 23.1121 24.0490 24.0490 24.6424 24.6424 25.1247 25.1247 25.9792 25.9792 k = 0.5000 0.5000 0.4455 ( 1072 PWs) bands (ev): -58.4425 -58.4425 -28.5952 -28.5952 -17.9013 -17.9013 -17.8897 -17.8897 14.3835 14.3835 14.4729 14.4729 14.6753 14.6753 22.6121 22.6121 23.0600 23.0600 24.1410 24.1410 24.6461 24.6461 25.1630 25.1630 25.8639 25.8639 k = 0.5000 0.5000 0.4545 ( 1072 PWs) bands (ev): -58.4423 -58.4423 -28.5958 -28.5958 -17.9006 -17.9006 -17.8926 -17.8926 14.3951 14.3951 14.4552 14.4552 14.6622 14.6622 22.7371 22.7371 23.0156 23.0156 24.2387 24.2387 24.6491 24.6491 25.1959 25.1959 25.7439 25.7439 k = 0.5000 0.5000 0.4636 ( 1072 PWs) bands (ev): -58.4421 -58.4421 -28.5962 -28.5962 -17.9001 -17.9001 -17.8949 -17.8949 14.4035 14.4035 14.4407 14.4407 14.6528 14.6528 22.8414 22.8414 22.9791 22.9791 24.3414 24.3414 24.6514 24.6514 25.2232 25.2232 25.6216 25.6216 k = 0.5000 0.5000 0.4727 ( 1072 PWs) bands (ev): -58.4420 -58.4420 -28.5966 -28.5966 -17.8997 -17.8997 -17.8968 -17.8968 14.4091 14.4091 14.4294 14.4294 14.6465 14.6465 22.9234 22.9234 22.9505 22.9505 24.4461 24.4461 24.6532 24.6532 25.2445 25.2445 25.5013 25.5013 k = 0.5000 0.5000 0.4818 ( 1064 PWs) bands (ev): -58.4418 -58.4418 -28.5968 -28.5968 -17.8993 -17.8993 -17.8980 -17.8980 14.4126 14.4126 14.4214 14.4214 14.6427 14.6427 22.9300 22.9300 22.9822 22.9822 24.5455 24.5455 24.6544 24.6544 25.2599 25.2599 25.3909 25.3909 k = 0.5000 0.5000 0.4909 ( 1064 PWs) bands (ev): -58.4417 -58.4417 -28.5969 -28.5969 -17.8992 -17.8992 -17.8988 -17.8988 14.4144 14.4144 14.4165 14.4165 14.6407 14.6407 22.9177 22.9177 23.0174 23.0174 24.6238 24.6238 24.6552 24.6552 25.2691 25.2691 25.3060 25.3060 k = 0.5000 0.5000 0.5000 ( 1064 PWs) bands (ev): -58.4417 -58.4417 -28.5970 -28.5970 -17.8991 -17.8991 -17.8991 -17.8991 14.4149 14.4149 14.4149 14.4149 14.6400 14.6400 22.9136 22.9136 23.0292 23.0292 24.6554 24.6554 24.6554 24.6554 25.2722 25.2722 25.2722 25.2722 Writing output data file AlRe.save init_run : 0.17s CPU 0.29s WALL ( 1 calls) electrons : 32.30s CPU 33.23s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.00s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 32.30s CPU 33.22s 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 : 0.03s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.02s WALL ( 422 calls) cegterg : 27.48s CPU 28.05s WALL ( 422 calls) Called by sum_band: Called by *egterg: h_psi : 11.88s CPU 12.56s WALL ( 5099 calls) s_psi : 0.69s CPU 0.71s WALL ( 5099 calls) g_psi : 0.01s CPU 0.03s WALL ( 4255 calls) cdiaghg : 14.88s CPU 14.94s WALL ( 4677 calls) cegterg:over : 0.80s CPU 0.85s WALL ( 4255 calls) cegterg:upda : 0.62s CPU 0.58s WALL ( 4255 calls) cegterg:last : 0.27s CPU 0.26s WALL ( 869 calls) cdiaghg:chol : 0.61s CPU 0.74s WALL ( 4677 calls) cdiaghg:inve : 0.32s CPU 0.30s WALL ( 4677 calls) cdiaghg:para : 0.89s CPU 0.94s WALL ( 9354 calls) Called by h_psi: h_psi:vloc : 10.38s CPU 10.94s WALL ( 5099 calls) h_psi:vnl : 1.48s CPU 1.59s WALL ( 5099 calls) add_vuspsi : 0.88s CPU 0.94s WALL ( 5099 calls) General routines calbec : 0.58s CPU 0.64s WALL ( 5099 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 9.88s CPU 10.44s WALL ( 332944 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.08s CPU 0.08s WALL ( 844 calls) Parallel routines fft_scatter : 5.52s CPU 5.90s WALL ( 332967 calls) PWSCF : 39.71s CPU 57.61s WALL This run was terminated on: 19:40:51 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=