Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18: 6:17 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: ./Fe11Si5.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 59 45 13 2082 1404 221 Max 61 46 14 2086 1422 226 Sum 2161 1653 489 75037 50883 8025 bravais-lattice index = 14 lattice parameter (alat) = 10.6615 a.u. unit-cell volume = 1211.8520 (a.u.)^3 number of atoms/cell = 16 number of atomic types = 2 number of electrons = 108.00 number of Kohn-Sham states= 130 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.661456 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 Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 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 Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 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 Fe 8.00 55.84500 Fe( 1.00) Si 4.00 28.08550 Si( 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= 219 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 2) = ( 0.0000000 0.0178571 -0.0000000), wk = 0.0045662 k( 3) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0045662 k( 4) = ( 0.0000000 0.0535714 -0.0000000), wk = 0.0045662 k( 5) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0045662 k( 6) = ( 0.0000000 0.0892857 -0.0000000), wk = 0.0045662 k( 7) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0045662 k( 8) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0045662 k( 9) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0045662 k( 10) = ( 0.0000000 0.1607143 -0.0000000), wk = 0.0045662 k( 11) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0045662 k( 12) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0045662 k( 13) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0045662 k( 14) = ( 0.0000000 0.2321429 -0.0000000), wk = 0.0045662 k( 15) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0045662 k( 16) = ( 0.0000000 0.2678571 -0.0000000), wk = 0.0045662 k( 17) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0045662 k( 18) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0045662 k( 19) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0045662 k( 20) = ( 0.0000000 0.3392857 -0.0000000), wk = 0.0045662 k( 21) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0045662 k( 22) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0045662 k( 23) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0045662 k( 24) = ( 0.0000000 0.4107143 -0.0000000), wk = 0.0045662 k( 25) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0045662 k( 26) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0045662 k( 27) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0045662 k( 28) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0045662 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0045662 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0045662 k( 31) = ( 0.0178571 0.5000000 -0.0000000), wk = 0.0045662 k( 32) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0045662 k( 33) = ( 0.0535714 0.5000000 -0.0000000), wk = 0.0045662 k( 34) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0045662 k( 35) = ( 0.0892857 0.5000000 -0.0000000), wk = 0.0045662 k( 36) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0045662 k( 37) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0045662 k( 38) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0045662 k( 39) = ( 0.1607143 0.5000000 -0.0000000), wk = 0.0045662 k( 40) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0045662 k( 41) = ( 0.1964286 0.5000000 -0.0000000), wk = 0.0045662 k( 42) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0045662 k( 43) = ( 0.2321429 0.5000000 -0.0000000), wk = 0.0045662 k( 44) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0045662 k( 45) = ( 0.2678571 0.5000000 -0.0000000), wk = 0.0045662 k( 46) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0045662 k( 47) = ( 0.3035714 0.5000000 -0.0000000), wk = 0.0045662 k( 48) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0045662 k( 49) = ( 0.3392857 0.5000000 -0.0000000), wk = 0.0045662 k( 50) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0045662 k( 51) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0045662 k( 52) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0045662 k( 53) = ( 0.4107143 0.5000000 -0.0000000), wk = 0.0045662 k( 54) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0045662 k( 55) = ( 0.4464286 0.5000000 -0.0000000), wk = 0.0045662 k( 56) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0045662 k( 57) = ( 0.4821429 0.5000000 -0.0000000), wk = 0.0045662 k( 58) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045662 k( 59) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045662 k( 60) = ( 0.4875000 0.4875000 -0.0000000), wk = 0.0045662 k( 61) = ( 0.4750000 0.4750000 -0.0000000), wk = 0.0045662 k( 62) = ( 0.4625000 0.4625000 -0.0000000), wk = 0.0045662 k( 63) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0045662 k( 64) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0045662 k( 65) = ( 0.4250000 0.4250000 -0.0000000), wk = 0.0045662 k( 66) = ( 0.4125000 0.4125000 -0.0000000), wk = 0.0045662 k( 67) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0045662 k( 68) = ( 0.3875000 0.3875000 -0.0000000), wk = 0.0045662 k( 69) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0045662 k( 70) = ( 0.3625000 0.3625000 -0.0000000), wk = 0.0045662 k( 71) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0045662 k( 72) = ( 0.3375000 0.3375000 -0.0000000), wk = 0.0045662 k( 73) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0045662 k( 74) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0045662 k( 75) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0045662 k( 76) = ( 0.2875000 0.2875000 -0.0000000), wk = 0.0045662 k( 77) = ( 0.2750000 0.2750000 -0.0000000), wk = 0.0045662 k( 78) = ( 0.2625000 0.2625000 -0.0000000), wk = 0.0045662 k( 79) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0045662 k( 80) = ( 0.2375000 0.2375000 -0.0000000), wk = 0.0045662 k( 81) = ( 0.2250000 0.2250000 -0.0000000), wk = 0.0045662 k( 82) = ( 0.2125000 0.2125000 -0.0000000), wk = 0.0045662 k( 83) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0045662 k( 84) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0045662 k( 85) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0045662 k( 86) = ( 0.1625000 0.1625000 -0.0000000), wk = 0.0045662 k( 87) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0045662 k( 88) = ( 0.1375000 0.1375000 -0.0000000), wk = 0.0045662 k( 89) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0045662 k( 90) = ( 0.1125000 0.1125000 -0.0000000), wk = 0.0045662 k( 91) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0045662 k( 92) = ( 0.0875000 0.0875000 -0.0000000), wk = 0.0045662 k( 93) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0045662 k( 94) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0045662 k( 95) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0045662 k( 96) = ( 0.0375000 0.0375000 -0.0000000), wk = 0.0045662 k( 97) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0045662 k( 98) = ( 0.0125000 0.0125000 -0.0000000), wk = 0.0045662 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 101) = ( 0.0102041 0.0102041 0.0102041), wk = 0.0045662 k( 102) = ( 0.0204082 0.0204082 0.0204082), wk = 0.0045662 k( 103) = ( 0.0306122 0.0306122 0.0306122), wk = 0.0045662 k( 104) = ( 0.0408163 0.0408163 0.0408163), wk = 0.0045662 k( 105) = ( 0.0510204 0.0510204 0.0510204), wk = 0.0045662 k( 106) = ( 0.0612245 0.0612245 0.0612245), wk = 0.0045662 k( 107) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0045662 k( 108) = ( 0.0816327 0.0816326 0.0816326), wk = 0.0045662 k( 109) = ( 0.0918367 0.0918367 0.0918367), wk = 0.0045662 k( 110) = ( 0.1020408 0.1020408 0.1020408), wk = 0.0045662 k( 111) = ( 0.1122449 0.1122449 0.1122449), wk = 0.0045662 k( 112) = ( 0.1224490 0.1224490 0.1224490), wk = 0.0045662 k( 113) = ( 0.1326531 0.1326531 0.1326531), wk = 0.0045662 k( 114) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0045662 k( 115) = ( 0.1530612 0.1530612 0.1530612), wk = 0.0045662 k( 116) = ( 0.1632653 0.1632653 0.1632653), wk = 0.0045662 k( 117) = ( 0.1734694 0.1734694 0.1734694), wk = 0.0045662 k( 118) = ( 0.1836735 0.1836735 0.1836735), wk = 0.0045662 k( 119) = ( 0.1938776 0.1938775 0.1938775), wk = 0.0045662 k( 120) = ( 0.2040816 0.2040816 0.2040816), wk = 0.0045662 k( 121) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0045662 k( 122) = ( 0.2244898 0.2244898 0.2244898), wk = 0.0045662 k( 123) = ( 0.2346939 0.2346939 0.2346939), wk = 0.0045662 k( 124) = ( 0.2448980 0.2448980 0.2448980), wk = 0.0045662 k( 125) = ( 0.2551020 0.2551020 0.2551020), wk = 0.0045662 k( 126) = ( 0.2653061 0.2653061 0.2653061), wk = 0.0045662 k( 127) = ( 0.2755102 0.2755102 0.2755102), wk = 0.0045662 k( 128) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0045662 k( 129) = ( 0.2959184 0.2959184 0.2959184), wk = 0.0045662 k( 130) = ( 0.3061224 0.3061224 0.3061224), wk = 0.0045662 k( 131) = ( 0.3163265 0.3163265 0.3163265), wk = 0.0045662 k( 132) = ( 0.3265306 0.3265306 0.3265306), wk = 0.0045662 k( 133) = ( 0.3367347 0.3367347 0.3367347), wk = 0.0045662 k( 134) = ( 0.3469388 0.3469388 0.3469388), wk = 0.0045662 k( 135) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0045662 k( 136) = ( 0.3673469 0.3673469 0.3673469), wk = 0.0045662 k( 137) = ( 0.3775510 0.3775510 0.3775510), wk = 0.0045662 k( 138) = ( 0.3877551 0.3877551 0.3877551), wk = 0.0045662 k( 139) = ( 0.3979592 0.3979592 0.3979592), wk = 0.0045662 k( 140) = ( 0.4081633 0.4081633 0.4081633), wk = 0.0045662 k( 141) = ( 0.4183674 0.4183673 0.4183673), wk = 0.0045662 k( 142) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0045662 k( 143) = ( 0.4387755 0.4387755 0.4387755), wk = 0.0045662 k( 144) = ( 0.4489796 0.4489796 0.4489796), wk = 0.0045662 k( 145) = ( 0.4591837 0.4591837 0.4591837), wk = 0.0045662 k( 146) = ( 0.4693878 0.4693878 0.4693878), wk = 0.0045662 k( 147) = ( 0.4795918 0.4795918 0.4795918), wk = 0.0045662 k( 148) = ( 0.4897959 0.4897959 0.4897959), wk = 0.0045662 k( 149) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 k( 150) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 k( 151) = ( 0.4875000 0.5000000 0.4875000), wk = 0.0045662 k( 152) = ( 0.4750000 0.5000000 0.4750000), wk = 0.0045662 k( 153) = ( 0.4625000 0.5000000 0.4625000), wk = 0.0045662 k( 154) = ( 0.4500000 0.5000000 0.4500000), wk = 0.0045662 k( 155) = ( 0.4375000 0.5000000 0.4375000), wk = 0.0045662 k( 156) = ( 0.4250000 0.5000000 0.4250000), wk = 0.0045662 k( 157) = ( 0.4125000 0.5000000 0.4125000), wk = 0.0045662 k( 158) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0045662 k( 159) = ( 0.3875000 0.5000000 0.3875000), wk = 0.0045662 k( 160) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0045662 k( 161) = ( 0.3625000 0.5000000 0.3625000), wk = 0.0045662 k( 162) = ( 0.3500000 0.5000000 0.3500000), wk = 0.0045662 k( 163) = ( 0.3375000 0.5000000 0.3375000), wk = 0.0045662 k( 164) = ( 0.3250000 0.5000000 0.3250000), wk = 0.0045662 k( 165) = ( 0.3125000 0.5000000 0.3125000), wk = 0.0045662 k( 166) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0045662 k( 167) = ( 0.2875000 0.5000000 0.2875000), wk = 0.0045662 k( 168) = ( 0.2750000 0.5000000 0.2750000), wk = 0.0045662 k( 169) = ( 0.2625000 0.5000000 0.2625000), wk = 0.0045662 k( 170) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0045662 k( 171) = ( 0.2375000 0.5000000 0.2375000), wk = 0.0045662 k( 172) = ( 0.2250000 0.5000000 0.2250000), wk = 0.0045662 k( 173) = ( 0.2125000 0.5000000 0.2125000), wk = 0.0045662 k( 174) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0045662 k( 175) = ( 0.1875000 0.5000000 0.1875000), wk = 0.0045662 k( 176) = ( 0.1750000 0.5000000 0.1750000), wk = 0.0045662 k( 177) = ( 0.1625000 0.5000000 0.1625000), wk = 0.0045662 k( 178) = ( 0.1500000 0.5000000 0.1500000), wk = 0.0045662 k( 179) = ( 0.1375000 0.5000000 0.1375000), wk = 0.0045662 k( 180) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0045662 k( 181) = ( 0.1125000 0.5000000 0.1125000), wk = 0.0045662 k( 182) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0045662 k( 183) = ( 0.0875000 0.5000000 0.0875000), wk = 0.0045662 k( 184) = ( 0.0750000 0.5000000 0.0750000), wk = 0.0045662 k( 185) = ( 0.0625000 0.5000000 0.0625000), wk = 0.0045662 k( 186) = ( 0.0500000 0.5000000 0.0500000), wk = 0.0045662 k( 187) = ( 0.0375000 0.5000000 0.0375000), wk = 0.0045662 k( 188) = ( 0.0250000 0.5000000 0.0250000), wk = 0.0045662 k( 189) = ( 0.0125000 0.5000000 0.0125000), wk = 0.0045662 k( 190) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0045662 k( 191) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045662 k( 192) = ( 0.5000000 0.5000000 0.0178571), wk = 0.0045662 k( 193) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0045662 k( 194) = ( 0.5000000 0.5000000 0.0535714), wk = 0.0045662 k( 195) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0045662 k( 196) = ( 0.5000000 0.5000000 0.0892857), wk = 0.0045662 k( 197) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0045662 k( 198) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0045662 k( 199) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0045662 k( 200) = ( 0.5000000 0.5000000 0.1607143), wk = 0.0045662 k( 201) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0045662 k( 202) = ( 0.5000000 0.5000000 0.1964286), wk = 0.0045662 k( 203) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0045662 k( 204) = ( 0.5000000 0.5000000 0.2321429), wk = 0.0045662 k( 205) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0045662 k( 206) = ( 0.5000000 0.5000000 0.2678571), wk = 0.0045662 k( 207) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0045662 k( 208) = ( 0.5000000 0.5000000 0.3035714), wk = 0.0045662 k( 209) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0045662 k( 210) = ( 0.5000000 0.5000000 0.3392857), wk = 0.0045662 k( 211) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0045662 k( 212) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0045662 k( 213) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0045662 k( 214) = ( 0.5000000 0.5000000 0.4107143), wk = 0.0045662 k( 215) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0045662 k( 216) = ( 0.5000000 0.5000000 0.4464286), wk = 0.0045662 k( 217) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0045662 k( 218) = ( 0.5000000 0.5000000 0.4821429), wk = 0.0045662 k( 219) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 2) = ( 0.0000000 0.0178571 0.0000000), wk = 0.0045662 k( 3) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0045662 k( 4) = ( 0.0000000 0.0535714 0.0000000), wk = 0.0045662 k( 5) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0045662 k( 6) = ( 0.0000000 0.0892857 0.0000000), wk = 0.0045662 k( 7) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0045662 k( 8) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0045662 k( 9) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0045662 k( 10) = ( 0.0000000 0.1607143 0.0000000), wk = 0.0045662 k( 11) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0045662 k( 12) = ( 0.0000000 0.1964286 0.0000000), wk = 0.0045662 k( 13) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0045662 k( 14) = ( 0.0000000 0.2321429 0.0000000), wk = 0.0045662 k( 15) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0045662 k( 16) = ( 0.0000000 0.2678571 0.0000000), wk = 0.0045662 k( 17) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0045662 k( 18) = ( 0.0000000 0.3035714 0.0000000), wk = 0.0045662 k( 19) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0045662 k( 20) = ( 0.0000000 0.3392857 0.0000000), wk = 0.0045662 k( 21) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0045662 k( 22) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0045662 k( 23) = ( 0.0000000 0.3928571 0.0000000), wk = 0.0045662 k( 24) = ( 0.0000000 0.4107143 0.0000000), wk = 0.0045662 k( 25) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0045662 k( 26) = ( 0.0000000 0.4464286 0.0000000), wk = 0.0045662 k( 27) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0045662 k( 28) = ( 0.0000000 0.4821429 0.0000000), wk = 0.0045662 k( 29) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0045662 k( 30) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0045662 k( 31) = ( 0.0178571 0.5000000 0.0000000), wk = 0.0045662 k( 32) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0045662 k( 33) = ( 0.0535714 0.5000000 0.0000000), wk = 0.0045662 k( 34) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0045662 k( 35) = ( 0.0892857 0.5000000 0.0000000), wk = 0.0045662 k( 36) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0045662 k( 37) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0045662 k( 38) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0045662 k( 39) = ( 0.1607143 0.5000000 0.0000000), wk = 0.0045662 k( 40) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0045662 k( 41) = ( 0.1964286 0.5000000 0.0000000), wk = 0.0045662 k( 42) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0045662 k( 43) = ( 0.2321429 0.5000000 0.0000000), wk = 0.0045662 k( 44) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0045662 k( 45) = ( 0.2678571 0.5000000 0.0000000), wk = 0.0045662 k( 46) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0045662 k( 47) = ( 0.3035714 0.5000000 0.0000000), wk = 0.0045662 k( 48) = ( 0.3214286 0.5000000 0.0000000), wk = 0.0045662 k( 49) = ( 0.3392857 0.5000000 0.0000000), wk = 0.0045662 k( 50) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0045662 k( 51) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0045662 k( 52) = ( 0.3928571 0.5000000 0.0000000), wk = 0.0045662 k( 53) = ( 0.4107143 0.5000000 0.0000000), wk = 0.0045662 k( 54) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0045662 k( 55) = ( 0.4464286 0.5000000 0.0000000), wk = 0.0045662 k( 56) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0045662 k( 57) = ( 0.4821429 0.5000000 0.0000000), wk = 0.0045662 k( 58) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045662 k( 59) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045662 k( 60) = ( 0.4875000 0.4875000 0.0000000), wk = 0.0045662 k( 61) = ( 0.4750000 0.4750000 0.0000000), wk = 0.0045662 k( 62) = ( 0.4625000 0.4625000 0.0000000), wk = 0.0045662 k( 63) = ( 0.4500000 0.4500000 0.0000000), wk = 0.0045662 k( 64) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0045662 k( 65) = ( 0.4250000 0.4250000 0.0000000), wk = 0.0045662 k( 66) = ( 0.4125000 0.4125000 0.0000000), wk = 0.0045662 k( 67) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0045662 k( 68) = ( 0.3875000 0.3875000 -0.0000000), wk = 0.0045662 k( 69) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0045662 k( 70) = ( 0.3625000 0.3625000 0.0000000), wk = 0.0045662 k( 71) = ( 0.3500000 0.3500000 0.0000000), wk = 0.0045662 k( 72) = ( 0.3375000 0.3375000 0.0000000), wk = 0.0045662 k( 73) = ( 0.3250000 0.3250000 0.0000000), wk = 0.0045662 k( 74) = ( 0.3125000 0.3125000 0.0000000), wk = 0.0045662 k( 75) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0045662 k( 76) = ( 0.2875000 0.2875000 -0.0000000), wk = 0.0045662 k( 77) = ( 0.2750000 0.2750000 0.0000000), wk = 0.0045662 k( 78) = ( 0.2625000 0.2625000 0.0000000), wk = 0.0045662 k( 79) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0045662 k( 80) = ( 0.2375000 0.2375000 0.0000000), wk = 0.0045662 k( 81) = ( 0.2250000 0.2250000 0.0000000), wk = 0.0045662 k( 82) = ( 0.2125000 0.2125000 0.0000000), wk = 0.0045662 k( 83) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0045662 k( 84) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0045662 k( 85) = ( 0.1750000 0.1750000 0.0000000), wk = 0.0045662 k( 86) = ( 0.1625000 0.1625000 0.0000000), wk = 0.0045662 k( 87) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0045662 k( 88) = ( 0.1375000 0.1375000 0.0000000), wk = 0.0045662 k( 89) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0045662 k( 90) = ( 0.1125000 0.1125000 0.0000000), wk = 0.0045662 k( 91) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0045662 k( 92) = ( 0.0875000 0.0875000 0.0000000), wk = 0.0045662 k( 93) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0045662 k( 94) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0045662 k( 95) = ( 0.0500000 0.0500000 0.0000000), wk = 0.0045662 k( 96) = ( 0.0375000 0.0375000 -0.0000000), wk = 0.0045662 k( 97) = ( 0.0250000 0.0250000 0.0000000), wk = 0.0045662 k( 98) = ( 0.0125000 0.0125000 0.0000000), wk = 0.0045662 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 101) = ( 0.0102041 0.0102041 0.0102041), wk = 0.0045662 k( 102) = ( 0.0204082 0.0204082 0.0204082), wk = 0.0045662 k( 103) = ( 0.0306122 0.0306122 0.0306122), wk = 0.0045662 k( 104) = ( 0.0408163 0.0408163 0.0408163), wk = 0.0045662 k( 105) = ( 0.0510204 0.0510204 0.0510204), wk = 0.0045662 k( 106) = ( 0.0612245 0.0612245 0.0612245), wk = 0.0045662 k( 107) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0045662 k( 108) = ( 0.0816327 0.0816327 0.0816327), wk = 0.0045662 k( 109) = ( 0.0918367 0.0918367 0.0918367), wk = 0.0045662 k( 110) = ( 0.1020408 0.1020408 0.1020408), wk = 0.0045662 k( 111) = ( 0.1122449 0.1122449 0.1122449), wk = 0.0045662 k( 112) = ( 0.1224490 0.1224490 0.1224490), wk = 0.0045662 k( 113) = ( 0.1326531 0.1326531 0.1326531), wk = 0.0045662 k( 114) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0045662 k( 115) = ( 0.1530612 0.1530612 0.1530612), wk = 0.0045662 k( 116) = ( 0.1632653 0.1632653 0.1632653), wk = 0.0045662 k( 117) = ( 0.1734694 0.1734694 0.1734694), wk = 0.0045662 k( 118) = ( 0.1836735 0.1836735 0.1836735), wk = 0.0045662 k( 119) = ( 0.1938776 0.1938776 0.1938776), wk = 0.0045662 k( 120) = ( 0.2040816 0.2040816 0.2040816), wk = 0.0045662 k( 121) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0045662 k( 122) = ( 0.2244898 0.2244898 0.2244898), wk = 0.0045662 k( 123) = ( 0.2346939 0.2346939 0.2346939), wk = 0.0045662 k( 124) = ( 0.2448980 0.2448980 0.2448980), wk = 0.0045662 k( 125) = ( 0.2551020 0.2551020 0.2551020), wk = 0.0045662 k( 126) = ( 0.2653061 0.2653061 0.2653061), wk = 0.0045662 k( 127) = ( 0.2755102 0.2755102 0.2755102), wk = 0.0045662 k( 128) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0045662 k( 129) = ( 0.2959184 0.2959184 0.2959184), wk = 0.0045662 k( 130) = ( 0.3061224 0.3061224 0.3061224), wk = 0.0045662 k( 131) = ( 0.3163265 0.3163265 0.3163265), wk = 0.0045662 k( 132) = ( 0.3265306 0.3265306 0.3265306), wk = 0.0045662 k( 133) = ( 0.3367347 0.3367347 0.3367347), wk = 0.0045662 k( 134) = ( 0.3469388 0.3469388 0.3469388), wk = 0.0045662 k( 135) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0045662 k( 136) = ( 0.3673469 0.3673469 0.3673469), wk = 0.0045662 k( 137) = ( 0.3775510 0.3775510 0.3775510), wk = 0.0045662 k( 138) = ( 0.3877551 0.3877551 0.3877551), wk = 0.0045662 k( 139) = ( 0.3979592 0.3979592 0.3979592), wk = 0.0045662 k( 140) = ( 0.4081633 0.4081633 0.4081633), wk = 0.0045662 k( 141) = ( 0.4183674 0.4183674 0.4183674), wk = 0.0045662 k( 142) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0045662 k( 143) = ( 0.4387755 0.4387755 0.4387755), wk = 0.0045662 k( 144) = ( 0.4489796 0.4489796 0.4489796), wk = 0.0045662 k( 145) = ( 0.4591837 0.4591837 0.4591837), wk = 0.0045662 k( 146) = ( 0.4693878 0.4693878 0.4693878), wk = 0.0045662 k( 147) = ( 0.4795918 0.4795918 0.4795918), wk = 0.0045662 k( 148) = ( 0.4897959 0.4897959 0.4897959), wk = 0.0045662 k( 149) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 k( 150) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 k( 151) = ( 0.4875000 0.5000000 0.4875000), wk = 0.0045662 k( 152) = ( 0.4750000 0.5000000 0.4750000), wk = 0.0045662 k( 153) = ( 0.4625000 0.5000000 0.4625000), wk = 0.0045662 k( 154) = ( 0.4500000 0.5000000 0.4500000), wk = 0.0045662 k( 155) = ( 0.4375000 0.5000000 0.4375000), wk = 0.0045662 k( 156) = ( 0.4250000 0.5000000 0.4250000), wk = 0.0045662 k( 157) = ( 0.4125000 0.5000000 0.4125000), wk = 0.0045662 k( 158) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0045662 k( 159) = ( 0.3875000 0.5000000 0.3875000), wk = 0.0045662 k( 160) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0045662 k( 161) = ( 0.3625000 0.5000000 0.3625000), wk = 0.0045662 k( 162) = ( 0.3500000 0.5000000 0.3500000), wk = 0.0045662 k( 163) = ( 0.3375000 0.5000000 0.3375000), wk = 0.0045662 k( 164) = ( 0.3250000 0.5000000 0.3250000), wk = 0.0045662 k( 165) = ( 0.3125000 0.5000000 0.3125000), wk = 0.0045662 k( 166) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0045662 k( 167) = ( 0.2875000 0.5000000 0.2875000), wk = 0.0045662 k( 168) = ( 0.2750000 0.5000000 0.2750000), wk = 0.0045662 k( 169) = ( 0.2625000 0.5000000 0.2625000), wk = 0.0045662 k( 170) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0045662 k( 171) = ( 0.2375000 0.5000000 0.2375000), wk = 0.0045662 k( 172) = ( 0.2250000 0.5000000 0.2250000), wk = 0.0045662 k( 173) = ( 0.2125000 0.5000000 0.2125000), wk = 0.0045662 k( 174) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0045662 k( 175) = ( 0.1875000 0.5000000 0.1875000), wk = 0.0045662 k( 176) = ( 0.1750000 0.5000000 0.1750000), wk = 0.0045662 k( 177) = ( 0.1625000 0.5000000 0.1625000), wk = 0.0045662 k( 178) = ( 0.1500000 0.5000000 0.1500000), wk = 0.0045662 k( 179) = ( 0.1375000 0.5000000 0.1375000), wk = 0.0045662 k( 180) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0045662 k( 181) = ( 0.1125000 0.5000000 0.1125000), wk = 0.0045662 k( 182) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0045662 k( 183) = ( 0.0875000 0.5000000 0.0875000), wk = 0.0045662 k( 184) = ( 0.0750000 0.5000000 0.0750000), wk = 0.0045662 k( 185) = ( 0.0625000 0.5000000 0.0625000), wk = 0.0045662 k( 186) = ( 0.0500000 0.5000000 0.0500000), wk = 0.0045662 k( 187) = ( 0.0375000 0.5000000 0.0375000), wk = 0.0045662 k( 188) = ( 0.0250000 0.5000000 0.0250000), wk = 0.0045662 k( 189) = ( 0.0125000 0.5000000 0.0125000), wk = 0.0045662 k( 190) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0045662 k( 191) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045662 k( 192) = ( 0.5000000 0.5000000 0.0178571), wk = 0.0045662 k( 193) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0045662 k( 194) = ( 0.5000000 0.5000000 0.0535714), wk = 0.0045662 k( 195) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0045662 k( 196) = ( 0.5000000 0.5000000 0.0892857), wk = 0.0045662 k( 197) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0045662 k( 198) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0045662 k( 199) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0045662 k( 200) = ( 0.5000000 0.5000000 0.1607143), wk = 0.0045662 k( 201) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0045662 k( 202) = ( 0.5000000 0.5000000 0.1964286), wk = 0.0045662 k( 203) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0045662 k( 204) = ( 0.5000000 0.5000000 0.2321429), wk = 0.0045662 k( 205) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0045662 k( 206) = ( 0.5000000 0.5000000 0.2678571), wk = 0.0045662 k( 207) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0045662 k( 208) = ( 0.5000000 0.5000000 0.3035714), wk = 0.0045662 k( 209) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0045662 k( 210) = ( 0.5000000 0.5000000 0.3392857), wk = 0.0045662 k( 211) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0045662 k( 212) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0045662 k( 213) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0045662 k( 214) = ( 0.5000000 0.5000000 0.4107143), wk = 0.0045662 k( 215) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0045662 k( 216) = ( 0.5000000 0.5000000 0.4464286), wk = 0.0045662 k( 217) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0045662 k( 218) = ( 0.5000000 0.5000000 0.4821429), wk = 0.0045662 k( 219) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 Dense grid: 75037 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 50883 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.73 Mb ( 368, 130) NL pseudopotentials 1.53 Mb ( 184, 544) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.02 Mb ( 2083) G-vector shells 0.00 Mb ( 443) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.92 Mb ( 368, 520) Each subspace H/S matrix 0.26 Mb ( 130, 130) Each matrix 2.16 Mb ( 544, 2, 130) The potential is recalculated from file : ./Fe11Si5.save/charge-density.dat Starting wfc are 238 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.2 secs Computing kpt #: 2 total cpu time spent up to now is 8.3 secs Computing kpt #: 3 total cpu time spent up to now is 11.5 secs Computing kpt #: 4 total cpu time spent up to now is 14.6 secs Computing kpt #: 5 total cpu time spent up to now is 17.8 secs Computing kpt #: 6 total cpu time spent up to now is 21.0 secs Computing kpt #: 7 total cpu time spent up to now is 24.1 secs Computing kpt #: 8 total cpu time spent up to now is 27.3 secs Computing kpt #: 9 total cpu time spent up to now is 30.6 secs Computing kpt #: 10 total cpu time spent up to now is 34.0 secs Computing kpt #: 11 total cpu time spent up to now is 37.5 secs Computing kpt #: 12 total cpu time spent up to now is 40.8 secs Computing kpt #: 13 total cpu time spent up to now is 44.2 secs Computing kpt #: 14 total cpu time spent up to now is 47.4 secs Computing kpt #: 15 total cpu time spent up to now is 50.7 secs Computing kpt #: 16 total cpu time spent up to now is 53.8 secs Computing kpt #: 17 total cpu time spent up to now is 57.0 secs Computing kpt #: 18 total cpu time spent up to now is 60.1 secs Computing kpt #: 19 total cpu time spent up to now is 63.1 secs Computing kpt #: 20 total cpu time spent up to now is 66.1 secs Computing kpt #: 21 total cpu time spent up to now is 69.1 secs Computing kpt #: 22 total cpu time spent up to now is 72.1 secs Computing kpt #: 23 total cpu time spent up to now is 75.0 secs Computing kpt #: 24 total cpu time spent up to now is 77.9 secs Computing kpt #: 25 total cpu time spent up to now is 80.8 secs Computing kpt #: 26 total cpu time spent up to now is 83.6 secs Computing kpt #: 27 total cpu time spent up to now is 86.4 secs Computing kpt #: 28 total cpu time spent up to now is 89.1 secs Computing kpt #: 29 total cpu time spent up to now is 91.9 secs Computing kpt #: 30 total cpu time spent up to now is 94.6 secs Computing kpt #: 31 total cpu time spent up to now is 97.3 secs Computing kpt #: 32 total cpu time spent up to now is 100.1 secs Computing kpt #: 33 total cpu time spent up to now is 103.0 secs Computing kpt #: 34 total cpu time spent up to now is 105.9 secs Computing kpt #: 35 total cpu time spent up to now is 108.9 secs Computing kpt #: 36 total cpu time spent up to now is 111.8 secs Computing kpt #: 37 total cpu time spent up to now is 114.9 secs Computing kpt #: 38 total cpu time spent up to now is 117.9 secs Computing kpt #: 39 total cpu time spent up to now is 121.1 secs Computing kpt #: 40 total cpu time spent up to now is 124.3 secs Computing kpt #: 41 total cpu time spent up to now is 127.5 secs Computing kpt #: 42 total cpu time spent up to now is 130.6 secs Computing kpt #: 43 total cpu time spent up to now is 133.6 secs Computing kpt #: 44 total cpu time spent up to now is 138.1 secs Computing kpt #: 45 total cpu time spent up to now is 143.7 secs Computing kpt #: 46 total cpu time spent up to now is 148.8 secs Computing kpt #: 47 total cpu time spent up to now is 153.2 secs Computing kpt #: 48 total cpu time spent up to now is 156.7 secs Computing kpt #: 49 total cpu time spent up to now is 159.8 secs Computing kpt #: 50 total cpu time spent up to now is 163.0 secs Computing kpt #: 51 total cpu time spent up to now is 166.1 secs Computing kpt #: 52 total cpu time spent up to now is 169.5 secs Computing kpt #: 53 total cpu time spent up to now is 172.6 secs Computing kpt #: 54 total cpu time spent up to now is 175.7 secs Computing kpt #: 55 total cpu time spent up to now is 178.9 secs Computing kpt #: 56 total cpu time spent up to now is 182.2 secs Computing kpt #: 57 total cpu time spent up to now is 185.5 secs Computing kpt #: 58 total cpu time spent up to now is 188.7 secs Computing kpt #: 59 total cpu time spent up to now is 191.9 secs Computing kpt #: 60 total cpu time spent up to now is 195.3 secs Computing kpt #: 61 total cpu time spent up to now is 198.5 secs Computing kpt #: 62 total cpu time spent up to now is 201.7 secs Computing kpt #: 63 total cpu time spent up to now is 205.0 secs Computing kpt #: 64 total cpu time spent up to now is 208.2 secs Computing kpt #: 65 total cpu time spent up to now is 212.0 secs Computing kpt #: 66 total cpu time spent up to now is 215.6 secs Computing kpt #: 67 total cpu time spent up to now is 218.9 secs Computing kpt #: 68 total cpu time spent up to now is 222.2 secs Computing kpt #: 69 total cpu time spent up to now is 225.7 secs Computing kpt #: 70 total cpu time spent up to now is 229.1 secs Computing kpt #: 71 total cpu time spent up to now is 232.5 secs Computing kpt #: 72 total cpu time spent up to now is 235.6 secs Computing kpt #: 73 total cpu time spent up to now is 238.9 secs Computing kpt #: 74 total cpu time spent up to now is 242.0 secs Computing kpt #: 75 total cpu time spent up to now is 245.8 secs Computing kpt #: 76 total cpu time spent up to now is 248.9 secs Computing kpt #: 77 total cpu time spent up to now is 252.3 secs Computing kpt #: 78 total cpu time spent up to now is 255.8 secs Computing kpt #: 79 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 263.1 secs Computing kpt #: 80 total cpu time spent up to now is 266.6 secs Computing kpt #: 81 total cpu time spent up to now is 270.0 secs Computing kpt #: 82 total cpu time spent up to now is 273.4 secs Computing kpt #: 83 total cpu time spent up to now is 276.8 secs Computing kpt #: 84 total cpu time spent up to now is 280.0 secs Computing kpt #: 85 total cpu time spent up to now is 283.3 secs Computing kpt #: 86 total cpu time spent up to now is 286.7 secs Computing kpt #: 87 total cpu time spent up to now is 290.1 secs Computing kpt #: 88 total cpu time spent up to now is 293.6 secs Computing kpt #: 89 total cpu time spent up to now is 297.0 secs Computing kpt #: 90 total cpu time spent up to now is 300.7 secs Computing kpt #: 91 total cpu time spent up to now is 304.0 secs Computing kpt #: 92 total cpu time spent up to now is 307.2 secs Computing kpt #: 93 total cpu time spent up to now is 310.4 secs Computing kpt #: 94 total cpu time spent up to now is 313.6 secs Computing kpt #: 95 total cpu time spent up to now is 316.7 secs Computing kpt #: 96 total cpu time spent up to now is 319.8 secs Computing kpt #: 97 total cpu time spent up to now is 323.0 secs Computing kpt #: 98 total cpu time spent up to now is 326.0 secs Computing kpt #: 99 total cpu time spent up to now is 329.1 secs Computing kpt #: 100 total cpu time spent up to now is 332.1 secs Computing kpt #: 101 total cpu time spent up to now is 335.3 secs Computing kpt #: 102 total cpu time spent up to now is 338.4 secs Computing kpt #: 103 total cpu time spent up to now is 341.5 secs Computing kpt #: 104 total cpu time spent up to now is 344.6 secs Computing kpt #: 105 total cpu time spent up to now is 347.7 secs Computing kpt #: 106 total cpu time spent up to now is 350.9 secs Computing kpt #: 107 total cpu time spent up to now is 354.2 secs Computing kpt #: 108 total cpu time spent up to now is 357.8 secs Computing kpt #: 109 total cpu time spent up to now is 361.5 secs Computing kpt #: 110 total cpu time spent up to now is 365.1 secs Computing kpt #: 111 total cpu time spent up to now is 368.4 secs Computing kpt #: 112 total cpu time spent up to now is 371.7 secs Computing kpt #: 113 total cpu time spent up to now is 375.0 secs Computing kpt #: 114 total cpu time spent up to now is 378.3 secs Computing kpt #: 115 total cpu time spent up to now is 381.5 secs Computing kpt #: 116 total cpu time spent up to now is 384.8 secs Computing kpt #: 117 total cpu time spent up to now is 388.1 secs Computing kpt #: 118 total cpu time spent up to now is 391.4 secs Computing kpt #: 119 total cpu time spent up to now is 394.6 secs Computing kpt #: 120 total cpu time spent up to now is 397.8 secs Computing kpt #: 121 total cpu time spent up to now is 401.0 secs Computing kpt #: 122 total cpu time spent up to now is 404.2 secs Computing kpt #: 123 total cpu time spent up to now is 407.5 secs Computing kpt #: 124 total cpu time spent up to now is 410.7 secs Computing kpt #: 125 total cpu time spent up to now is 414.0 secs Computing kpt #: 126 total cpu time spent up to now is 417.3 secs Computing kpt #: 127 total cpu time spent up to now is 420.6 secs Computing kpt #: 128 total cpu time spent up to now is 423.8 secs Computing kpt #: 129 total cpu time spent up to now is 427.5 secs Computing kpt #: 130 total cpu time spent up to now is 431.1 secs Computing kpt #: 131 total cpu time spent up to now is 434.6 secs Computing kpt #: 132 total cpu time spent up to now is 438.0 secs Computing kpt #: 133 total cpu time spent up to now is 441.5 secs Computing kpt #: 134 total cpu time spent up to now is 444.8 secs Computing kpt #: 135 total cpu time spent up to now is 448.2 secs Computing kpt #: 136 total cpu time spent up to now is 451.5 secs Computing kpt #: 137 total cpu time spent up to now is 454.8 secs Computing kpt #: 138 total cpu time spent up to now is 458.3 secs Computing kpt #: 139 total cpu time spent up to now is 461.5 secs Computing kpt #: 140 total cpu time spent up to now is 465.5 secs Computing kpt #: 141 total cpu time spent up to now is 469.1 secs Computing kpt #: 142 total cpu time spent up to now is 473.1 secs Computing kpt #: 143 total cpu time spent up to now is 477.0 secs Computing kpt #: 144 total cpu time spent up to now is 481.1 secs Computing kpt #: 145 total cpu time spent up to now is 485.2 secs Computing kpt #: 146 total cpu time spent up to now is 489.2 secs Computing kpt #: 147 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 496.3 secs Computing kpt #: 148 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 503.5 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 510.4 secs Computing kpt #: 150 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 517.4 secs Computing kpt #: 151 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 524.5 secs Computing kpt #: 152 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 531.6 secs Computing kpt #: 153 total cpu time spent up to now is 535.4 secs Computing kpt #: 154 total cpu time spent up to now is 539.3 secs Computing kpt #: 155 total cpu time spent up to now is 542.9 secs Computing kpt #: 156 total cpu time spent up to now is 546.6 secs Computing kpt #: 157 total cpu time spent up to now is 550.2 secs Computing kpt #: 158 total cpu time spent up to now is 553.8 secs Computing kpt #: 159 total cpu time spent up to now is 557.4 secs Computing kpt #: 160 total cpu time spent up to now is 560.6 secs Computing kpt #: 161 total cpu time spent up to now is 563.5 secs Computing kpt #: 162 total cpu time spent up to now is 566.4 secs Computing kpt #: 163 total cpu time spent up to now is 569.3 secs Computing kpt #: 164 total cpu time spent up to now is 572.2 secs Computing kpt #: 165 total cpu time spent up to now is 575.1 secs Computing kpt #: 166 total cpu time spent up to now is 578.1 secs Computing kpt #: 167 total cpu time spent up to now is 581.0 secs Computing kpt #: 168 total cpu time spent up to now is 584.0 secs Computing kpt #: 169 total cpu time spent up to now is 586.9 secs Computing kpt #: 170 total cpu time spent up to now is 590.0 secs Computing kpt #: 171 total cpu time spent up to now is 593.0 secs Computing kpt #: 172 total cpu time spent up to now is 596.2 secs Computing kpt #: 173 total cpu time spent up to now is 599.7 secs Computing kpt #: 174 total cpu time spent up to now is 603.0 secs Computing kpt #: 175 total cpu time spent up to now is 606.2 secs Computing kpt #: 176 total cpu time spent up to now is 609.7 secs Computing kpt #: 177 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 616.9 secs Computing kpt #: 178 total cpu time spent up to now is 620.4 secs Computing kpt #: 179 total cpu time spent up to now is 623.7 secs Computing kpt #: 180 total cpu time spent up to now is 626.7 secs Computing kpt #: 181 total cpu time spent up to now is 629.9 secs Computing kpt #: 182 total cpu time spent up to now is 632.9 secs Computing kpt #: 183 total cpu time spent up to now is 636.0 secs Computing kpt #: 184 total cpu time spent up to now is 639.0 secs Computing kpt #: 185 total cpu time spent up to now is 642.0 secs Computing kpt #: 186 total cpu time spent up to now is 644.8 secs Computing kpt #: 187 total cpu time spent up to now is 647.7 secs Computing kpt #: 188 total cpu time spent up to now is 650.5 secs Computing kpt #: 189 total cpu time spent up to now is 653.2 secs Computing kpt #: 190 total cpu time spent up to now is 656.0 secs Computing kpt #: 191 total cpu time spent up to now is 659.2 secs Computing kpt #: 192 total cpu time spent up to now is 662.5 secs Computing kpt #: 193 total cpu time spent up to now is 666.1 secs Computing kpt #: 194 total cpu time spent up to now is 669.7 secs Computing kpt #: 195 total cpu time spent up to now is 673.2 secs Computing kpt #: 196 total cpu time spent up to now is 676.7 secs Computing kpt #: 197 total cpu time spent up to now is 680.2 secs Computing kpt #: 198 total cpu time spent up to now is 683.3 secs Computing kpt #: 199 total cpu time spent up to now is 686.7 secs Computing kpt #: 200 total cpu time spent up to now is 690.2 secs Computing kpt #: 201 total cpu time spent up to now is 693.6 secs Computing kpt #: 202 total cpu time spent up to now is 697.0 secs Computing kpt #: 203 total cpu time spent up to now is 700.4 secs Computing kpt #: 204 total cpu time spent up to now is 703.8 secs Computing kpt #: 205 total cpu time spent up to now is 707.2 secs Computing kpt #: 206 total cpu time spent up to now is 710.6 secs Computing kpt #: 207 total cpu time spent up to now is 714.0 secs Computing kpt #: 208 total cpu time spent up to now is 717.3 secs Computing kpt #: 209 total cpu time spent up to now is 720.7 secs Computing kpt #: 210 total cpu time spent up to now is 724.0 secs Computing kpt #: 211 total cpu time spent up to now is 727.6 secs Computing kpt #: 212 total cpu time spent up to now is 731.2 secs Computing kpt #: 213 total cpu time spent up to now is 734.6 secs Computing kpt #: 214 total cpu time spent up to now is 738.5 secs Computing kpt #: 215 total cpu time spent up to now is 742.4 secs Computing kpt #: 216 total cpu time spent up to now is 746.3 secs Computing kpt #: 217 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 753.4 secs Computing kpt #: 218 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 760.5 secs Computing kpt #: 219 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 767.4 secs ethr = 9.26E-09, avg # of iterations = 26.9 total cpu time spent up to now is 767.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6403 PWs) bands (ev): 1.4852 1.4852 4.6947 4.6947 4.9492 4.9492 4.9492 4.9492 6.5187 6.5187 6.6972 6.6972 6.6972 6.6972 6.7021 6.7021 9.2184 9.2184 9.2184 9.2184 9.2304 9.2304 9.6902 9.6902 9.6902 9.6902 9.8628 9.8628 9.8628 9.8628 9.8631 9.8631 10.1399 10.1399 10.1399 10.1399 10.3822 10.3822 10.3822 10.3822 10.4020 10.4020 10.7423 10.7423 10.7509 10.7509 10.7509 10.7509 11.3797 11.3797 11.3797 11.3797 11.3837 11.3837 11.4510 11.4510 11.4510 11.4510 11.4548 11.4548 11.4909 11.4909 11.4909 11.4909 11.4993 11.4993 12.0933 12.0933 12.1456 12.1456 12.1456 12.1456 12.4152 12.4152 12.4618 12.4618 12.4618 12.4618 12.6477 12.6477 12.6928 12.6928 12.6928 12.6928 12.7296 12.7296 13.1046 13.1046 13.1046 13.1046 13.3860 13.3860 13.3860 13.3860 13.3931 13.3931 13.4531 13.4531 13.4531 13.4531 13.5169 13.5169 13.8329 13.8329 13.8666 13.8666 13.8666 13.8666 13.8994 13.8994 13.9218 13.9218 13.9218 13.9218 13.9825 13.9825 13.9898 13.9898 13.9898 13.9898 14.0320 14.0320 14.0320 14.0320 14.1823 14.1823 14.1834 14.1834 14.1834 14.1834 k = 0.0000 0.0179-0.0000 ( 6403 PWs) bands (ev): 1.4865 1.4865 4.6929 4.6929 4.9449 4.9449 4.9496 4.9496 6.5075 6.5075 6.6984 6.6984 6.7013 6.7013 6.7167 6.7167 9.2157 9.2157 9.2178 9.2178 9.2290 9.2290 9.6893 9.6893 9.6922 9.6922 9.8563 9.8563 9.8564 9.8564 9.8643 9.8643 10.1365 10.1365 10.1405 10.1405 10.3853 10.3853 10.3863 10.3863 10.4053 10.4053 10.7425 10.7425 10.7505 10.7505 10.7524 10.7524 11.3787 11.3787 11.3794 11.3794 11.3832 11.3832 11.4498 11.4498 11.4513 11.4513 11.4542 11.4542 11.4914 11.4914 11.4934 11.4934 11.5011 11.5011 12.0922 12.0922 12.1441 12.1441 12.1442 12.1442 12.4166 12.4166 12.4625 12.4625 12.4639 12.4639 12.6491 12.6491 12.6907 12.6907 12.6926 12.6926 12.7287 12.7287 13.1064 13.1064 13.1065 13.1065 13.3837 13.3837 13.3845 13.3845 13.3921 13.3921 13.4514 13.4514 13.4515 13.4515 13.5150 13.5150 13.8331 13.8331 13.8672 13.8672 13.8675 13.8675 13.9000 13.9000 13.9214 13.9214 13.9220 13.9220 13.9831 13.9831 13.9902 13.9902 13.9911 13.9911 14.0319 14.0319 14.0331 14.0331 14.1836 14.1836 14.1842 14.1842 14.1851 14.1851 k = 0.0000 0.0357-0.0000 ( 6399 PWs) bands (ev): 1.4905 1.4905 4.6871 4.6871 4.9328 4.9328 4.9506 4.9506 6.4828 6.4828 6.7020 6.7020 6.7052 6.7052 6.7600 6.7600 9.2067 9.2067 9.2161 9.2161 9.2260 9.2260 9.6865 9.6865 9.6976 9.6976 9.8376 9.8376 9.8377 9.8377 9.8685 9.8685 10.1279 10.1279 10.1427 10.1427 10.3936 10.3936 10.3972 10.3972 10.4147 10.4147 10.7396 10.7396 10.7531 10.7531 10.7572 10.7572 11.3759 11.3759 11.3769 11.3769 11.3836 11.3836 11.4447 11.4447 11.4527 11.4527 11.4543 11.4543 11.4915 11.4915 11.5002 11.5002 11.5071 11.5071 12.0887 12.0887 12.1398 12.1398 12.1402 12.1402 12.4202 12.4202 12.4648 12.4648 12.4701 12.4701 12.6527 12.6527 12.6845 12.6845 12.6917 12.6917 12.7272 12.7272 13.1117 13.1117 13.1120 13.1120 13.3767 13.3767 13.3794 13.3794 13.3897 13.3897 13.4468 13.4468 13.4470 13.4470 13.5097 13.5097 13.8337 13.8337 13.8688 13.8688 13.8701 13.8701 13.9020 13.9020 13.9201 13.9201 13.9228 13.9228 13.9847 13.9847 13.9917 13.9917 13.9949 13.9949 14.0318 14.0318 14.0366 14.0366 14.1869 14.1869 14.1874 14.1874 14.1904 14.1904 k = 0.0000 0.0536-0.0000 ( 6407 PWs) bands (ev): 1.4972 1.4972 4.6757 4.6757 4.9149 4.9149 4.9523 4.9523 6.4552 6.4552 6.7080 6.7080 6.7112 6.7112 6.8180 6.8180 9.1914 9.1914 9.2129 9.2129 9.2221 9.2221 9.6817 9.6817 9.7048 9.7048 9.8088 9.8088 9.8093 9.8093 9.8755 9.8755 10.1159 10.1159 10.1461 10.1461 10.4045 10.4045 10.4118 10.4118 10.4288 10.4288 10.7316 10.7316 10.7614 10.7614 10.7657 10.7657 11.3715 11.3715 11.3720 11.3720 11.3856 11.3856 11.4356 11.4356 11.4555 11.4555 11.4564 11.4564 11.4905 11.4905 11.5103 11.5103 11.5168 11.5168 12.0833 12.0833 12.1329 12.1329 12.1343 12.1343 12.4244 12.4244 12.4698 12.4698 12.4800 12.4800 12.6566 12.6566 12.6745 12.6745 12.6884 12.6884 12.7286 12.7286 13.1203 13.1203 13.1211 13.1211 13.3654 13.3654 13.3704 13.3704 13.3865 13.3865 13.4389 13.4389 13.4390 13.4390 13.5006 13.5006 13.8348 13.8348 13.8712 13.8712 13.8738 13.8738 13.9052 13.9052 13.9182 13.9182 13.9241 13.9241 13.9860 13.9860 13.9954 13.9954 14.0013 14.0013 14.0316 14.0316 14.0422 14.0422 14.1916 14.1916 14.1936 14.1936 14.1992 14.1992 k = 0.0000 0.0714-0.0000 ( 6407 PWs) bands (ev): 1.5065 1.5065 4.6563 4.6563 4.8950 4.8950 4.9546 4.9546 6.4293 6.4293 6.7164 6.7164 6.7196 6.7196 6.8846 6.8846 9.1714 9.1714 9.2078 9.2078 9.2169 9.2169 9.6750 9.6750 9.7116 9.7116 9.7731 9.7731 9.7740 9.7740 9.8852 9.8852 10.1042 10.1042 10.1511 10.1511 10.4151 10.4151 10.4254 10.4254 10.4472 10.4472 10.7203 10.7203 10.7747 10.7747 10.7787 10.7787 11.3658 11.3658 11.3660 11.3660 11.3888 11.3888 11.4229 11.4229 11.4601 11.4601 11.4603 11.4603 11.4885 11.4885 11.5228 11.5228 11.5289 11.5289 12.0760 12.0760 12.1240 12.1240 12.1269 12.1269 12.4274 12.4274 12.4786 12.4786 12.4929 12.4929 12.6587 12.6587 12.6611 12.6611 12.6805 12.6805 12.7371 12.7371 13.1321 13.1321 13.1335 13.1335 13.3502 13.3502 13.3577 13.3577 13.3824 13.3824 13.4278 13.4278 13.4286 13.4286 13.4882 13.4882 13.8361 13.8361 13.8740 13.8740 13.8781 13.8781 13.9092 13.9092 13.9157 13.9157 13.9259 13.9259 13.9868 13.9868 14.0013 14.0013 14.0099 14.0099 14.0314 14.0314 14.0502 14.0502 14.1986 14.1986 14.2028 14.2028 14.2110 14.2110 k = 0.0000 0.0893-0.0000 ( 6411 PWs) bands (ev): 1.5184 1.5184 4.6262 4.6262 4.8771 4.8771 4.9574 4.9574 6.4065 6.4065 6.7271 6.7271 6.7303 6.7303 6.9568 6.9568 9.1481 9.1481 9.2005 9.2005 9.2096 9.2096 9.6664 9.6664 9.7158 9.7158 9.7334 9.7334 9.7346 9.7346 9.8976 9.8976 10.0951 10.0951 10.1571 10.1571 10.4228 10.4228 10.4348 10.4348 10.4693 10.4693 10.7062 10.7062 10.7930 10.7930 10.7964 10.7964 11.3590 11.3590 11.3600 11.3600 11.3931 11.3931 11.4071 11.4071 11.4661 11.4661 11.4662 11.4662 11.4857 11.4857 11.5369 11.5369 11.5429 11.5429 12.0670 12.0670 12.1138 12.1138 12.1188 12.1188 12.4284 12.4284 12.4912 12.4912 12.5082 12.5082 12.6447 12.6447 12.6571 12.6571 12.6693 12.6693 12.7537 12.7537 13.1466 13.1466 13.1492 13.1492 13.3315 13.3315 13.3421 13.3421 13.3769 13.3769 13.4136 13.4136 13.4161 13.4161 13.4726 13.4726 13.8377 13.8377 13.8769 13.8769 13.8819 13.8819 13.9109 13.9109 13.9162 13.9162 13.9281 13.9281 13.9873 13.9873 14.0093 14.0093 14.0207 14.0207 14.0312 14.0312 14.0593 14.0593 14.2082 14.2082 14.2149 14.2149 14.2255 14.2255 k = 0.0000 0.1071-0.0000 ( 6403 PWs) bands (ev): 1.5330 1.5330 4.5838 4.5838 4.8641 4.8641 4.9610 4.9610 6.3871 6.3871 6.7402 6.7402 6.7433 6.7433 7.0328 7.0328 9.1228 9.1228 9.1897 9.1897 9.1990 9.1990 9.6560 9.6560 9.6924 9.6924 9.6936 9.6936 9.7158 9.7158 9.9128 9.9128 10.0911 10.0911 10.1645 10.1645 10.4262 10.4262 10.4390 10.4390 10.4930 10.4930 10.6902 10.6902 10.8161 10.8161 10.8189 10.8189 11.3523 11.3523 11.3538 11.3538 11.3884 11.3884 11.3982 11.3982 11.4730 11.4730 11.4735 11.4735 11.4822 11.4822 11.5523 11.5523 11.5581 11.5581 12.0562 12.0562 12.1031 12.1031 12.1106 12.1106 12.4276 12.4276 12.5068 12.5068 12.5254 12.5254 12.6261 12.6261 12.6469 12.6469 12.6614 12.6614 12.7767 12.7767 13.1636 13.1636 13.1679 13.1679 13.3100 13.3100 13.3241 13.3241 13.3691 13.3691 13.3964 13.3964 13.4026 13.4026 13.4541 13.4541 13.8395 13.8395 13.8795 13.8795 13.8844 13.8844 13.9076 13.9076 13.9227 13.9227 13.9306 13.9306 13.9878 13.9878 14.0189 14.0189 14.0310 14.0310 14.0330 14.0330 14.0695 14.0695 14.2210 14.2210 14.2304 14.2304 14.2422 14.2422 k = 0.0000 0.1250-0.0000 ( 6411 PWs) bands (ev): 1.5501 1.5501 4.5298 4.5298 4.8569 4.8569 4.9650 4.9650 6.3706 6.3706 6.7555 6.7555 6.7586 6.7586 7.1111 7.1111 9.0967 9.0967 9.1743 9.1743 9.1838 9.1838 9.6435 9.6435 9.6525 9.6525 9.6540 9.6540 9.7098 9.7098 9.9307 9.9307 10.0935 10.0935 10.1732 10.1732 10.4247 10.4247 10.4379 10.4379 10.5173 10.5173 10.6726 10.6726 10.8432 10.8432 10.8454 10.8454 11.3460 11.3460 11.3476 11.3476 11.3671 11.3671 11.4041 11.4041 11.4756 11.4756 11.4818 11.4818 11.4830 11.4830 11.5687 11.5687 11.5742 11.5742 12.0433 12.0433 12.0927 12.0927 12.1026 12.1026 12.4253 12.4253 12.5240 12.5240 12.5435 12.5435 12.6057 12.6057 12.6297 12.6297 12.6567 12.6567 12.8044 12.8044 13.1826 13.1826 13.1892 13.1892 13.2863 13.2863 13.3042 13.3042 13.3577 13.3577 13.3765 13.3765 13.3900 13.3900 13.4331 13.4331 13.8415 13.8415 13.8815 13.8815 13.8845 13.8845 13.9037 13.9037 13.9312 13.9312 13.9336 13.9336 13.9883 13.9883 14.0295 14.0295 14.0309 14.0309 14.0463 14.0463 14.0806 14.0806 14.2371 14.2371 14.2495 14.2495 14.2607 14.2607 k = 0.0000 0.1429-0.0000 ( 6403 PWs) bands (ev): 1.5697 1.5697 4.4660 4.4660 4.8548 4.8548 4.9696 4.9696 6.3567 6.3567 6.7730 6.7730 6.7761 6.7761 7.1904 7.1904 9.0704 9.0704 9.1534 9.1534 9.1631 9.1631 9.6160 9.6160 9.6179 9.6179 9.6296 9.6296 9.6983 9.6983 9.9512 9.9512 10.1022 10.1022 10.1832 10.1832 10.4186 10.4186 10.4320 10.4320 10.5412 10.5412 10.6542 10.6542 10.8731 10.8731 10.8747 10.8747 11.3395 11.3395 11.3403 11.3403 11.3460 11.3460 11.4109 11.4109 11.4699 11.4699 11.4907 11.4907 11.4917 11.4917 11.5860 11.5860 11.5912 11.5912 12.0282 12.0282 12.0836 12.0836 12.0953 12.0953 12.4222 12.4222 12.5416 12.5416 12.5615 12.5615 12.5849 12.5849 12.6108 12.6108 12.6520 12.6520 12.8355 12.8355 13.2025 13.2025 13.2128 13.2128 13.2615 13.2615 13.2829 13.2829 13.3417 13.3417 13.3540 13.3540 13.3795 13.3795 13.4098 13.4098 13.8434 13.8434 13.8820 13.8820 13.8827 13.8827 13.9001 13.9001 13.9369 13.9369 13.9408 13.9408 13.9888 13.9888 14.0301 14.0301 14.0416 14.0416 14.0600 14.0600 14.0923 14.0923 14.2567 14.2567 14.2719 14.2719 14.2804 14.2804 k = 0.0000 0.1607-0.0000 ( 6407 PWs) bands (ev): 1.5919 1.5919 4.3949 4.3949 4.8566 4.8566 4.9746 4.9746 6.3449 6.3449 6.7927 6.7927 6.7957 6.7957 7.2698 7.2698 9.0443 9.0443 9.1258 9.1258 9.1356 9.1356 9.5847 9.5847 9.5869 9.5869 9.6138 9.6138 9.6825 9.6825 9.9744 9.9744 10.1165 10.1165 10.1945 10.1945 10.4085 10.4085 10.4220 10.4220 10.5642 10.5642 10.6353 10.6353 10.9048 10.9048 10.9057 10.9057 11.3161 11.3161 11.3357 11.3357 11.3390 11.3390 11.4185 11.4185 11.4621 11.4621 11.5001 11.5001 11.5015 11.5015 11.6039 11.6039 11.6088 11.6088 12.0109 12.0109 12.0761 12.0761 12.0887 12.0887 12.4184 12.4184 12.5570 12.5570 12.5595 12.5595 12.5836 12.5836 12.5934 12.5934 12.6469 12.6469 12.8691 12.8691 13.2160 13.2160 13.2372 13.2372 13.2430 13.2430 13.2613 13.2613 13.3220 13.3220 13.3290 13.3290 13.3707 13.3707 13.3846 13.3846 13.8452 13.8452 13.8768 13.8768 13.8830 13.8830 13.8965 13.8965 13.9406 13.9406 13.9512 13.9512 13.9894 13.9894 14.0296 14.0296 14.0541 14.0541 14.0738 14.0738 14.1044 14.1044 14.2792 14.2792 14.2972 14.2972 14.3010 14.3010 k = 0.0000 0.1786-0.0000 ( 6395 PWs) bands (ev): 1.6164 1.6164 4.3184 4.3184 4.8614 4.8614 4.9800 4.9800 6.3348 6.3348 6.8146 6.8146 6.8175 6.8175 7.3481 7.3481 9.0188 9.0188 9.0911 9.0911 9.1011 9.1011 9.5598 9.5598 9.5623 9.5623 9.5966 9.5966 9.6642 9.6642 10.0000 10.0000 10.1351 10.1351 10.2071 10.2071 10.3950 10.3950 10.4085 10.4085 10.5858 10.5858 10.6166 10.6166 10.9369 10.9369 10.9373 10.9373 11.2884 11.2884 11.3323 11.3323 11.3356 11.3356 11.4267 11.4267 11.4524 11.4524 11.5096 11.5096 11.5116 11.5116 11.6226 11.6226 11.6271 11.6271 11.9921 11.9921 12.0703 12.0703 12.0830 12.0830 12.4143 12.4143 12.5381 12.5381 12.5581 12.5581 12.5898 12.5898 12.6015 12.6015 12.6418 12.6418 12.9044 12.9044 13.1981 13.1981 13.2344 13.2344 13.2559 13.2559 13.2672 13.2672 13.3002 13.3002 13.3018 13.3018 13.3565 13.3565 13.3642 13.3642 13.8469 13.8469 13.8695 13.8695 13.8825 13.8825 13.8928 13.8928 13.9447 13.9447 13.9620 13.9620 13.9901 13.9901 14.0290 14.0290 14.0673 14.0673 14.0876 14.0876 14.1166 14.1166 14.3036 14.3036 14.3217 14.3217 14.3253 14.3253 k = 0.0000 0.1964-0.0000 ( 6399 PWs) bands (ev): 1.6434 1.6434 4.2381 4.2381 4.8683 4.8683 4.9858 4.9858 6.3258 6.3258 6.8384 6.8384 6.8412 6.8412 7.4246 7.4246 8.9937 8.9937 9.0494 9.0494 9.0595 9.0595 9.5415 9.5415 9.5444 9.5444 9.5778 9.5778 9.6451 9.6451 10.0281 10.0281 10.1566 10.1566 10.2210 10.2210 10.3788 10.3788 10.3924 10.3924 10.5983 10.5983 10.6058 10.6058 10.9682 10.9682 10.9685 10.9685 11.2589 11.2589 11.3301 11.3301 11.3334 11.3334 11.4357 11.4357 11.4407 11.4407 11.5190 11.5190 11.5217 11.5217 11.6416 11.6416 11.6458 11.6458 11.9718 11.9718 12.0660 12.0660 12.0783 12.0783 12.4101 12.4101 12.5166 12.5166 12.5425 12.5425 12.6018 12.6018 12.6194 12.6194 12.6373 12.6373 12.9408 12.9408 13.1701 13.1701 13.2107 13.2107 13.2724 13.2724 13.2755 13.2755 13.2792 13.2792 13.2951 13.2951 13.3291 13.3291 13.3569 13.3569 13.8481 13.8481 13.8607 13.8607 13.8811 13.8811 13.8884 13.8884 13.9491 13.9491 13.9730 13.9730 13.9910 13.9910 14.0284 14.0284 14.0810 14.0810 14.1013 14.1013 14.1288 14.1288 14.3277 14.3277 14.3432 14.3432 14.3528 14.3528 k = 0.0000 0.2143-0.0000 ( 6387 PWs) bands (ev): 1.6726 1.6726 4.1552 4.1552 4.8769 4.8769 4.9918 4.9918 6.3178 6.3178 6.8641 6.8641 6.8668 6.8668 7.4984 7.4984 8.9690 8.9690 9.0017 9.0017 9.0119 9.0119 9.5295 9.5295 9.5329 9.5329 9.5579 9.5579 9.6274 9.6274 10.0587 10.0587 10.1801 10.1801 10.2361 10.2361 10.3606 10.3606 10.3741 10.3741 10.5808 10.5808 10.6238 10.6238 10.9978 10.9978 10.9987 10.9987 11.2280 11.2280 11.3294 11.3294 11.3327 11.3327 11.4266 11.4266 11.4451 11.4451 11.5282 11.5282 11.5316 11.5316 11.6612 11.6612 11.6650 11.6650 11.9508 11.9508 12.0629 12.0629 12.0744 12.0744 12.4059 12.4059 12.4962 12.4962 12.5249 12.5249 12.6121 12.6121 12.6365 12.6365 12.6368 12.6368 12.9778 12.9778 13.1409 13.1409 13.1861 13.1861 13.2415 13.2415 13.2514 13.2514 13.2988 13.2988 13.3039 13.3039 13.3221 13.3221 13.3530 13.3530 13.8486 13.8486 13.8506 13.8506 13.8793 13.8793 13.8833 13.8833 13.9540 13.9540 13.9840 13.9840 13.9919 13.9919 14.0277 14.0277 14.0952 14.0952 14.1150 14.1150 14.1407 14.1407 14.3482 14.3482 14.3645 14.3645 14.3761 14.3761 k = 0.0000 0.2321-0.0000 ( 6391 PWs) bands (ev): 1.7040 1.7040 4.0709 4.0709 4.8866 4.8866 4.9980 4.9980 6.3105 6.3105 6.8916 6.8916 6.8942 6.8942 7.5691 7.5691 8.9439 8.9439 8.9492 8.9492 8.9596 8.9596 9.5227 9.5227 9.5267 9.5267 9.5371 9.5371 9.6125 9.6125 10.0915 10.0915 10.2046 10.2046 10.2524 10.2524 10.3409 10.3409 10.3542 10.3542 10.5642 10.5642 10.6396 10.6396 11.0251 11.0251 11.0267 11.0267 11.1960 11.1960 11.3304 11.3304 11.3335 11.3335 11.4100 11.4100 11.4550 11.4550 11.5370 11.5370 11.5412 11.5412 11.6809 11.6809 11.6843 11.6843 11.9293 11.9293 12.0607 12.0607 12.0711 12.0711 12.4020 12.4020 12.4777 12.4777 12.5084 12.5084 12.6128 12.6128 12.6452 12.6452 12.6524 12.6524 13.0146 13.0146 13.1109 13.1109 13.1607 13.1607 13.2087 13.2087 13.2253 13.2253 13.2713 13.2713 13.3290 13.3290 13.3322 13.3322 13.3646 13.3646 13.8394 13.8394 13.8482 13.8482 13.8772 13.8772 13.8774 13.8774 13.9591 13.9591 13.9929 13.9929 13.9947 13.9947 14.0275 14.0275 14.1098 14.1098 14.1287 14.1287 14.1525 14.1525 14.3626 14.3626 14.3853 14.3853 14.3906 14.3906 k = 0.0000 0.2500-0.0000 ( 6383 PWs) bands (ev): 1.7374 1.7374 3.9858 3.9858 4.8973 4.8973 5.0044 5.0044 6.3035 6.3035 6.9208 6.9208 6.9232 6.9232 7.6361 7.6361 8.8931 8.8931 8.9026 8.9026 8.9193 8.9193 9.5151 9.5151 9.5209 9.5209 9.5249 9.5249 9.6020 9.6020 10.1265 10.1265 10.2295 10.2295 10.2699 10.2699 10.3200 10.3200 10.3332 10.3332 10.5488 10.5488 10.6529 10.6529 11.0498 11.0498 11.0520 11.0520 11.1631 11.1631 11.3331 11.3331 11.3360 11.3360 11.3907 11.3907 11.4653 11.4653 11.5455 11.5455 11.5504 11.5504 11.7009 11.7009 11.7039 11.7039 11.9079 11.9079 12.0591 12.0591 12.0684 12.0684 12.3987 12.3987 12.4618 12.4618 12.4945 12.4945 12.6081 12.6081 12.6580 12.6580 12.6671 12.6671 13.0499 13.0499 13.0812 13.0812 13.1364 13.1364 13.1747 13.1747 13.1971 13.1971 13.2454 13.2454 13.3282 13.3282 13.3541 13.3541 13.3913 13.3913 13.8271 13.8271 13.8466 13.8466 13.8707 13.8707 13.8753 13.8753 13.9644 13.9644 13.9941 13.9941 14.0051 14.0051 14.0268 14.0268 14.1247 14.1247 14.1424 14.1424 14.1637 14.1637 14.3713 14.3713 14.3976 14.3976 14.4057 14.4057 k = 0.0000 0.2679-0.0000 ( 6391 PWs) bands (ev): 1.7727 1.7727 3.9009 3.9009 4.9086 4.9086 5.0107 5.0107 6.2968 6.2968 6.9514 6.9514 6.9537 6.9537 7.6992 7.6992 8.8346 8.8346 8.8445 8.8445 8.8923 8.8923 9.4934 9.4934 9.5219 9.5219 9.5266 9.5266 9.5971 9.5971 10.1636 10.1636 10.2542 10.2542 10.2886 10.2886 10.2984 10.2984 10.3113 10.3113 10.5347 10.5347 10.6637 10.6637 11.0714 11.0714 11.0742 11.0742 11.1295 11.1295 11.3375 11.3375 11.3399 11.3399 11.3687 11.3687 11.4757 11.4757 11.5534 11.5534 11.5590 11.5590 11.7208 11.7208 11.7235 11.7235 11.8867 11.8867 12.0577 12.0577 12.0657 12.0657 12.3960 12.3960 12.4488 12.4488 12.4833 12.4833 12.6019 12.6019 12.6711 12.6711 12.6803 12.6803 13.0520 13.0520 13.0760 13.0760 13.1203 13.1203 13.1395 13.1395 13.1662 13.1662 13.2228 13.2228 13.3217 13.3217 13.3788 13.3788 13.4202 13.4202 13.8137 13.8137 13.8435 13.8435 13.8635 13.8635 13.8739 13.8739 13.9698 13.9698 13.9954 13.9954 14.0150 14.0150 14.0260 14.0260 14.1394 14.1394 14.1558 14.1558 14.1744 14.1744 14.3762 14.3762 14.4009 14.4009 14.4253 14.4253 k = 0.0000 0.2857-0.0000 ( 6403 PWs) bands (ev): 1.8098 1.8098 3.8166 3.8166 4.9203 4.9203 5.0171 5.0171 6.2903 6.2903 6.9832 6.9832 6.9854 6.9854 7.7584 7.7584 8.7748 8.7748 8.7848 8.7848 8.8637 8.8637 9.4714 9.4714 9.5258 9.5258 9.5310 9.5310 9.5983 9.5983 10.2024 10.2024 10.2765 10.2765 10.2782 10.2782 10.2891 10.2891 10.3084 10.3084 10.5219 10.5219 10.6717 10.6717 11.0897 11.0897 11.0899 11.0899 11.0987 11.0987 11.3407 11.3407 11.3435 11.3435 11.3483 11.3483 11.4863 11.4863 11.5608 11.5608 11.5671 11.5671 11.7405 11.7405 11.7431 11.7431 11.8664 11.8664 12.0559 12.0559 12.0629 12.0629 12.3943 12.3943 12.4394 12.4394 12.4756 12.4756 12.5953 12.5953 12.6832 12.6832 12.6919 12.6919 13.0235 13.0235 13.0681 13.0681 13.1034 13.1034 13.1315 13.1315 13.1382 13.1382 13.2038 13.2038 13.3148 13.3148 13.4027 13.4027 13.4490 13.4490 13.7994 13.7994 13.8391 13.8391 13.8557 13.8557 13.8730 13.8730 13.9751 13.9751 13.9968 13.9968 14.0244 14.0244 14.0253 14.0253 14.1541 14.1541 14.1690 14.1690 14.1845 14.1845 14.3788 14.3788 14.4022 14.4022 14.4439 14.4439 k = 0.0000 0.3036-0.0000 ( 6407 PWs) bands (ev): 1.8483 1.8483 3.7336 3.7336 4.9322 4.9322 5.0233 5.0233 6.2838 6.2838 7.0161 7.0161 7.0181 7.0181 7.8136 7.8136 8.7147 8.7147 8.7249 8.7249 8.8332 8.8332 9.4496 9.4496 9.5318 9.5318 9.5374 9.5374 9.6059 9.6059 10.2404 10.2404 10.2572 10.2572 10.2665 10.2665 10.3017 10.3017 10.3292 10.3292 10.5105 10.5105 10.6769 10.6769 11.0600 11.0600 11.1051 11.1051 11.1101 11.1101 11.3142 11.3142 11.3509 11.3509 11.3534 11.3534 11.4969 11.4969 11.5675 11.5675 11.5745 11.5745 11.7596 11.7596 11.7625 11.7625 11.8473 11.8473 12.0536 12.0536 12.0597 12.0597 12.3936 12.3936 12.4340 12.4340 12.4718 12.4718 12.5886 12.5886 12.6942 12.6942 12.7020 12.7020 12.9959 12.9959 13.0441 13.0441 13.0665 13.0665 13.0970 13.0970 13.1667 13.1667 13.1903 13.1903 13.3082 13.3082 13.4258 13.4258 13.4769 13.4769 13.7842 13.7842 13.8338 13.8338 13.8478 13.8478 13.8726 13.8726 13.9800 13.9800 13.9985 13.9985 14.0245 14.0245 14.0332 14.0332 14.1687 14.1687 14.1822 14.1822 14.1939 14.1939 14.3799 14.3799 14.4026 14.4026 14.4615 14.4615 k = 0.0000 0.3214-0.0000 ( 6411 PWs) bands (ev): 1.8880 1.8880 3.6525 3.6525 4.9440 4.9440 5.0293 5.0293 6.2775 6.2775 7.0496 7.0496 7.0514 7.0514 7.8650 7.8650 8.6551 8.6551 8.6654 8.6654 8.8005 8.8005 9.4285 9.4285 9.5393 9.5393 9.5453 9.5453 9.6197 9.6197 10.2307 10.2307 10.2444 10.2444 10.2876 10.2876 10.3238 10.3238 10.3510 10.3510 10.5004 10.5004 10.6794 10.6794 11.0256 11.0256 11.1175 11.1175 11.1231 11.1231 11.2829 11.2829 11.3591 11.3591 11.3611 11.3611 11.5073 11.5073 11.5736 11.5736 11.5812 11.5812 11.7770 11.7770 11.7816 11.7816 11.8308 11.8308 12.0503 12.0503 12.0558 12.0558 12.3942 12.3942 12.4329 12.4329 12.4721 12.4721 12.5822 12.5822 12.7039 12.7039 12.7106 12.7106 12.9698 12.9698 13.0180 13.0180 13.0290 13.0290 13.0602 13.0602 13.1693 13.1693 13.2070 13.2070 13.3024 13.3024 13.4478 13.4478 13.5033 13.5033 13.7679 13.7679 13.8280 13.8280 13.8399 13.8399 13.8723 13.8723 13.9845 13.9845 14.0004 14.0004 14.0239 14.0239 14.0416 14.0416 14.1827 14.1827 14.1947 14.1947 14.2030 14.2030 14.3802 14.3802 14.4025 14.4025 14.4781 14.4781 k = 0.0000 0.3393-0.0000 ( 6399 PWs) bands (ev): 1.9285 1.9285 3.5740 3.5740 4.9556 4.9556 5.0351 5.0351 6.2712 6.2712 7.0835 7.0835 7.0850 7.0850 7.9132 7.9132 8.5968 8.5968 8.6073 8.6073 8.7659 8.7659 9.4083 9.4083 9.5480 9.5480 9.5543 9.5543 9.6389 9.6389 10.2097 10.2097 10.2227 10.2227 10.3311 10.3311 10.3446 10.3446 10.3738 10.3738 10.4916 10.4916 10.6792 10.6792 10.9915 10.9915 11.1274 11.1274 11.1335 11.1335 11.2487 11.2487 11.3678 11.3678 11.3694 11.3694 11.5174 11.5174 11.5792 11.5792 11.5873 11.5873 11.7877 11.7877 11.8003 11.8003 11.8219 11.8219 12.0460 12.0460 12.0512 12.0512 12.3958 12.3958 12.4365 12.4365 12.4767 12.4767 12.5760 12.5760 12.7124 12.7124 12.7176 12.7176 12.9452 12.9452 12.9915 12.9915 12.9919 12.9919 13.0227 13.0227 13.1588 13.1588 13.2371 13.2371 13.2992 13.2992 13.4683 13.4683 13.5277 13.5277 13.7511 13.7511 13.8220 13.8220 13.8321 13.8321 13.8721 13.8721 13.9884 13.9884 14.0025 14.0025 14.0233 14.0233 14.0491 14.0491 14.1961 14.1961 14.2060 14.2060 14.2119 14.2119 14.3799 14.3799 14.4020 14.4020 14.4933 14.4933 k = 0.0000 0.3571-0.0000 ( 6399 PWs) bands (ev): 1.9693 1.9693 3.4987 3.4987 4.9666 4.9666 5.0405 5.0405 6.2651 6.2651 7.1171 7.1171 7.1185 7.1185 7.9582 7.9582 8.5406 8.5406 8.5513 8.5513 8.7298 8.7298 9.3893 9.3893 9.5572 9.5572 9.5639 9.5639 9.6622 9.6622 10.1890 10.1890 10.2016 10.2016 10.3637 10.3637 10.3757 10.3757 10.3977 10.3977 10.4840 10.4840 10.6766 10.6766 10.9572 10.9572 11.1351 11.1351 11.1419 11.1419 11.2118 11.2118 11.3765 11.3765 11.3778 11.3778 11.5270 11.5270 11.5839 11.5839 11.5925 11.5925 11.7830 11.7830 11.8185 11.8185 11.8293 11.8293 12.0403 12.0403 12.0457 12.0457 12.3987 12.3987 12.4442 12.4442 12.4852 12.4852 12.5703 12.5703 12.7197 12.7197 12.7232 12.7232 12.9225 12.9225 12.9541 12.9541 12.9665 12.9665 12.9849 12.9849 13.1494 13.1494 13.2599 13.2599 13.3039 13.3039 13.4872 13.4872 13.5498 13.5498 13.7336 13.7336 13.8160 13.8160 13.8247 13.8247 13.8718 13.8718 13.9915 13.9915 14.0047 14.0047 14.0229 14.0229 14.0560 14.0560 14.2086 14.2086 14.2151 14.2151 14.2216 14.2216 14.3791 14.3791 14.4012 14.4012 14.5073 14.5073 k = 0.0000 0.3750-0.0000 ( 6395 PWs) bands (ev): 2.0098 2.0098 3.4274 3.4274 4.9770 4.9770 5.0454 5.0454 6.2592 6.2592 7.1501 7.1501 7.1512 7.1512 8.0005 8.0005 8.4873 8.4873 8.4982 8.4982 8.6927 8.6927 9.3718 9.3718 9.5666 9.5666 9.5737 9.5737 9.6884 9.6884 10.1695 10.1695 10.1818 10.1818 10.3811 10.3811 10.4164 10.4164 10.4271 10.4271 10.4775 10.4775 10.6719 10.6719 10.9235 10.9235 11.1413 11.1413 11.1484 11.1484 11.1727 11.1727 11.3849 11.3849 11.3858 11.3858 11.5360 11.5360 11.5882 11.5882 11.5972 11.5972 11.7714 11.7714 11.8360 11.8360 11.8449 11.8449 12.0335 12.0335 12.0395 12.0395 12.4024 12.4024 12.4561 12.4561 12.4977 12.4977 12.5652 12.5652 12.7259 12.7259 12.7272 12.7272 12.9017 12.9017 12.9173 12.9173 12.9419 12.9419 12.9476 12.9476 13.1414 13.1414 13.2669 13.2669 13.3245 13.3245 13.5043 13.5043 13.5689 13.5689 13.7158 13.7158 13.8102 13.8102 13.8179 13.8179 13.8715 13.8715 13.9941 13.9941 14.0068 14.0068 14.0228 14.0228 14.0621 14.0621 14.2201 14.2201 14.2222 14.2222 14.2316 14.2316 14.3780 14.3780 14.4003 14.4003 14.5198 14.5198 k = 0.0000 0.3929-0.0000 ( 6407 PWs) bands (ev): 2.0492 2.0492 3.3610 3.3610 4.9865 4.9865 5.0499 5.0499 6.2538 6.2538 7.1817 7.1817 7.1824 7.1824 8.0401 8.0401 8.4377 8.4377 8.4490 8.4490 8.6552 8.6552 9.3561 9.3561 9.5760 9.5760 9.5834 9.5834 9.7158 9.7158 10.1515 10.1515 10.1636 10.1636 10.3965 10.3965 10.4434 10.4434 10.4711 10.4711 10.4721 10.4721 10.6655 10.6655 10.8907 10.8907 11.1314 11.1314 11.1459 11.1459 11.1538 11.1538 11.3925 11.3925 11.3931 11.3931 11.5441 11.5441 11.5919 11.5919 11.6012 11.6012 11.7595 11.7595 11.8526 11.8526 11.8618 11.8618 12.0256 12.0256 12.0326 12.0326 12.4068 12.4068 12.4717 12.4717 12.5136 12.5136 12.5605 12.5605 12.7294 12.7294 12.7309 12.7309 12.8803 12.8803 12.8841 12.8841 12.9085 12.9085 12.9206 12.9206 13.1350 13.1350 13.2654 13.2654 13.3533 13.3533 13.5195 13.5195 13.5842 13.5842 13.6983 13.6983 13.8049 13.8049 13.8116 13.8116 13.8710 13.8710 13.9961 13.9961 14.0086 14.0086 14.0231 14.0231 14.0674 14.0674 14.2280 14.2280 14.2305 14.2305 14.2412 14.2412 14.3766 14.3766 14.3992 14.3992 14.5307 14.5307 k = 0.0000 0.4107-0.0000 ( 6415 PWs) bands (ev): 2.0865 2.0865 3.3008 3.3008 4.9950 4.9950 5.0537 5.0537 6.2488 6.2488 7.2110 7.2110 7.2115 7.2115 8.0772 8.0772 8.3930 8.3930 8.4045 8.4045 8.6185 8.6185 9.3424 9.3424 9.5849 9.5849 9.5926 9.5926 9.7428 9.7428 10.1353 10.1353 10.1472 10.1472 10.4098 10.4098 10.4674 10.4674 10.4681 10.4681 10.5175 10.5175 10.6582 10.6582 10.8591 10.8591 11.0894 11.0894 11.1495 11.1495 11.1576 11.1576 11.3991 11.3991 11.3995 11.3995 11.5512 11.5512 11.5949 11.5949 11.6046 11.6046 11.7488 11.7488 11.8681 11.8681 11.8785 11.8785 12.0170 12.0170 12.0255 12.0255 12.4114 12.4114 12.4903 12.4903 12.5326 12.5326 12.5565 12.5565 12.7293 12.7293 12.7349 12.7349 12.8474 12.8474 12.8673 12.8673 12.8718 12.8718 12.9002 12.9002 13.1298 13.1298 13.2621 13.2621 13.3837 13.3837 13.5325 13.5325 13.5942 13.5942 13.6825 13.6825 13.8001 13.8001 13.8062 13.8062 13.8704 13.8704 13.9977 13.9977 14.0096 14.0096 14.0237 14.0237 14.0720 14.0720 14.2328 14.2328 14.2395 14.2395 14.2498 14.2498 14.3752 14.3752 14.3981 14.3981 14.5400 14.5400 k = 0.0000 0.4286-0.0000 ( 6411 PWs) bands (ev): 2.1204 2.1204 3.2479 3.2479 5.0021 5.0021 5.0570 5.0570 6.2446 6.2446 7.2371 7.2371 7.2373 7.2373 8.1113 8.1113 8.3540 8.3540 8.3658 8.3658 8.5837 8.5837 9.3309 9.3309 9.5929 9.5929 9.6008 9.6008 9.7679 9.7679 10.1213 10.1213 10.1330 10.1330 10.4210 10.4210 10.4640 10.4640 10.4915 10.4915 10.5634 10.5634 10.6505 10.6505 10.8295 10.8295 11.0471 11.0471 11.1522 11.1522 11.1605 11.1605 11.4047 11.4047 11.4048 11.4048 11.5573 11.5573 11.5974 11.5974 11.6073 11.6073 11.7398 11.7398 11.8823 11.8823 11.8947 11.8947 12.0075 12.0075 12.0181 12.0181 12.4162 12.4162 12.5117 12.5117 12.5526 12.5526 12.5548 12.5548 12.7255 12.7255 12.7379 12.7379 12.8178 12.8178 12.8361 12.8361 12.8538 12.8538 12.8825 12.8825 13.1259 13.1259 13.2587 13.2587 13.4140 13.4140 13.5433 13.5433 13.5964 13.5964 13.6707 13.6707 13.7961 13.7961 13.8017 13.8017 13.8699 13.8699 13.9991 13.9991 14.0101 14.0101 14.0246 14.0246 14.0758 14.0758 14.2368 14.2368 14.2472 14.2472 14.2571 14.2571 14.3737 14.3737 14.3970 14.3970 14.5477 14.5477 k = 0.0000 0.4464-0.0000 ( 6435 PWs) bands (ev): 2.1494 2.1494 3.2041 3.2041 5.0078 5.0078 5.0595 5.0595 6.2410 6.2410 7.2590 7.2590 7.2591 7.2591 8.1413 8.1413 8.3221 8.3221 8.3341 8.3341 8.5521 8.5521 9.3218 9.3218 9.5997 9.5997 9.6077 9.6077 9.7894 9.7894 10.1100 10.1100 10.1215 10.1215 10.4297 10.4297 10.4612 10.4612 10.5133 10.5133 10.6068 10.6068 10.6433 10.6433 10.8029 10.8029 11.0061 11.0061 11.1540 11.1540 11.1626 11.1626 11.4090 11.4090 11.4090 11.4090 11.5622 11.5622 11.5992 11.5992 11.6093 11.6093 11.7326 11.7326 11.8947 11.8947 11.9100 11.9100 11.9974 11.9974 12.0109 12.0109 12.4205 12.4205 12.5349 12.5349 12.5504 12.5504 12.5775 12.5775 12.7158 12.7158 12.7394 12.7394 12.7951 12.7951 12.8028 12.8028 12.8431 12.8431 12.8680 12.8680 13.1229 13.1229 13.2558 13.2558 13.4435 13.4435 13.5519 13.5519 13.5887 13.5887 13.6651 13.6651 13.7928 13.7928 13.7981 13.7981 13.8694 13.8694 14.0000 14.0000 14.0100 14.0100 14.0255 14.0255 14.0787 14.0787 14.2398 14.2398 14.2532 14.2532 14.2631 14.2631 14.3724 14.3724 14.3961 14.3961 14.5537 14.5537 k = 0.0000 0.4643-0.0000 ( 6427 PWs) bands (ev): 2.1719 2.1719 3.1711 3.1711 5.0120 5.0120 5.0614 5.0614 6.2384 6.2384 7.2754 7.2754 7.2757 7.2757 8.1660 8.1660 8.2982 8.2982 8.3104 8.3104 8.5262 8.5262 9.3152 9.3152 9.6047 9.6047 9.6130 9.6130 9.8060 9.8060 10.1016 10.1016 10.1130 10.1130 10.4360 10.4360 10.4593 10.4593 10.5319 10.5319 10.6374 10.6374 10.6457 10.6457 10.7807 10.7807 10.9693 10.9693 11.1554 11.1554 11.1642 11.1642 11.4120 11.4120 11.4122 11.4122 11.5658 11.5658 11.6006 11.6006 11.6108 11.6108 11.7275 11.7275 11.9048 11.9048 11.9240 11.9240 11.9872 11.9872 12.0048 12.0048 12.4240 12.4240 12.5486 12.5486 12.5583 12.5583 12.6011 12.6011 12.6994 12.6994 12.7379 12.7379 12.7747 12.7747 12.7814 12.7814 12.8356 12.8356 12.8574 12.8574 13.1209 13.1209 13.2536 13.2536 13.4720 13.4720 13.5580 13.5580 13.5728 13.5728 13.6643 13.6643 13.7905 13.7905 13.7957 13.7957 13.8690 13.8690 14.0009 14.0009 14.0099 14.0099 14.0264 14.0264 14.0808 14.0808 14.2420 14.2420 14.2577 14.2577 14.2676 14.2676 14.3713 14.3713 14.3954 14.3954 14.5580 14.5580 k = 0.0000 0.4821-0.0000 ( 6423 PWs) bands (ev): 2.1861 2.1861 3.1505 3.1505 5.0146 5.0146 5.0625 5.0625 6.2368 6.2368 7.2857 7.2857 7.2862 7.2862 8.1827 8.1827 8.2834 8.2834 8.2958 8.2958 8.5086 8.5086 9.3112 9.3112 9.6079 9.6079 9.6163 9.6163 9.8164 9.8164 10.0964 10.0964 10.1078 10.1078 10.4398 10.4398 10.4581 10.4581 10.5448 10.5448 10.6336 10.6336 10.6746 10.6746 10.7654 10.7654 10.9417 10.9417 11.1562 11.1562 11.1650 11.1650 11.4138 11.4138 11.4141 11.4141 11.5680 11.5680 11.6014 11.6014 11.6117 11.6117 11.7244 11.7244 11.9116 11.9116 11.9355 11.9355 11.9780 11.9780 12.0003 12.0003 12.4262 12.4262 12.5474 12.5474 12.5789 12.5789 12.6216 12.6216 12.6812 12.6812 12.7295 12.7295 12.7591 12.7591 12.7752 12.7752 12.8309 12.8309 12.8507 12.8507 13.1197 13.1197 13.2522 13.2522 13.4989 13.4989 13.5523 13.5523 13.5617 13.5617 13.6651 13.6651 13.7891 13.7891 13.7942 13.7942 13.8688 13.8688 14.0015 14.0015 14.0097 14.0097 14.0269 14.0269 14.0821 14.0821 14.2432 14.2432 14.2604 14.2604 14.2703 14.2703 14.3706 14.3706 14.3949 14.3949 14.5606 14.5606 k = 0.0000 0.5000-0.0000 ( 6432 PWs) bands (ev): 2.1910 2.1910 3.1434 3.1434 5.0155 5.0155 5.0629 5.0629 6.2363 6.2363 7.2892 7.2892 7.2897 7.2897 8.1886 8.1886 8.2784 8.2784 8.2908 8.2908 8.5023 8.5023 9.3099 9.3099 9.6089 9.6089 9.6173 9.6173 9.8200 9.8200 10.0946 10.0946 10.1059 10.1059 10.4411 10.4411 10.4578 10.4578 10.5496 10.5496 10.6322 10.6322 10.6858 10.6858 10.7598 10.7598 10.9310 10.9310 11.1564 11.1564 11.1653 11.1653 11.4144 11.4144 11.4148 11.4148 11.5687 11.5687 11.6016 11.6016 11.6119 11.6119 11.7233 11.7233 11.9140 11.9140 11.9407 11.9407 11.9735 11.9735 11.9987 11.9987 12.4270 12.4270 12.5471 12.5471 12.5883 12.5883 12.6309 12.6309 12.6723 12.6723 12.7224 12.7224 12.7557 12.7557 12.7734 12.7734 12.8293 12.8293 12.8484 12.8484 13.1193 13.1193 13.2518 13.2518 13.5177 13.5177 13.5354 13.5354 13.5630 13.5630 13.6655 13.6655 13.7886 13.7886 13.7938 13.7938 13.8687 13.8687 14.0017 14.0017 14.0095 14.0095 14.0270 14.0270 14.0825 14.0825 14.2437 14.2437 14.2613 14.2613 14.2712 14.2712 14.3703 14.3703 14.3947 14.3947 14.5615 14.5615 k = 0.0000 0.5000-0.0000 ( 6432 PWs) bands (ev): 2.1910 2.1910 3.1434 3.1434 5.0155 5.0155 5.0629 5.0629 6.2363 6.2363 7.2892 7.2892 7.2897 7.2897 8.1886 8.1886 8.2784 8.2784 8.2908 8.2908 8.5023 8.5023 9.3099 9.3099 9.6089 9.6089 9.6173 9.6173 9.8200 9.8200 10.0946 10.0946 10.1059 10.1059 10.4411 10.4411 10.4578 10.4578 10.5496 10.5496 10.6322 10.6322 10.6858 10.6858 10.7598 10.7598 10.9310 10.9310 11.1564 11.1564 11.1653 11.1653 11.4144 11.4144 11.4148 11.4148 11.5687 11.5687 11.6016 11.6016 11.6119 11.6119 11.7233 11.7233 11.9140 11.9140 11.9407 11.9407 11.9735 11.9735 11.9987 11.9987 12.4270 12.4270 12.5471 12.5471 12.5883 12.5883 12.6309 12.6309 12.6723 12.6723 12.7224 12.7224 12.7557 12.7557 12.7734 12.7734 12.8293 12.8293 12.8484 12.8484 13.1193 13.1193 13.2518 13.2518 13.5177 13.5177 13.5354 13.5354 13.5630 13.5630 13.6655 13.6655 13.7886 13.7886 13.7938 13.7938 13.8687 13.8687 14.0017 14.0017 14.0095 14.0095 14.0270 14.0270 14.0825 14.0825 14.2437 14.2437 14.2613 14.2613 14.2712 14.2712 14.3703 14.3703 14.3947 14.3947 14.5615 14.5615 k = 0.0179 0.5000-0.0000 ( 6416 PWs) bands (ev): 2.1922 2.1922 3.1447 3.1447 5.0142 5.0142 5.0604 5.0604 6.2294 6.2294 7.2904 7.2904 7.2997 7.2997 8.1888 8.1888 8.2761 8.2761 8.2897 8.2897 8.5024 8.5024 9.3149 9.3149 9.6075 9.6075 9.6159 9.6159 9.8191 9.8191 10.0923 10.0923 10.1036 10.1036 10.4429 10.4429 10.4567 10.4567 10.5520 10.5520 10.6300 10.6300 10.6879 10.6879 10.7597 10.7597 10.9317 10.9317 11.1571 11.1571 11.1660 11.1660 11.4134 11.4134 11.4155 11.4155 11.5696 11.5696 11.6012 11.6012 11.6117 11.6117 11.7226 11.7226 11.9146 11.9146 11.9412 11.9412 11.9742 11.9742 11.9991 11.9991 12.4269 12.4269 12.5447 12.5447 12.5875 12.5875 12.6301 12.6301 12.6717 12.6717 12.7217 12.7217 12.7544 12.7544 12.7723 12.7723 12.8278 12.8278 12.8499 12.8499 13.1194 13.1194 13.2510 13.2510 13.5179 13.5179 13.5363 13.5363 13.5635 13.5635 13.6657 13.6657 13.7905 13.7905 13.7957 13.7957 13.8689 13.8689 14.0013 14.0013 14.0094 14.0094 14.0268 14.0268 14.0828 14.0828 14.2403 14.2403 14.2642 14.2642 14.2739 14.2739 14.3709 14.3709 14.3952 14.3952 14.5628 14.5628 k = 0.0357 0.5000-0.0000 ( 6408 PWs) bands (ev): 2.1958 2.1958 3.1484 3.1484 5.0103 5.0103 5.0529 5.0529 6.2096 6.2096 7.2931 7.2931 7.3294 7.3294 8.1891 8.1891 8.2649 8.2649 8.2910 8.2910 8.5023 8.5023 9.3293 9.3293 9.6030 9.6030 9.6115 9.6115 9.8165 9.8165 10.0855 10.0855 10.0969 10.0969 10.4480 10.4480 10.4534 10.4534 10.5590 10.5590 10.6235 10.6235 10.6937 10.6937 10.7594 10.7594 10.9333 10.9333 11.1587 11.1587 11.1680 11.1680 11.4100 11.4100 11.4182 11.4182 11.5719 11.5719 11.5991 11.5991 11.6118 11.6118 11.7204 11.7204 11.9164 11.9164 11.9425 11.9425 11.9762 11.9762 12.0005 12.0005 12.4265 12.4265 12.5377 12.5377 12.5849 12.5849 12.6278 12.6278 12.6699 12.6699 12.7196 12.7196 12.7487 12.7487 12.7720 12.7720 12.8232 12.8232 12.8532 12.8532 13.1197 13.1197 13.2489 13.2489 13.5183 13.5183 13.5388 13.5388 13.5650 13.5650 13.6664 13.6664 13.7958 13.7958 13.8015 13.8015 13.8696 13.8696 13.9998 13.9998 14.0087 14.0087 14.0260 14.0260 14.0837 14.0837 14.2335 14.2335 14.2701 14.2701 14.2813 14.2813 14.3710 14.3710 14.3984 14.3984 14.5669 14.5669 k = 0.0536 0.5000-0.0000 ( 6414 PWs) bands (ev): 2.2018 2.2018 3.1545 3.1545 5.0038 5.0038 5.0402 5.0402 6.1798 6.1798 7.2977 7.2977 7.3758 7.3758 8.1893 8.1893 8.2443 8.2443 8.2962 8.2962 8.5024 8.5024 9.3521 9.3521 9.5957 9.5957 9.6044 9.6044 9.8117 9.8117 10.0747 10.0747 10.0865 10.0865 10.4482 10.4482 10.4561 10.4561 10.5700 10.5700 10.6129 10.6129 10.7030 10.7030 10.7591 10.7591 10.9359 10.9359 11.1611 11.1611 11.1716 11.1716 11.4046 11.4046 11.4226 11.4226 11.5753 11.5753 11.5942 11.5942 11.6135 11.6135 11.7169 11.7169 11.9194 11.9194 11.9446 11.9446 11.9794 11.9794 12.0027 12.0027 12.4258 12.4258 12.5263 12.5263 12.5802 12.5802 12.6245 12.6245 12.6664 12.6664 12.7156 12.7156 12.7381 12.7381 12.7755 12.7755 12.8158 12.8158 12.8567 12.8567 13.1200 13.1200 13.2452 13.2452 13.5189 13.5189 13.5426 13.5426 13.5675 13.5675 13.6675 13.6675 13.8040 13.8040 13.8106 13.8106 13.8715 13.8715 13.9973 13.9973 14.0072 14.0072 14.0246 14.0246 14.0851 14.0851 14.2261 14.2261 14.2783 14.2783 14.2913 14.2913 14.3682 14.3682 14.4069 14.4069 14.5732 14.5732 k = 0.0714 0.5000-0.0000 ( 6410 PWs) bands (ev): 2.2101 2.2101 3.1631 3.1631 4.9946 4.9946 5.0221 5.0221 6.1434 6.1434 7.3040 7.3040 7.4352 7.4352 8.1896 8.1896 8.2170 8.2170 8.3043 8.3043 8.5029 8.5029 9.3814 9.3814 9.5859 9.5859 9.5948 9.5948 9.8044 9.8044 10.0601 10.0601 10.0737 10.0737 10.4412 10.4412 10.4667 10.4667 10.5842 10.5842 10.5985 10.5985 10.7156 10.7156 10.7587 10.7587 10.9397 10.9397 11.1638 11.1638 11.1768 11.1768 11.3977 11.3977 11.4285 11.4285 11.5786 11.5786 11.5873 11.5873 11.6169 11.6169 11.7121 11.7121 11.9236 11.9236 11.9474 11.9474 11.9840 11.9840 12.0058 12.0058 12.4245 12.4245 12.5107 12.5107 12.5729 12.5729 12.6207 12.6207 12.6607 12.6607 12.7091 12.7091 12.7261 12.7261 12.7829 12.7829 12.8061 12.8061 12.8589 12.8589 13.1201 13.1201 13.2398 13.2398 13.5198 13.5198 13.5475 13.5475 13.5712 13.5712 13.6690 13.6690 13.8142 13.8142 13.8219 13.8219 13.8762 13.8762 13.9941 13.9941 14.0052 14.0052 14.0227 14.0227 14.0872 14.0872 14.2190 14.2190 14.2894 14.2894 14.3029 14.3029 14.3622 14.3622 14.4218 14.4218 14.5816 14.5816 k = 0.0893 0.5000-0.0000 ( 6414 PWs) bands (ev): 2.2208 2.2208 3.1741 3.1741 4.9828 4.9828 4.9983 4.9983 6.1039 6.1039 7.3121 7.3121 7.5040 7.5040 8.1841 8.1841 8.1907 8.1907 8.3149 8.3149 8.5041 8.5041 9.4153 9.4153 9.5739 9.5739 9.5829 9.5829 9.7944 9.7944 10.0416 10.0416 10.0605 10.0605 10.4330 10.4330 10.4790 10.4790 10.5811 10.5811 10.6007 10.6007 10.7309 10.7309 10.7584 10.7584 10.9444 10.9444 11.1668 11.1668 11.1833 11.1833 11.3895 11.3895 11.4358 11.4358 11.5739 11.5739 11.5863 11.5863 11.6216 11.6216 11.7062 11.7062 11.9292 11.9292 11.9510 11.9510 11.9899 11.9899 12.0098 12.0098 12.4226 12.4226 12.4915 12.4915 12.5625 12.5625 12.6167 12.6167 12.6524 12.6524 12.6983 12.6983 12.7166 12.7166 12.7932 12.7932 12.7948 12.7948 12.8592 12.8592 13.1196 13.1196 13.2327 13.2327 13.5208 13.5208 13.5528 13.5528 13.5761 13.5761 13.6709 13.6709 13.8241 13.8241 13.8346 13.8346 13.8860 13.8860 13.9903 13.9903 14.0025 14.0025 14.0204 14.0204 14.0899 14.0899 14.2121 14.2121 14.3034 14.3034 14.3156 14.3156 14.3542 14.3542 14.4420 14.4420 14.5914 14.5914 k = 0.1071 0.5000-0.0000 ( 6414 PWs) bands (ev): 2.2338 2.2338 3.1875 3.1875 4.9678 4.9678 4.9689 4.9689 6.0642 6.0642 7.3218 7.3218 7.5789 7.5789 8.1495 8.1495 8.1904 8.1904 8.3280 8.3280 8.5067 8.5067 9.4518 9.4518 9.5604 9.5604 9.5690 9.5690 9.7812 9.7812 10.0193 10.0193 10.0487 10.0487 10.4240 10.4240 10.4914 10.4914 10.5617 10.5617 10.6188 10.6188 10.7486 10.7486 10.7583 10.7583 10.9502 10.9502 11.1701 11.1701 11.1909 11.1909 11.3805 11.3805 11.4442 11.4442 11.5619 11.5619 11.5904 11.5904 11.6273 11.6273 11.6995 11.6995 11.9360 11.9360 11.9551 11.9551 11.9971 11.9971 12.0146 12.0146 12.4196 12.4196 12.4692 12.4692 12.5491 12.5491 12.6123 12.6123 12.6413 12.6413 12.6839 12.6839 12.7106 12.7106 12.7819 12.7819 12.8067 12.8067 12.8572 12.8572 13.1183 13.1183 13.2237 13.2237 13.5220 13.5220 13.5580 13.5580 13.5824 13.5824 13.6732 13.6732 13.8301 13.8301 13.8498 13.8498 13.9022 13.9022 13.9863 13.9863 13.9998 13.9998 14.0179 14.0179 14.0934 14.0934 14.2058 14.2058 14.3202 14.3202 14.3296 14.3296 14.3452 14.3452 14.4673 14.4673 14.6025 14.6025 k = 0.1250 0.5000-0.0000 ( 6400 PWs) bands (ev): 2.2491 2.2491 3.2033 3.2033 4.9324 4.9324 4.9512 4.9512 6.0265 6.0265 7.3332 7.3332 7.6567 7.6567 8.1129 8.1129 8.1904 8.1904 8.3434 8.3434 8.5117 8.5117 9.4888 9.4888 9.5457 9.5457 9.5535 9.5535 9.7647 9.7647 9.9937 9.9937 10.0393 10.0393 10.4149 10.4149 10.5002 10.5002 10.5439 10.5439 10.6378 10.6378 10.7584 10.7584 10.7685 10.7685 10.9570 10.9570 11.1737 11.1737 11.1993 11.1993 11.3709 11.3709 11.4536 11.4536 11.5478 11.5478 11.5944 11.5944 11.6340 11.6340 11.6922 11.6922 11.9440 11.9440 11.9598 11.9598 12.0056 12.0056 12.0202 12.0202 12.4150 12.4150 12.4448 12.4448 12.5330 12.5330 12.6061 12.6061 12.6287 12.6287 12.6687 12.6687 12.7064 12.7064 12.7691 12.7691 12.8223 12.8223 12.8530 12.8530 13.1157 13.1157 13.2126 13.2126 13.5232 13.5232 13.5629 13.5629 13.5902 13.5902 13.6761 13.6761 13.8326 13.8326 13.8675 13.8675 13.9238 13.9238 13.9820 13.9820 13.9969 13.9969 14.0152 14.0152 14.0978 14.0978 14.2001 14.2001 14.3303 14.3303 14.3434 14.3434 14.3470 14.3470 14.4976 14.4976 14.6147 14.6147 k = 0.1429 0.5000-0.0000 ( 6392 PWs) bands (ev): 2.2666 2.2666 3.2214 3.2214 4.8904 4.8904 4.9313 4.9313 5.9922 5.9922 7.3462 7.3462 7.7343 7.7343 8.0760 8.0760 8.1900 8.1900 8.3611 8.3611 8.5204 8.5204 9.5242 9.5242 9.5294 9.5294 9.5378 9.5378 9.7454 9.7454 9.9652 9.9652 10.0325 10.0325 10.4065 10.4065 10.4935 10.4935 10.5393 10.5393 10.6572 10.6572 10.7591 10.7591 10.7898 10.7898 10.9647 10.9647 11.1774 11.1774 11.2082 11.2082 11.3611 11.3611 11.4635 11.4635 11.5321 11.5321 11.5974 11.5974 11.6415 11.6415 11.6845 11.6845 11.9532 11.9532 11.9649 11.9649 12.0151 12.0151 12.0264 12.0264 12.4051 12.4051 12.4221 12.4221 12.5145 12.5145 12.5957 12.5957 12.6171 12.6171 12.6540 12.6540 12.7029 12.7029 12.7569 12.7569 12.8381 12.8381 12.8483 12.8483 13.1116 13.1116 13.1996 13.1996 13.5244 13.5244 13.5671 13.5671 13.5991 13.5991 13.6796 13.6796 13.8330 13.8330 13.8867 13.8867 13.9484 13.9484 13.9779 13.9779 13.9941 13.9941 14.0123 14.0123 14.1030 14.1030 14.1950 14.1950 14.3212 14.3212 14.3587 14.3587 14.3708 14.3708 14.5325 14.5325 14.6276 14.6276 k = 0.1607 0.5000-0.0000 ( 6372 PWs) bands (ev): 2.2863 2.2863 3.2418 3.2418 4.8425 4.8425 4.9086 4.9086 5.9625 5.9625 7.3606 7.3606 7.8085 7.8085 8.0399 8.0399 8.1892 8.1892 8.3811 8.3811 8.5347 8.5347 9.5096 9.5096 9.5235 9.5235 9.5573 9.5573 9.7241 9.7241 9.9344 9.9344 10.0285 10.0285 10.3995 10.3995 10.4711 10.4711 10.5477 10.5477 10.6766 10.6766 10.7603 10.7603 10.8126 10.8126 10.9734 10.9734 11.1814 11.1814 11.2175 11.2175 11.3511 11.3511 11.4737 11.4737 11.5153 11.5153 11.5993 11.5993 11.6496 11.6496 11.6768 11.6768 11.9634 11.9634 11.9704 11.9704 12.0255 12.0255 12.0333 12.0333 12.3817 12.3817 12.4101 12.4101 12.4941 12.4941 12.5793 12.5793 12.6079 12.6079 12.6402 12.6402 12.6998 12.6998 12.7462 12.7462 12.8354 12.8354 12.8621 12.8621 13.1057 13.1057 13.1841 13.1841 13.5254 13.5254 13.5708 13.5708 13.6087 13.6087 13.6839 13.6839 13.8326 13.8326 13.9069 13.9069 13.9710 13.9710 13.9766 13.9766 13.9929 13.9929 14.0093 14.0093 14.1091 14.1091 14.1906 14.1906 14.3100 14.3100 14.3755 14.3755 14.4003 14.4003 14.5719 14.5719 14.6415 14.6415 k = 0.1786 0.5000-0.0000 ( 6372 PWs) bands (ev): 2.3081 2.3081 3.2645 3.2645 4.7893 4.7893 4.8832 4.8832 5.9376 5.9376 7.3764 7.3764 7.8760 7.8760 8.0054 8.0054 8.1877 8.1877 8.4033 8.4033 8.5569 8.5569 9.4876 9.4876 9.5109 9.5109 9.5843 9.5843 9.7024 9.7024 9.9012 9.9012 10.0267 10.0267 10.3950 10.3950 10.4433 10.4433 10.5582 10.5582 10.6955 10.6955 10.7621 10.7621 10.8363 10.8363 10.9829 10.9829 11.1854 11.1854 11.2272 11.2272 11.3412 11.3412 11.4836 11.4836 11.4979 11.4979 11.5994 11.5994 11.6578 11.6578 11.6698 11.6698 11.9743 11.9743 11.9765 11.9765 12.0367 12.0367 12.0407 12.0407 12.3521 12.3521 12.4018 12.4018 12.4721 12.4721 12.5588 12.5588 12.5994 12.5994 12.6277 12.6277 12.6965 12.6965 12.7377 12.7377 12.8249 12.8249 12.8833 12.8833 13.0977 13.0977 13.1664 13.1664 13.5262 13.5262 13.5740 13.5740 13.6188 13.6188 13.6890 13.6890 13.8319 13.8319 13.9274 13.9274 13.9691 13.9691 13.9846 13.9846 14.0055 14.0055 14.0084 14.0084 14.1159 14.1159 14.1870 14.1870 14.2983 14.2983 14.3933 14.3933 14.4344 14.4344 14.6149 14.6149 14.6568 14.6568 k = 0.1964 0.5000-0.0000 ( 6368 PWs) bands (ev): 2.3319 2.3319 3.2893 3.2893 4.7315 4.7315 4.8552 4.8552 5.9176 5.9176 7.3935 7.3935 7.9333 7.9333 7.9732 7.9732 8.1854 8.1854 8.4276 8.4276 8.5897 8.5897 9.4637 9.4637 9.5002 9.5002 9.6021 9.6021 9.6842 9.6842 9.8661 9.8661 10.0265 10.0265 10.3937 10.3937 10.4134 10.4134 10.5674 10.5674 10.7136 10.7136 10.7645 10.7645 10.8610 10.8610 10.9932 10.9932 11.1893 11.1893 11.2375 11.2375 11.3314 11.3314 11.4791 11.4791 11.4943 11.4943 11.5977 11.5977 11.6612 11.6612 11.6689 11.6689 11.9829 11.9829 11.9858 11.9858 12.0471 12.0471 12.0498 12.0498 12.3210 12.3210 12.3932 12.3932 12.4488 12.4488 12.5360 12.5360 12.5902 12.5902 12.6168 12.6168 12.6931 12.6931 12.7320 12.7320 12.8125 12.8125 12.9064 12.9064 13.0878 13.0878 13.1463 13.1463 13.5267 13.5267 13.5770 13.5770 13.6289 13.6289 13.6948 13.6948 13.8312 13.8312 13.9477 13.9477 13.9653 13.9653 13.9829 13.9829 14.0035 14.0035 14.0347 14.0347 14.1235 14.1235 14.1843 14.1843 14.2865 14.2865 14.4122 14.4122 14.4729 14.4729 14.6556 14.6556 14.6792 14.6792 k = 0.2143 0.5000-0.0000 ( 6368 PWs) bands (ev): 2.3577 2.3577 3.3163 3.3163 4.6697 4.6697 4.8245 4.8245 5.9023 5.9023 7.4116 7.4116 7.9438 7.9438 7.9782 7.9782 8.1820 8.1820 8.4541 8.4541 8.6348 8.6348 9.4382 9.4382 9.4914 9.4914 9.6042 9.6042 9.6761 9.6761 9.8292 9.8292 10.0271 10.0271 10.3822 10.3822 10.3964 10.3964 10.5739 10.5739 10.7309 10.7309 10.7679 10.7679 10.8863 10.8863 11.0042 11.0042 11.1930 11.1930 11.2484 11.2484 11.3219 11.3219 11.4611 11.4611 11.5029 11.5029 11.5939 11.5939 11.6568 11.6568 11.6775 11.6775 11.9902 11.9902 11.9971 11.9971 12.0551 12.0551 12.0618 12.0618 12.2898 12.2898 12.3839 12.3839 12.4247 12.4247 12.5116 12.5116 12.5794 12.5794 12.6078 12.6078 12.6893 12.6893 12.7289 12.7289 12.7989 12.7989 12.9309 12.9309 13.0760 13.0760 13.1240 13.1240 13.5270 13.5270 13.5796 13.5796 13.6390 13.6390 13.7014 13.7014 13.8308 13.8308 13.9613 13.9613 13.9672 13.9672 13.9804 13.9804 14.0012 14.0012 14.0625 14.0625 14.1317 14.1317 14.1827 14.1827 14.2749 14.2749 14.4323 14.4323 14.5156 14.5156 14.6784 14.6784 14.7238 14.7238 k = 0.2321 0.5000-0.0000 ( 6372 PWs) bands (ev): 2.3853 2.3853 3.3454 3.3454 4.6049 4.6049 4.7912 4.7912 5.8912 5.8912 7.4307 7.4307 7.9176 7.9176 8.0097 8.0097 8.1775 8.1775 8.4826 8.4826 8.6928 8.6928 9.4114 9.4114 9.4848 9.4848 9.5906 9.5906 9.6783 9.6783 9.7906 9.7906 10.0278 10.0278 10.3502 10.3502 10.4035 10.4035 10.5769 10.5769 10.7469 10.7469 10.7720 10.7720 10.9123 10.9123 11.0160 11.0160 11.1963 11.1963 11.2600 11.2600 11.3127 11.3127 11.4432 11.4432 11.5103 11.5103 11.5879 11.5879 11.6537 11.6537 11.6871 11.6871 11.9980 11.9980 12.0076 12.0076 12.0627 12.0627 12.0746 12.0746 12.2595 12.2595 12.3739 12.3739 12.3999 12.3999 12.4862 12.4862 12.5671 12.5671 12.6011 12.6011 12.6849 12.6849 12.7281 12.7281 12.7846 12.7846 12.9565 12.9565 13.0623 13.0623 13.0997 13.0997 13.5271 13.5271 13.5818 13.5818 13.6487 13.6487 13.7086 13.7086 13.8308 13.8308 13.9570 13.9570 13.9781 13.9781 13.9851 13.9851 13.9999 13.9999 14.0899 14.0899 14.1404 14.1404 14.1824 14.1824 14.2637 14.2637 14.4535 14.4535 14.5620 14.5620 14.6947 14.6947 14.7776 14.7776 k = 0.2500 0.5000-0.0000 ( 6380 PWs) bands (ev): 2.4146 2.4146 3.3765 3.3765 4.5379 4.5379 4.7556 4.7556 5.8838 5.8838 7.4506 7.4506 7.8950 7.8950 8.0287 8.0287 8.1716 8.1716 8.5131 8.5131 8.7624 8.7624 9.3837 9.3837 9.4805 9.4805 9.5702 9.5702 9.6828 9.6828 9.7506 9.7506 10.0282 10.0282 10.3179 10.3179 10.4150 10.4150 10.5759 10.5759 10.7616 10.7616 10.7765 10.7765 10.9385 10.9385 11.0283 11.0283 11.1993 11.1993 11.2725 11.2725 11.3039 11.3039 11.4256 11.4256 11.5159 11.5159 11.5797 11.5797 11.6530 11.6530 11.6966 11.6966 12.0063 12.0063 12.0159 12.0159 12.0701 12.0701 12.0875 12.0875 12.2315 12.2315 12.3633 12.3633 12.3748 12.3748 12.4598 12.4598 12.5537 12.5537 12.5966 12.5966 12.6799 12.6799 12.7289 12.7289 12.7701 12.7701 12.9829 12.9829 13.0469 13.0469 13.0735 13.0735 13.5270 13.5270 13.5836 13.5836 13.6581 13.6581 13.7166 13.7166 13.8311 13.8311 13.9520 13.9520 13.9765 13.9765 13.9943 13.9943 14.0062 14.0062 14.1159 14.1159 14.1498 14.1498 14.1836 14.1836 14.2531 14.2531 14.4760 14.4760 14.6119 14.6119 14.7102 14.7102 14.8319 14.8319 k = 0.2679 0.5000-0.0000 ( 6364 PWs) bands (ev): 2.4455 2.4455 3.4094 3.4094 4.4697 4.4697 4.7176 4.7176 5.8796 5.8796 7.4711 7.4711 7.8761 7.8761 8.0373 8.0373 8.1642 8.1642 8.5455 8.5455 8.8413 8.8413 9.3554 9.3554 9.4785 9.4785 9.5485 9.5485 9.6849 9.6849 9.7093 9.7093 10.0282 10.0282 10.2855 10.2855 10.4307 10.4307 10.5708 10.5708 10.7748 10.7748 10.7812 10.7812 10.9652 10.9652 11.0413 11.0413 11.2017 11.2017 11.2861 11.2861 11.2957 11.2957 11.4088 11.4088 11.5194 11.5194 11.5693 11.5693 11.6554 11.6554 11.7063 11.7063 12.0148 12.0148 12.0209 12.0209 12.0774 12.0774 12.1004 12.1004 12.2079 12.2079 12.3498 12.3498 12.3528 12.3528 12.4331 12.4331 12.5401 12.5401 12.5935 12.5935 12.6744 12.6744 12.7307 12.7307 12.7564 12.7564 13.0097 13.0097 13.0303 13.0303 13.0464 13.0464 13.5269 13.5269 13.5850 13.5850 13.6671 13.6671 13.7250 13.7250 13.8319 13.8319 13.9464 13.9464 13.9757 13.9757 13.9941 13.9941 14.0206 14.0206 14.1383 14.1383 14.1610 14.1610 14.1872 14.1872 14.2442 14.2442 14.4998 14.4998 14.6639 14.6639 14.7258 14.7258 14.8724 14.8724 k = 0.2857 0.5000-0.0000 ( 6362 PWs) bands (ev): 2.4776 2.4776 3.4441 3.4441 4.4010 4.4010 4.6777 4.6777 5.8780 5.8780 7.4919 7.4919 7.8610 7.8610 8.0379 8.0379 8.1550 8.1550 8.5797 8.5797 8.9268 8.9268 9.3267 9.3267 9.4789 9.4789 9.5278 9.5278 9.6664 9.6664 9.6835 9.6835 10.0277 10.0277 10.2534 10.2534 10.4498 10.4498 10.5612 10.5612 10.7858 10.7858 10.7864 10.7864 10.9919 10.9919 11.0546 11.0546 11.2034 11.2034 11.2879 11.2879 11.3010 11.3010 11.3928 11.3928 11.5206 11.5206 11.5570 11.5570 11.6609 11.6609 11.7157 11.7157 12.0165 12.0165 12.0267 12.0267 12.0844 12.0844 12.1124 12.1124 12.1910 12.1910 12.3254 12.3254 12.3426 12.3426 12.4060 12.4060 12.5267 12.5267 12.5910 12.5910 12.6688 12.6688 12.7319 12.7319 12.7450 12.7450 13.0083 13.0083 13.0193 13.0193 13.0394 13.0394 13.5267 13.5267 13.5857 13.5857 13.6758 13.6758 13.7337 13.7337 13.8329 13.8329 13.9399 13.9399 13.9757 13.9757 13.9930 13.9930 14.0343 14.0343 14.1519 14.1519 14.1751 14.1751 14.1960 14.1960 14.2377 14.2377 14.5249 14.5249 14.7163 14.7163 14.7423 14.7423 14.8768 14.8768 k = 0.3036 0.5000-0.0000 ( 6364 PWs) bands (ev): 2.5108 2.5108 3.4804 3.4804 4.3325 4.3325 4.6359 4.6359 5.8785 5.8785 7.5128 7.5128 7.8497 7.8497 8.0329 8.0329 8.1443 8.1443 8.6157 8.6157 9.0164 9.0164 9.2981 9.2981 9.4818 9.4818 9.5089 9.5089 9.6227 9.6227 9.6779 9.6779 10.0271 10.0271 10.2217 10.2217 10.4713 10.4713 10.5470 10.5470 10.7900 10.7900 10.7961 10.7961 11.0189 11.0189 11.0683 11.0683 11.2045 11.2045 11.2807 11.2807 11.3170 11.3170 11.3778 11.3778 11.5198 11.5198 11.5429 11.5429 11.6690 11.6690 11.7249 11.7249 12.0070 12.0070 12.0363 12.0363 12.0911 12.0911 12.1230 12.1230 12.1827 12.1827 12.3016 12.3016 12.3336 12.3336 12.3791 12.3791 12.5138 12.5138 12.5879 12.5879 12.6639 12.6639 12.7270 12.7270 12.7415 12.7415 12.9812 12.9812 12.9974 12.9974 13.0673 13.0673 13.5267 13.5267 13.5855 13.5855 13.6843 13.6843 13.7426 13.7426 13.8341 13.8341 13.9328 13.9328 13.9766 13.9766 13.9918 13.9918 14.0462 14.0462 14.1571 14.1571 14.1855 14.1855 14.2130 14.2130 14.2364 14.2364 14.5510 14.5510 14.7523 14.7523 14.7741 14.7741 14.8583 14.8583 k = 0.3214 0.5000-0.0000 ( 6372 PWs) bands (ev): 2.5447 2.5447 3.5182 3.5182 4.2652 4.2652 4.5925 4.5925 5.8807 5.8807 7.5336 7.5336 7.8423 7.8423 8.0239 8.0239 8.1317 8.1317 8.6533 8.6533 9.1080 9.1080 9.2699 9.2699 9.4873 9.4873 9.4928 9.4928 9.5780 9.5780 9.6689 9.6689 10.0265 10.0265 10.1908 10.1908 10.4944 10.4944 10.5281 10.5281 10.7937 10.7937 10.8040 10.8040 11.0458 11.0458 11.0822 11.0822 11.2047 11.2047 11.2740 11.2740 11.3342 11.3342 11.3640 11.3640 11.5167 11.5167 11.5283 11.5283 11.6794 11.6794 11.7336 11.7336 11.9899 11.9899 12.0464 12.0464 12.0972 12.0972 12.1315 12.1315 12.1825 12.1825 12.2789 12.2789 12.3265 12.3265 12.3527 12.3527 12.5017 12.5017 12.5827 12.5827 12.6608 12.6608 12.7182 12.7182 12.7437 12.7437 12.9504 12.9504 12.9775 12.9775 13.0958 13.0958 13.5267 13.5267 13.5843 13.5843 13.6925 13.6925 13.7514 13.7514 13.8355 13.8355 13.9251 13.9251 13.9782 13.9782 13.9906 13.9906 14.0563 14.0563 14.1568 14.1568 14.1928 14.1928 14.2249 14.2249 14.2506 14.2506 14.5783 14.5783 14.7688 14.7688 14.8210 14.8210 14.8337 14.8337 k = 0.3393 0.5000-0.0000 ( 6372 PWs) bands (ev): 2.5790 2.5790 3.5572 3.5572 4.1997 4.1997 4.5479 4.5479 5.8840 5.8840 7.5539 7.5539 7.8386 7.8386 8.0126 8.0126 8.1173 8.1173 8.6925 8.6925 9.1993 9.1993 9.2426 9.2426 9.4793 9.4793 9.4958 9.4958 9.5326 9.5326 9.6569 9.6569 10.0261 10.0261 10.1610 10.1610 10.5043 10.5043 10.5184 10.5184 10.7966 10.7966 10.8099 10.8099 11.0727 11.0727 11.0962 11.0962 11.2042 11.2042 11.2680 11.2680 11.3509 11.3509 11.3529 11.3529 11.5061 11.5061 11.5191 11.5191 11.6914 11.6914 11.7416 11.7416 11.9678 11.9678 12.0563 12.0563 12.1028 12.1028 12.1384 12.1384 12.1870 12.1870 12.2577 12.2577 12.3185 12.3185 12.3314 12.3314 12.4905 12.4905 12.5746 12.5746 12.6604 12.6604 12.7104 12.7104 12.7467 12.7467 12.9184 12.9184 12.9576 12.9576 13.1244 13.1244 13.5269 13.5269 13.5818 13.5818 13.7005 13.7005 13.7603 13.7603 13.8370 13.8370 13.9169 13.9169 13.9804 13.9804 13.9894 13.9894 14.0647 14.0647 14.1526 14.1526 14.1997 14.1997 14.2298 14.2298 14.2776 14.2776 14.6066 14.6066 14.7833 14.7833 14.8084 14.8084 14.8594 14.8594 k = 0.3571 0.5000-0.0000 ( 6364 PWs) bands (ev): 2.6132 2.6132 3.5972 3.5972 4.1369 4.1369 4.5026 4.5026 5.8881 5.8881 7.5734 7.5734 7.8385 7.8385 7.9999 7.9999 8.1013 8.1013 8.7331 8.7331 9.2162 9.2162 9.2880 9.2880 9.4684 9.4684 9.4859 9.4859 9.5100 9.5100 9.6425 9.6425 10.0260 10.0260 10.1325 10.1325 10.4755 10.4755 10.5424 10.5424 10.7989 10.7989 10.8141 10.8141 11.0994 11.0994 11.1102 11.1102 11.2031 11.2031 11.2626 11.2626 11.3396 11.3396 11.3718 11.3718 11.4886 11.4886 11.5154 11.5154 11.7044 11.7044 11.7490 11.7490 11.9428 11.9428 12.0656 12.0656 12.1080 12.1080 12.1441 12.1441 12.1923 12.1923 12.2384 12.2384 12.2968 12.2968 12.3295 12.3295 12.4803 12.4803 12.5638 12.5638 12.6625 12.6625 12.7045 12.7045 12.7492 12.7492 12.8867 12.8867 12.9377 12.9377 13.1526 13.1526 13.5273 13.5273 13.5782 13.5782 13.7084 13.7084 13.7690 13.7690 13.8385 13.8385 13.9085 13.9085 13.9832 13.9832 13.9884 13.9884 14.0716 14.0716 14.1457 14.1457 14.2065 14.2065 14.2351 14.2351 14.3080 14.3080 14.6358 14.6358 14.7820 14.7820 14.7988 14.7988 14.8800 14.8800 k = 0.3750 0.5000-0.0000 ( 6360 PWs) bands (ev): 2.6467 2.6467 3.6378 3.6378 4.0775 4.0775 4.4569 4.4569 5.8927 5.8927 7.5918 7.5918 7.8418 7.8418 7.9868 7.9868 8.0837 8.0837 8.7751 8.7751 9.1917 9.1917 9.3681 9.3681 9.4369 9.4369 9.4640 9.4640 9.5307 9.5307 9.6262 9.6262 10.0261 10.0261 10.1059 10.1059 10.4417 10.4417 10.5657 10.5657 10.8006 10.8006 10.8163 10.8163 11.1240 11.1240 11.1259 11.1259 11.2014 11.2014 11.2578 11.2578 11.3290 11.3290 11.3917 11.3917 11.4692 11.4692 11.5127 11.5127 11.7180 11.7180 11.7556 11.7556 11.9169 11.9169 12.0740 12.0740 12.1129 12.1129 12.1490 12.1490 12.1958 12.1958 12.2215 12.2215 12.2723 12.2723 12.3373 12.3373 12.4711 12.4711 12.5513 12.5513 12.6655 12.6655 12.7015 12.7015 12.7505 12.7505 12.8560 12.8560 12.9178 12.9178 13.1803 13.1803 13.5278 13.5278 13.5732 13.5732 13.7161 13.7161 13.7776 13.7776 13.8401 13.8401 13.8999 13.8999 13.9856 13.9856 13.9883 13.9883 14.0773 14.0773 14.1376 14.1376 14.2130 14.2130 14.2408 14.2408 14.3404 14.3404 14.6658 14.6658 14.7592 14.7592 14.8115 14.8115 14.8792 14.8792 k = 0.3929 0.5000-0.0000 ( 6364 PWs) bands (ev): 2.6788 2.6788 3.6784 3.6784 4.0226 4.0226 4.4115 4.4115 5.8973 5.8973 7.6087 7.6087 7.8483 7.8483 7.9742 7.9742 8.0648 8.0648 8.8184 8.8184 9.1694 9.1694 9.3894 9.3894 9.4304 9.4304 9.4601 9.4601 9.5687 9.5687 9.6088 9.6088 10.0264 10.0264 10.0815 10.0815 10.4028 10.4028 10.5879 10.5879 10.8017 10.8017 10.8169 10.8169 11.1374 11.1374 11.1520 11.1520 11.1995 11.1995 11.2537 11.2537 11.3192 11.3192 11.4116 11.4116 11.4488 11.4488 11.5104 11.5104 11.7314 11.7314 11.7613 11.7613 11.8911 11.8911 12.0810 12.0810 12.1174 12.1174 12.1529 12.1529 12.1959 12.1959 12.2084 12.2084 12.2486 12.2486 12.3506 12.3506 12.4629 12.4629 12.5380 12.5380 12.6671 12.6671 12.7028 12.7028 12.7492 12.7492 12.8283 12.8283 12.8980 12.8980 13.2068 13.2068 13.5284 13.5284 13.5670 13.5670 13.7233 13.7233 13.7860 13.7860 13.8415 13.8415 13.8911 13.8911 13.9853 13.9853 13.9912 13.9912 14.0819 14.0819 14.1291 14.1291 14.2191 14.2191 14.2466 14.2466 14.3743 14.3743 14.6963 14.6963 14.7381 14.7381 14.8232 14.8232 14.8613 14.8613 k = 0.4107 0.5000-0.0000 ( 6368 PWs) bands (ev): 2.7087 2.7087 3.7184 3.7184 3.9732 3.9732 4.3673 4.3673 5.9017 5.9017 7.6238 7.6238 7.8577 7.8577 7.9625 7.9625 8.0447 8.0447 8.8628 8.8628 9.1495 9.1495 9.3413 9.3413 9.4596 9.4596 9.4677 9.4677 9.5903 9.5903 9.6293 9.6293 10.0268 10.0268 10.0599 10.0599 10.3591 10.3591 10.6085 10.6085 10.8024 10.8024 10.8161 10.8161 11.1499 11.1499 11.1774 11.1774 11.1976 11.1976 11.2502 11.2502 11.3103 11.3103 11.4268 11.4268 11.4320 11.4320 11.5085 11.5085 11.7441 11.7441 11.7663 11.7663 11.8666 11.8666 12.0870 12.0870 12.1213 12.1213 12.1558 12.1558 12.1898 12.1898 12.2029 12.2029 12.2270 12.2270 12.3679 12.3679 12.4559 12.4559 12.5251 12.5251 12.6661 12.6661 12.7081 12.7081 12.7433 12.7433 12.8069 12.8069 12.8785 12.8785 13.2317 13.2317 13.5291 13.5291 13.5598 13.5598 13.7299 13.7299 13.7942 13.7942 13.8427 13.8427 13.8823 13.8823 13.9843 13.9843 13.9950 13.9950 14.0855 14.0855 14.1207 14.1207 14.2246 14.2246 14.2519 14.2519 14.4095 14.4095 14.7177 14.7177 14.7291 14.7291 14.8255 14.8255 14.8411 14.8411 k = 0.4286 0.5000-0.0000 ( 6364 PWs) bands (ev): 2.7353 2.7353 3.7567 3.7567 3.9303 3.9303 4.3254 4.3254 5.9057 5.9057 7.6367 7.6367 7.8698 7.8698 7.9523 7.9523 8.0239 8.0239 8.9083 8.9083 9.1326 9.1326 9.2927 9.2927 9.4625 9.4625 9.4881 9.4881 9.5721 9.5721 9.7018 9.7018 10.0273 10.0273 10.0418 10.0418 10.3110 10.3110 10.6269 10.6269 10.8026 10.8026 10.8141 10.8141 11.1615 11.1615 11.1944 11.1944 11.2039 11.2039 11.2475 11.2475 11.3023 11.3023 11.4060 11.4060 11.4497 11.4497 11.5070 11.5070 11.7554 11.7554 11.7708 11.7708 11.8440 11.8440 12.0922 12.0922 12.1245 12.1245 12.1572 12.1572 12.1820 12.1820 12.1983 12.1983 12.2113 12.2113 12.3870 12.3870 12.4501 12.4501 12.5135 12.5135 12.6632 12.6632 12.7120 12.7120 12.7352 12.7352 12.7945 12.7945 12.8594 12.8594 13.2544 13.2544 13.5297 13.5297 13.5522 13.5522 13.7358 13.7358 13.8022 13.8022 13.8438 13.8438 13.8736 13.8736 13.9834 13.9834 13.9991 13.9991 14.0882 14.0882 14.1129 14.1129 14.2292 14.2292 14.2566 14.2566 14.4457 14.4457 14.7029 14.7029 14.7590 14.7590 14.7954 14.7954 14.8469 14.8469 k = 0.4464 0.5000-0.0000 ( 6354 PWs) bands (ev): 2.7577 2.7577 3.7915 3.7915 3.8953 3.8953 4.2876 4.2876 5.9090 5.9090 7.6472 7.6472 7.8842 7.8842 7.9440 7.9440 8.0026 8.0026 8.9546 8.9546 9.1190 9.1190 9.2439 9.2439 9.4681 9.4681 9.5009 9.5009 9.5542 9.5542 9.7756 9.7756 10.0266 10.0266 10.0294 10.0294 10.2594 10.2594 10.6424 10.6424 10.8024 10.8024 10.8118 10.8118 11.1714 11.1714 11.1937 11.1937 11.2272 11.2272 11.2457 11.2457 11.2955 11.2955 11.3843 11.3843 11.4659 11.4659 11.5059 11.5059 11.7644 11.7644 11.7752 11.7752 11.8243 11.8243 12.0968 12.0968 12.1270 12.1270 12.1564 12.1564 12.1766 12.1766 12.1845 12.1845 12.2086 12.2086 12.4055 12.4055 12.4463 12.4463 12.5040 12.5040 12.6590 12.6590 12.7019 12.7019 12.7394 12.7394 12.7892 12.7892 12.8408 12.8408 13.2738 13.2738 13.5302 13.5302 13.5448 13.5448 13.7407 13.7407 13.8101 13.8101 13.8446 13.8446 13.8652 13.8652 13.9827 13.9827 14.0029 14.0029 14.0899 14.0899 14.1065 14.1065 14.2330 14.2330 14.2604 14.2604 14.4823 14.4823 14.6902 14.6902 14.7567 14.7567 14.7925 14.7925 14.8545 14.8545 k = 0.4643 0.5000-0.0000 ( 6358 PWs) bands (ev): 2.7748 2.7748 3.8205 3.8205 3.8692 3.8692 4.2565 4.2565 5.9115 5.9115 7.6549 7.6549 7.9006 7.9006 7.9378 7.9378 7.9813 7.9813 9.0016 9.0016 9.1090 9.1090 9.1951 9.1951 9.4760 9.4760 9.5092 9.5092 9.5374 9.5374 9.8430 9.8430 10.0202 10.0202 10.0289 10.0289 10.2065 10.2065 10.6544 10.6544 10.8017 10.8017 10.8097 10.8097 11.1787 11.1787 11.1932 11.1932 11.2421 11.2421 11.2515 11.2515 11.2905 11.2905 11.3629 11.3629 11.4789 11.4789 11.5052 11.5052 11.7700 11.7700 11.7802 11.7802 11.8084 11.8084 12.1008 12.1008 12.1292 12.1292 12.1540 12.1540 12.1688 12.1688 12.1756 12.1756 12.2098 12.2098 12.4197 12.4197 12.4456 12.4456 12.4972 12.4972 12.6530 12.6530 12.6878 12.6878 12.7515 12.7515 12.7871 12.7871 12.8231 12.8231 13.2890 13.2890 13.5302 13.5302 13.5387 13.5387 13.7443 13.7443 13.8177 13.8177 13.8449 13.8449 13.8573 13.8573 13.9821 13.9821 14.0061 14.0061 14.0905 14.0905 14.1019 14.1019 14.2357 14.2357 14.2632 14.2632 14.5179 14.5179 14.6805 14.6805 14.7212 14.7212 14.8227 14.8227 14.8604 14.8604 k = 0.4821 0.5000-0.0000 ( 6354 PWs) bands (ev): 2.7854 2.7854 3.8401 3.8401 3.8532 3.8532 4.2354 4.2354 5.9131 5.9131 7.6595 7.6595 7.9184 7.9184 7.9341 7.9341 7.9605 7.9605 9.0493 9.0493 9.1029 9.1029 9.1463 9.1463 9.4851 9.4851 9.5140 9.5140 9.5229 9.5229 9.8938 9.8938 10.0212 10.0212 10.0302 10.0302 10.1584 10.1584 10.6622 10.6622 10.8009 10.8009 10.8085 10.8085 11.1827 11.1827 11.1937 11.1937 11.2423 11.2423 11.2676 11.2676 11.2897 11.2897 11.3438 11.3438 11.4874 11.4874 11.5048 11.5048 11.7730 11.7730 11.7850 11.7850 11.7969 11.7969 12.1038 12.1038 12.1318 12.1318 12.1508 12.1508 12.1591 12.1591 12.1744 12.1744 12.2111 12.2111 12.4260 12.4260 12.4491 12.4491 12.4935 12.4935 12.6463 12.6463 12.6792 12.6792 12.7651 12.7651 12.7859 12.7859 12.8073 12.8073 13.2988 13.2988 13.5294 13.5294 13.5353 13.5353 13.7465 13.7465 13.8245 13.8245 13.8441 13.8441 13.8513 13.8513 13.9818 13.9818 14.0083 14.0083 14.0900 14.0900 14.0997 14.0997 14.2373 14.2373 14.2649 14.2649 14.5486 14.5486 14.6729 14.6729 14.6916 14.6916 14.8503 14.8503 14.8643 14.8643 k = 0.5000 0.5000-0.0000 ( 6304 PWs) bands (ev): 2.7891 2.7891 3.8457 3.8457 3.8493 3.8493 4.2278 4.2278 5.9136 5.9136 7.6611 7.6611 7.9327 7.9327 7.9330 7.9330 7.9452 7.9452 9.0944 9.0944 9.1008 9.1008 9.1010 9.1010 9.4907 9.4907 9.5155 9.5155 9.5158 9.5158 9.9131 9.9131 10.0246 10.0246 10.0331 10.0331 10.1349 10.1349 10.6651 10.6651 10.8006 10.8006 10.8083 10.8083 11.1838 11.1838 11.1942 11.1942 11.2421 11.2421 11.2729 11.2729 11.2930 11.2930 11.3341 11.3341 11.4904 11.4904 11.5047 11.5047 11.7742 11.7742 11.7896 11.7896 11.7900 11.7900 12.1050 12.1050 12.1336 12.1336 12.1483 12.1483 12.1562 12.1562 12.1743 12.1743 12.2116 12.2116 12.4274 12.4274 12.4516 12.4516 12.4926 12.4926 12.6433 12.6433 12.6768 12.6768 12.7745 12.7745 12.7842 12.7842 12.7993 12.7993 13.3022 13.3022 13.5288 13.5288 13.5345 13.5345 13.7474 13.7474 13.8281 13.8281 13.8427 13.8427 13.8496 13.8496 13.9817 13.9817 14.0092 14.0092 14.0898 14.0898 14.0992 14.0992 14.2381 14.2381 14.2657 14.2657 14.5629 14.5629 14.6669 14.6669 14.6813 14.6813 14.8630 14.8630 14.8676 14.8676 k = 0.5000 0.5000-0.0000 ( 6304 PWs) bands (ev): 2.7891 2.7891 3.8457 3.8457 3.8493 3.8493 4.2278 4.2278 5.9136 5.9136 7.6611 7.6611 7.9327 7.9327 7.9330 7.9330 7.9452 7.9452 9.0944 9.0944 9.1008 9.1008 9.1010 9.1010 9.4907 9.4907 9.5155 9.5155 9.5158 9.5158 9.9131 9.9131 10.0246 10.0246 10.0331 10.0331 10.1349 10.1349 10.6651 10.6651 10.8006 10.8006 10.8083 10.8083 11.1838 11.1838 11.1942 11.1942 11.2421 11.2421 11.2729 11.2729 11.2930 11.2930 11.3341 11.3341 11.4904 11.4904 11.5047 11.5047 11.7742 11.7742 11.7896 11.7896 11.7900 11.7900 12.1050 12.1050 12.1336 12.1336 12.1483 12.1483 12.1562 12.1562 12.1743 12.1743 12.2116 12.2116 12.4274 12.4274 12.4516 12.4516 12.4926 12.4926 12.6433 12.6433 12.6768 12.6768 12.7745 12.7745 12.7842 12.7842 12.7993 12.7993 13.3022 13.3022 13.5288 13.5288 13.5345 13.5345 13.7474 13.7474 13.8281 13.8281 13.8427 13.8427 13.8496 13.8496 13.9817 13.9817 14.0092 14.0092 14.0898 14.0898 14.0992 14.0992 14.2381 14.2381 14.2657 14.2657 14.5629 14.5629 14.6669 14.6669 14.6813 14.6813 14.8630 14.8630 14.8676 14.8676 k = 0.4875 0.4875-0.0000 ( 6352 PWs) bands (ev): 2.7855 2.7855 3.8440 3.8440 3.8493 3.8493 4.2353 4.2353 5.9131 5.9131 7.6596 7.6596 7.9198 7.9198 7.9321 7.9321 7.9611 7.9611 9.0504 9.0504 9.1017 9.1017 9.1464 9.1464 9.4851 9.4851 9.5146 9.5146 9.5222 9.5222 9.8962 9.8962 10.0050 10.0050 10.0455 10.0455 10.1569 10.1569 10.6623 10.6623 10.8008 10.8008 10.8086 10.8086 11.1828 11.1828 11.1936 11.1936 11.2423 11.2423 11.2679 11.2679 11.2895 11.2895 11.3437 11.3437 11.4873 11.4873 11.5049 11.5049 11.7723 11.7723 11.7869 11.7869 11.7956 11.7956 12.1039 12.1039 12.1319 12.1319 12.1501 12.1501 12.1594 12.1594 12.1746 12.1746 12.2111 12.2111 12.4263 12.4263 12.4489 12.4489 12.4934 12.4934 12.6465 12.6465 12.6790 12.6790 12.7650 12.7650 12.7863 12.7863 12.8068 12.8068 13.2988 13.2988 13.5292 13.5292 13.5354 13.5354 13.7465 13.7465 13.8245 13.8245 13.8443 13.8443 13.8511 13.8511 13.9818 13.9818 14.0084 14.0084 14.0901 14.0901 14.0997 14.0997 14.2374 14.2374 14.2650 14.2650 14.5492 14.5492 14.6703 14.6703 14.6936 14.6936 14.8500 14.8500 14.8651 14.8651 k = 0.4750 0.4750-0.0000 ( 6352 PWs) bands (ev): 2.7748 2.7748 3.8371 3.8371 3.8522 3.8522 4.2566 4.2566 5.9116 5.9116 7.6549 7.6549 7.9050 7.9050 7.9300 7.9300 7.9846 7.9846 9.0056 9.0056 9.1041 9.1041 9.1959 9.1959 9.4753 9.4753 9.5115 9.5115 9.5352 9.5352 9.8604 9.8604 9.9595 9.9595 10.0805 10.0805 10.1990 10.1990 10.6547 10.6547 10.8009 10.8009 10.8107 10.8107 11.1800 11.1800 11.1918 11.1918 11.2428 11.2428 11.2528 11.2528 11.2887 11.2887 11.3628 11.3628 11.4783 11.4783 11.5060 11.5060 11.7645 11.7645 11.7919 11.7919 11.8019 11.8019 12.1014 12.1014 12.1298 12.1298 12.1504 12.1504 12.1670 12.1670 12.1794 12.1794 12.2102 12.2102 12.4235 12.4235 12.4416 12.4416 12.4966 12.4966 12.6559 12.6559 12.6854 12.6854 12.7509 12.7509 12.7897 12.7897 12.8211 12.8211 13.2893 13.2893 13.5286 13.5286 13.5402 13.5402 13.7443 13.7443 13.8172 13.8172 13.8466 13.8466 13.8560 13.8560 13.9821 13.9821 14.0062 14.0062 14.0908 14.0908 14.1016 14.1016 14.2357 14.2357 14.2634 14.2634 14.5211 14.5211 14.6675 14.6675 14.7309 14.7309 14.8217 14.8217 14.8637 14.8637 k = 0.4625 0.4625-0.0000 ( 6356 PWs) bands (ev): 2.7573 2.7573 3.8275 3.8275 3.8577 3.8577 4.2891 4.2891 5.9092 5.9092 7.6471 7.6471 7.8929 7.8929 7.9264 7.9264 8.0112 8.0112 8.9635 8.9635 9.1080 9.1080 9.2457 9.2457 9.4656 9.4656 9.5053 9.5053 9.5497 9.5497 9.8195 9.8195 9.9097 9.9097 10.1211 10.1211 10.2434 10.2434 10.6429 10.6429 10.7994 10.7994 10.8150 10.8150 11.1757 11.1757 11.1889 11.1889 11.2333 11.2333 11.2439 11.2439 11.2918 11.2918 11.3842 11.3842 11.4640 11.4640 11.5084 11.5084 11.7533 11.7533 11.7993 11.7993 11.8108 11.8108 12.0986 12.0986 12.1277 12.1277 12.1492 12.1492 12.1681 12.1681 12.1958 12.1958 12.2106 12.2106 12.4194 12.4194 12.4306 12.4306 12.5023 12.5023 12.6697 12.6697 12.6930 12.6930 12.7391 12.7391 12.7947 12.7947 12.8362 12.8362 13.2745 13.2745 13.5261 13.5261 13.5486 13.5486 13.7407 13.7407 13.8087 13.8087 13.8488 13.8488 13.8623 13.8623 13.9827 13.9827 14.0030 14.0030 14.0910 14.0910 14.1054 14.1054 14.2326 14.2326 14.2610 14.2610 14.4904 14.4904 14.6605 14.6605 14.7767 14.7767 14.7926 14.7926 14.8615 14.8615 k = 0.4500 0.4500-0.0000 ( 6366 PWs) bands (ev): 2.7334 2.7334 3.8178 3.8178 3.8655 3.8655 4.3301 4.3301 5.9061 5.9061 7.6361 7.6361 7.8835 7.8835 7.9214 7.9214 8.0407 8.0407 8.9248 8.9248 9.1135 9.1135 9.2951 9.2951 9.4569 9.4569 9.4942 9.4942 9.5634 9.5634 9.7789 9.7789 9.8617 9.8617 10.1628 10.1628 10.2865 10.2865 10.6276 10.6276 10.7965 10.7965 10.8210 10.8210 11.1702 11.1702 11.1851 11.1851 11.2131 11.2131 11.2450 11.2450 11.2969 11.2969 11.4058 11.4058 11.4458 11.4458 11.5120 11.5120 11.7401 11.7401 11.8036 11.8036 11.8251 11.8251 12.0951 12.0951 12.1249 12.1249 12.1474 12.1474 12.1671 12.1671 12.2099 12.2099 12.2216 12.2216 12.4143 12.4143 12.4177 12.4177 12.5097 12.5097 12.6842 12.6842 12.6965 12.6965 12.7374 12.7374 12.8019 12.8019 12.8513 12.8513 13.2556 13.2556 13.5222 13.5222 13.5592 13.5592 13.7358 13.7358 13.7993 13.7993 13.8513 13.8513 13.8688 13.8688 13.9835 13.9835 13.9990 13.9990 14.0904 14.0904 14.1109 14.1109 14.2280 14.2280 14.2580 14.2580 14.4605 14.4605 14.6505 14.6505 14.7574 14.7574 14.8330 14.8330 14.8593 14.8593 k = 0.4375 0.4375-0.0000 ( 6366 PWs) bands (ev): 2.7036 2.7036 3.8100 3.8100 3.8756 3.8756 4.3768 4.3768 5.9024 5.9024 7.6218 7.6218 7.8771 7.8771 7.9148 7.9148 8.0729 8.0729 8.8899 8.8899 9.1206 9.1206 9.3433 9.3433 9.4495 9.4495 9.4757 9.4757 9.5734 9.5734 9.7430 9.7430 9.8195 9.8195 10.2043 10.2043 10.3265 10.3265 10.6093 10.6093 10.7923 10.7923 10.8282 10.8282 11.1644 11.1644 11.1804 11.1804 11.1929 11.1929 11.2464 11.2464 11.3035 11.3035 11.4248 11.4248 11.4268 11.4268 11.5166 11.5166 11.7256 11.7256 11.8059 11.8059 11.8426 11.8426 12.0894 12.0894 12.1220 12.1220 12.1456 12.1456 12.1666 12.1666 12.2146 12.2146 12.2481 12.2481 12.4020 12.4020 12.4118 12.4118 12.5183 12.5183 12.6804 12.6804 12.7098 12.7098 12.7492 12.7492 12.8115 12.8115 12.8659 12.8659 13.2337 13.2337 13.5171 13.5171 13.5711 13.5711 13.7298 13.7298 13.7892 13.7892 13.8542 13.8542 13.8753 13.8753 13.9845 13.9845 13.9947 13.9947 14.0893 14.0893 14.1176 14.1176 14.2217 14.2217 14.2549 14.2549 14.4324 14.4324 14.6377 14.6377 14.7260 14.7260 14.8527 14.8527 14.8933 14.8933 k = 0.4250 0.4250-0.0000 ( 6364 PWs) bands (ev): 2.6686 2.6686 3.8051 3.8051 3.8879 3.8879 4.4273 4.4273 5.8986 5.8986 7.6043 7.6043 7.8736 7.8736 7.9064 7.9064 8.1076 8.1076 8.8593 8.8593 9.1293 9.1293 9.3897 9.3897 9.4433 9.4433 9.4477 9.4477 9.5739 9.5739 9.7182 9.7182 9.7863 9.7863 10.2449 10.2449 10.3625 10.3625 10.5888 10.5888 10.7869 10.7869 10.8364 10.8364 11.1589 11.1589 11.1720 11.1720 11.1760 11.1760 11.2480 11.2480 11.3114 11.3114 11.4022 11.4022 11.4465 11.4465 11.5223 11.5223 11.7101 11.7101 11.8070 11.8070 11.8613 11.8613 12.0798 12.0798 12.1196 12.1196 12.1439 12.1439 12.1677 12.1677 12.2198 12.2198 12.2783 12.2783 12.3868 12.3868 12.4112 12.4112 12.5269 12.5269 12.6665 12.6665 12.7302 12.7302 12.7680 12.7680 12.8236 12.8236 12.8800 12.8800 13.2098 13.2098 13.5108 13.5108 13.5836 13.5836 13.7228 13.7228 13.7784 13.7784 13.8575 13.8575 13.8816 13.8816 13.9858 13.9858 13.9903 13.9903 14.0877 14.0877 14.1249 14.1249 14.2136 14.2136 14.2517 14.2517 14.4062 14.4062 14.6224 14.6224 14.6950 14.6950 14.8481 14.8481 14.9530 14.9530 k = 0.4125 0.4125-0.0000 ( 6362 PWs) bands (ev): 2.6290 2.6290 3.8039 3.8039 3.9023 3.9023 4.4798 4.4798 5.8949 5.8949 7.5836 7.5836 7.8728 7.8728 7.8963 7.8963 8.1448 8.1448 8.8333 8.8333 9.1394 9.1394 9.4068 9.4068 9.4315 9.4315 9.4418 9.4418 9.5589 9.5589 9.7111 9.7111 9.7641 9.7641 10.2842 10.2842 10.3939 10.3939 10.5663 10.5663 10.7800 10.7800 10.8456 10.8456 11.1512 11.1512 11.1557 11.1557 11.1697 11.1697 11.2497 11.2497 11.3204 11.3204 11.3787 11.3787 11.4649 11.4649 11.5288 11.5288 11.6941 11.6941 11.8070 11.8070 11.8802 11.8802 12.0666 12.0666 12.1171 12.1171 12.1428 12.1428 12.1711 12.1711 12.2248 12.2248 12.3114 12.3114 12.3717 12.3717 12.4150 12.4150 12.5348 12.5348 12.6511 12.6511 12.7518 12.7518 12.7900 12.7900 12.8381 12.8381 12.8937 12.8937 13.1844 13.1844 13.5033 13.5033 13.5963 13.5963 13.7150 13.7150 13.7670 13.7670 13.8611 13.8611 13.8877 13.8877 13.9859 13.9859 13.9874 13.9874 14.0857 14.0857 14.1327 14.1327 14.2040 14.2040 14.2486 14.2486 14.3818 14.3818 14.6047 14.6047 14.6645 14.6645 14.8419 14.8419 15.0124 15.0124 k = 0.4000 0.4000-0.0000 ( 6354 PWs) bands (ev): 2.5856 2.5856 3.8065 3.8065 3.9190 3.9190 4.5330 4.5330 5.8916 5.8916 7.5598 7.5598 7.8749 7.8749 7.8842 7.8842 8.1842 8.1842 8.8121 8.8121 9.1512 9.1512 9.3565 9.3565 9.4336 9.4336 9.4766 9.4766 9.5309 9.5309 9.7201 9.7201 9.7526 9.7526 10.3220 10.3220 10.4201 10.4201 10.5424 10.5424 10.7717 10.7717 10.8560 10.8560 11.1315 11.1315 11.1529 11.1529 11.1634 11.1634 11.2514 11.2514 11.3302 11.3302 11.3549 11.3549 11.4815 11.4815 11.5362 11.5362 11.6778 11.6778 11.8062 11.8062 11.8983 11.8983 12.0509 12.0509 12.1137 12.1137 12.1425 12.1425 12.1772 12.1772 12.2283 12.2283 12.3443 12.3443 12.3596 12.3596 12.4246 12.4246 12.5411 12.5411 12.6360 12.6360 12.7742 12.7742 12.8137 12.8137 12.8551 12.8551 12.9071 12.9071 13.1581 13.1581 13.4946 13.4946 13.6089 13.6089 13.7064 13.7064 13.7547 13.7547 13.8649 13.8649 13.8935 13.8935 13.9819 13.9819 13.9890 13.9890 14.0833 14.0833 14.1406 14.1406 14.1930 14.1930 14.2454 14.2454 14.3588 14.3588 14.5850 14.5850 14.6348 14.6348 14.8346 14.8346 15.0250 15.0250 k = 0.3875 0.3875-0.0000 ( 6366 PWs) bands (ev): 2.5392 2.5392 3.8132 3.8132 3.9378 3.9378 4.5857 4.5857 5.8892 5.8892 7.5330 7.5330 7.8699 7.8699 7.8796 7.8796 8.2256 8.2256 8.7958 8.7958 9.1644 9.1644 9.2974 9.2974 9.4289 9.4289 9.4979 9.4979 9.5145 9.5145 9.7383 9.7383 9.7500 9.7500 10.3580 10.3580 10.4405 10.4405 10.5179 10.5179 10.7619 10.7619 10.8676 10.8676 11.1107 11.1107 11.1532 11.1532 11.1566 11.1566 11.2530 11.2530 11.3307 11.3307 11.3417 11.3417 11.4960 11.4960 11.5443 11.5443 11.6612 11.6612 11.8044 11.8044 11.9146 11.9146 12.0337 12.0337 12.1088 12.1088 12.1435 12.1435 12.1859 12.1859 12.2299 12.2299 12.3408 12.3408 12.3869 12.3869 12.4401 12.4401 12.5454 12.5454 12.6218 12.6218 12.7972 12.7972 12.8384 12.8384 12.8740 12.8740 12.9204 12.9204 13.1314 13.1314 13.4846 13.4846 13.6211 13.6211 13.6974 13.6974 13.7416 13.7416 13.8688 13.8688 13.8990 13.8990 13.9781 13.9781 13.9909 13.9909 14.0804 14.0804 14.1483 14.1483 14.1810 14.1810 14.2420 14.2420 14.3371 14.3371 14.5635 14.5635 14.6058 14.6058 14.8260 14.8260 15.0103 15.0103 k = 0.3750 0.3750-0.0000 ( 6372 PWs) bands (ev): 2.4904 2.4904 3.8237 3.8237 3.9586 3.9586 4.6369 4.6369 5.8882 5.8882 7.5034 7.5034 7.8534 7.8534 7.8869 7.8869 8.2688 8.2688 8.7844 8.7844 9.1790 9.1790 9.2325 9.2325 9.4182 9.4182 9.4702 9.4702 9.5484 9.5484 9.7528 9.7528 9.7630 9.7630 10.3920 10.3920 10.4526 10.4526 10.4954 10.4954 10.7505 10.7505 10.8807 10.8807 11.0894 11.0894 11.1490 11.1490 11.1569 11.1569 11.2545 11.2545 11.3080 11.3080 11.3529 11.3529 11.5085 11.5085 11.5530 11.5530 11.6444 11.6444 11.8016 11.8016 11.9285 11.9285 12.0157 12.0157 12.1027 12.1027 12.1464 12.1464 12.1963 12.1963 12.2301 12.2301 12.3281 12.3281 12.4263 12.4263 12.4613 12.4613 12.5476 12.5476 12.6091 12.6091 12.8209 12.8209 12.8633 12.8633 12.8944 12.8944 12.9339 12.9339 13.1045 13.1045 13.4734 13.4734 13.6327 13.6327 13.6881 13.6881 13.7276 13.7276 13.8726 13.8726 13.9041 13.9041 13.9746 13.9746 13.9928 13.9928 14.0769 14.0769 14.1557 14.1557 14.1682 14.1682 14.2385 14.2385 14.3164 14.3164 14.5406 14.5406 14.5777 14.5777 14.8160 14.8160 14.9896 14.9896 k = 0.3625 0.3625-0.0000 ( 6382 PWs) bands (ev): 2.4399 2.4399 3.8378 3.8378 3.9816 3.9816 4.6857 4.6857 5.8888 5.8888 7.4713 7.4713 7.8343 7.8343 7.8965 7.8965 8.3137 8.3137 8.7779 8.7779 9.1637 9.1637 9.1951 9.1951 9.3938 9.3938 9.4576 9.4576 9.5784 9.5784 9.7617 9.7617 9.7894 9.7894 10.4238 10.4238 10.4468 10.4468 10.4849 10.4849 10.7375 10.7375 10.8952 10.8952 11.0676 11.0676 11.1411 11.1411 11.1639 11.1639 11.2560 11.2560 11.2861 11.2861 11.3650 11.3650 11.5188 11.5188 11.5620 11.5620 11.6275 11.6275 11.7979 11.7979 11.9388 11.9388 11.9978 11.9978 12.0955 12.0955 12.1512 12.1512 12.2064 12.2064 12.2311 12.2311 12.3165 12.3165 12.4676 12.4676 12.4874 12.4874 12.5477 12.5477 12.5984 12.5984 12.8452 12.8452 12.8878 12.8878 12.9158 12.9158 12.9484 12.9484 13.0778 13.0778 13.4608 13.4608 13.6426 13.6426 13.6797 13.6797 13.7127 13.7127 13.8762 13.8762 13.9090 13.9090 13.9714 13.9714 13.9950 13.9950 14.0728 14.0728 14.1550 14.1550 14.1626 14.1626 14.2348 14.2348 14.2966 14.2966 14.5165 14.5165 14.5505 14.5505 14.8047 14.8047 14.9491 14.9491 k = 0.3500 0.3500-0.0000 ( 6382 PWs) bands (ev): 2.3882 2.3882 3.8554 3.8554 4.0065 4.0065 4.7313 4.7313 5.8915 5.8915 7.4371 7.4371 7.8126 7.8126 7.9081 7.9081 8.3599 8.3599 8.7760 8.7760 9.0932 9.0932 9.2126 9.2126 9.3607 9.3607 9.4562 9.4562 9.6041 9.6041 9.7739 9.7739 9.8183 9.8183 10.4237 10.4237 10.4531 10.4531 10.4862 10.4862 10.7231 10.7231 10.9110 10.9110 11.0453 11.0453 11.1326 11.1326 11.1744 11.1744 11.2572 11.2572 11.2656 11.2656 11.3777 11.3777 11.5271 11.5271 11.5711 11.5711 11.6106 11.6106 11.7932 11.7932 11.9441 11.9441 11.9809 11.9809 12.0876 12.0876 12.1578 12.1578 12.2127 12.2127 12.2372 12.2372 12.3064 12.3064 12.5082 12.5082 12.5181 12.5181 12.5471 12.5471 12.5902 12.5902 12.8700 12.8700 12.9113 12.9113 12.9374 12.9374 12.9646 12.9646 13.0515 13.0515 13.4468 13.4468 13.6472 13.6472 13.6758 13.6758 13.6969 13.6969 13.8796 13.8796 13.9135 13.9135 13.9686 13.9686 13.9974 13.9974 14.0680 14.0680 14.1419 14.1419 14.1687 14.1687 14.2308 14.2308 14.2774 14.2774 14.4916 14.4916 14.5242 14.5242 14.7920 14.7920 14.8878 14.8878 k = 0.3375 0.3375-0.0000 ( 6384 PWs) bands (ev): 2.3359 2.3359 3.8762 3.8762 4.0334 4.0334 4.7731 4.7731 5.8967 5.8967 7.4011 7.4011 7.7881 7.7881 7.9213 7.9213 8.4073 8.4073 8.7784 8.7784 9.0225 9.0225 9.2314 9.2314 9.3263 9.3263 9.4597 9.4597 9.6256 9.6256 9.7886 9.7886 9.8488 9.8488 10.3961 10.3961 10.4793 10.4793 10.4876 10.4876 10.7077 10.7077 10.9279 10.9279 11.0225 11.0225 11.1234 11.1234 11.1883 11.1883 11.2464 11.2464 11.2588 11.2588 11.3906 11.3906 11.5330 11.5330 11.5795 11.5795 11.5943 11.5943 11.7875 11.7875 11.9410 11.9410 11.9690 11.9690 12.0793 12.0793 12.1646 12.1646 12.2158 12.2158 12.2495 12.2495 12.2981 12.2981 12.5335 12.5335 12.5507 12.5507 12.5623 12.5623 12.5843 12.5843 12.8949 12.8949 12.9331 12.9331 12.9587 12.9587 12.9838 12.9838 13.0258 13.0258 13.4313 13.4313 13.6420 13.6420 13.6776 13.6776 13.6831 13.6831 13.8827 13.8827 13.9175 13.9175 13.9661 13.9661 13.9998 13.9998 14.0621 14.0621 14.1291 14.1291 14.1737 14.1737 14.2266 14.2266 14.2588 14.2588 14.4663 14.4663 14.4990 14.4990 14.7777 14.7777 14.8258 14.8258 k = 0.3250 0.3250-0.0000 ( 6390 PWs) bands (ev): 2.2833 2.2833 3.8999 3.8999 4.0622 4.0622 4.8105 4.8105 5.9045 5.9045 7.3637 7.3637 7.7607 7.7607 7.9353 7.9353 8.4549 8.4549 8.7851 8.7851 8.9532 8.9532 9.2516 9.2516 9.2929 9.2929 9.4658 9.4658 9.6429 9.6429 9.8051 9.8051 9.8805 9.8805 10.3672 10.3672 10.4864 10.4864 10.5017 10.5017 10.6919 10.6919 10.9455 10.9455 10.9993 10.9993 11.1136 11.1136 11.2051 11.2051 11.2293 11.2293 11.2601 11.2601 11.4036 11.4036 11.5367 11.5367 11.5738 11.5738 11.5915 11.5915 11.7808 11.7808 11.9278 11.9278 11.9641 11.9641 12.0707 12.0707 12.1688 12.1688 12.2215 12.2215 12.2648 12.2648 12.2920 12.2920 12.5329 12.5329 12.5743 12.5743 12.5899 12.5899 12.6052 12.6052 12.9191 12.9191 12.9531 12.9531 12.9797 12.9797 13.0001 13.0001 13.0066 13.0066 13.4141 13.4141 13.6311 13.6311 13.6614 13.6614 13.6910 13.6910 13.8852 13.8852 13.9212 13.9212 13.9639 13.9639 14.0025 14.0025 14.0551 14.0551 14.1174 14.1174 14.1772 14.1772 14.2220 14.2220 14.2410 14.2410 14.4408 14.4408 14.4750 14.4750 14.7607 14.7607 14.7676 14.7676 k = 0.3125 0.3125-0.0000 ( 6382 PWs) bands (ev): 2.2310 2.2310 3.9265 3.9265 4.0929 4.0929 4.8432 4.8432 5.9151 5.9151 7.3252 7.3252 7.7303 7.7303 7.9491 7.9491 8.5021 8.5021 8.7955 8.7955 8.8879 8.8879 9.2613 9.2613 9.2734 9.2734 9.4741 9.4741 9.6563 9.6563 9.8228 9.8228 9.9132 9.9132 10.3381 10.3381 10.4826 10.4826 10.5192 10.5192 10.6770 10.6770 10.9633 10.9633 10.9760 10.9760 11.1030 11.1030 11.2139 11.2139 11.2250 11.2250 11.2616 11.2616 11.4166 11.4166 11.5383 11.5383 11.5565 11.5565 11.5994 11.5994 11.7733 11.7733 11.9100 11.9100 11.9615 11.9615 12.0619 12.0619 12.1682 12.1682 12.2330 12.2330 12.2806 12.2806 12.2892 12.2892 12.5290 12.5290 12.5734 12.5734 12.6243 12.6243 12.6510 12.6510 12.9414 12.9414 12.9690 12.9690 12.9811 12.9811 13.0012 13.0012 13.0298 13.0298 13.3953 13.3953 13.6177 13.6177 13.6424 13.6424 13.7021 13.7021 13.8872 13.8872 13.9244 13.9244 13.9620 13.9620 14.0052 14.0052 14.0468 14.0468 14.1068 14.1068 14.1785 14.1785 14.2169 14.2169 14.2244 14.2244 14.4155 14.4155 14.4524 14.4524 14.7102 14.7102 14.7451 14.7451 k = 0.3000 0.3000-0.0000 ( 6394 PWs) bands (ev): 2.1791 2.1791 3.9556 3.9556 4.1254 4.1254 4.8710 4.8710 5.9285 5.9285 7.2861 7.2861 7.6968 7.6968 7.9611 7.9611 8.5471 8.5471 8.8093 8.8093 8.8300 8.8300 9.2330 9.2330 9.2958 9.2958 9.4840 9.4840 9.6659 9.6659 9.8412 9.8412 9.9464 9.9464 10.3093 10.3093 10.4766 10.4766 10.5298 10.5298 10.6648 10.6648 10.9514 10.9514 10.9821 10.9821 11.0917 11.0917 11.2012 11.2012 11.2463 11.2463 11.2632 11.2632 11.4292 11.4292 11.5348 11.5348 11.5412 11.5412 11.6071 11.6071 11.7649 11.7649 11.8907 11.8907 11.9587 11.9587 12.0532 12.0532 12.1637 12.1637 12.2496 12.2496 12.2852 12.2852 12.3011 12.3011 12.5248 12.5248 12.5711 12.5711 12.6626 12.6626 12.6973 12.6973 12.9485 12.9485 12.9636 12.9636 12.9974 12.9974 13.0228 13.0228 13.0546 13.0546 13.3747 13.3747 13.6025 13.6025 13.6223 13.6223 13.7136 13.7136 13.8887 13.8887 13.9271 13.9271 13.9601 13.9601 14.0078 14.0078 14.0372 14.0372 14.0976 14.0976 14.1758 14.1758 14.2085 14.2085 14.2130 14.2130 14.3905 14.3905 14.4316 14.4316 14.6593 14.6593 14.7259 14.7259 k = 0.2875 0.2875-0.0000 ( 6386 PWs) bands (ev): 2.1281 2.1281 3.9871 3.9871 4.1595 4.1595 4.8940 4.8940 5.9444 5.9444 7.2466 7.2466 7.6603 7.6603 7.9692 7.9692 8.5855 8.5855 8.7861 8.7861 8.8263 8.8263 9.2074 9.2074 9.3196 9.3196 9.4954 9.4954 9.6726 9.6726 9.8595 9.8595 9.9800 9.9800 10.2814 10.2814 10.4688 10.4688 10.5316 10.5316 10.6574 10.6574 10.9272 10.9272 11.0001 11.0001 11.0797 11.0797 11.1909 11.1909 11.2638 11.2638 11.2705 11.2705 11.4413 11.4413 11.5172 11.5172 11.5375 11.5375 11.6137 11.6137 11.7559 11.7559 11.8707 11.8707 11.9559 11.9559 12.0449 12.0449 12.1569 12.1569 12.2694 12.2694 12.2869 12.2869 12.3195 12.3195 12.5209 12.5209 12.5699 12.5699 12.7020 12.7020 12.7433 12.7433 12.9277 12.9277 12.9792 12.9792 13.0215 13.0215 13.0445 13.0445 13.0795 13.0795 13.3522 13.3522 13.5857 13.5857 13.6012 13.6012 13.7254 13.7254 13.8896 13.8896 13.9294 13.9294 13.9584 13.9584 14.0106 14.0106 14.0267 14.0267 14.0895 14.0895 14.1674 14.1674 14.1982 14.1982 14.2069 14.2069 14.3662 14.3662 14.4128 14.4128 14.6132 14.6132 14.7045 14.7045 k = 0.2750 0.2750-0.0000 ( 6392 PWs) bands (ev): 2.0781 2.0781 4.0207 4.0207 4.1953 4.1953 4.9122 4.9122 5.9628 5.9628 7.2072 7.2072 7.6208 7.6208 7.9704 7.9704 8.6081 8.6081 8.7684 8.7684 8.8459 8.8459 9.1850 9.1850 9.3445 9.3445 9.5083 9.5083 9.6766 9.6766 9.8770 9.8770 10.0135 10.0135 10.2550 10.2550 10.4599 10.4599 10.5241 10.5241 10.6556 10.6556 10.9025 10.9025 11.0172 11.0172 11.0669 11.0669 11.1830 11.1830 11.2665 11.2665 11.2937 11.2937 11.4525 11.4525 11.4971 11.4971 11.5341 11.5341 11.6188 11.6188 11.7461 11.7461 11.8505 11.8505 11.9534 11.9534 12.0370 12.0370 12.1486 12.1486 12.2875 12.2875 12.2945 12.2945 12.3388 12.3388 12.5172 12.5172 12.5699 12.5699 12.7420 12.7420 12.7874 12.7874 12.9079 12.9079 12.9948 12.9948 13.0474 13.0474 13.0659 13.0659 13.1042 13.1042 13.3278 13.3278 13.5673 13.5673 13.5792 13.5792 13.7371 13.7371 13.8898 13.8898 13.9312 13.9312 13.9568 13.9568 14.0134 14.0134 14.0155 14.0155 14.0823 14.0823 14.1537 14.1537 14.1904 14.1904 14.2009 14.2009 14.3425 14.3425 14.3964 14.3964 14.5720 14.5720 14.6794 14.6794 k = 0.2625 0.2625-0.0000 ( 6404 PWs) bands (ev): 2.0293 2.0293 4.0563 4.0563 4.2325 4.2325 4.9262 4.9262 5.9831 5.9831 7.1680 7.1680 7.5784 7.5784 7.9618 7.9618 8.6105 8.6105 8.7844 8.7844 8.8679 8.8679 9.1658 9.1658 9.3704 9.3704 9.5224 9.5224 9.6785 9.6785 9.8928 9.8928 10.0465 10.0465 10.2308 10.2308 10.4502 10.4502 10.5097 10.5097 10.6575 10.6575 10.8776 10.8776 11.0331 11.0331 11.0537 11.0537 11.1779 11.1779 11.2688 11.2688 11.3175 11.3175 11.4626 11.4626 11.4761 11.4761 11.5295 11.5295 11.6222 11.6222 11.7358 11.7358 11.8299 11.8299 11.9516 11.9516 12.0299 12.0299 12.1397 12.1397 12.2958 12.2958 12.3160 12.3160 12.3586 12.3586 12.5134 12.5134 12.5712 12.5712 12.7815 12.7815 12.8240 12.8240 12.8964 12.8964 13.0103 13.0103 13.0739 13.0739 13.0872 13.0872 13.1284 13.1284 13.3015 13.3015 13.5468 13.5468 13.5562 13.5562 13.7488 13.7488 13.8894 13.8894 13.9324 13.9324 13.9551 13.9551 14.0042 14.0042 14.0162 14.0162 14.0755 14.0755 14.1376 14.1376 14.1826 14.1826 14.1945 14.1945 14.3194 14.3194 14.3826 14.3826 14.5361 14.5361 14.6450 14.6451 k = 0.2500 0.2500-0.0000 ( 6408 PWs) bands (ev): 1.9820 1.9820 4.0936 4.0936 4.2712 4.2712 4.9362 4.9362 6.0050 6.0050 7.1294 7.1294 7.5334 7.5334 7.9407 7.9407 8.6068 8.6068 8.8223 8.8223 8.8919 8.8919 9.1498 9.1498 9.3973 9.3973 9.5377 9.5377 9.6789 9.6789 9.9059 9.9059 10.0783 10.0783 10.2096 10.2096 10.4403 10.4403 10.4915 10.4915 10.6605 10.6605 10.8524 10.8524 11.0372 11.0372 11.0501 11.0501 11.1755 11.1755 11.2714 11.2714 11.3410 11.3410 11.4546 11.4546 11.4719 11.4719 11.5239 11.5239 11.6234 11.6234 11.7249 11.7249 11.8092 11.8092 11.9511 11.9511 12.0236 12.0236 12.1305 12.1305 12.3051 12.3051 12.3399 12.3399 12.3788 12.3788 12.5097 12.5097 12.5737 12.5737 12.8143 12.8143 12.8406 12.8406 12.9108 12.9108 13.0270 13.0270 13.0998 13.0998 13.1090 13.1090 13.1522 13.1522 13.2733 13.2733 13.5243 13.5243 13.5329 13.5329 13.7603 13.7603 13.8886 13.8886 13.9333 13.9333 13.9533 13.9533 13.9932 13.9932 14.0189 14.0189 14.0688 14.0688 14.1210 14.1210 14.1731 14.1731 14.1878 14.1878 14.2970 14.2970 14.3713 14.3713 14.5052 14.5052 14.6026 14.6026 k = 0.2375 0.2375-0.0000 ( 6414 PWs) bands (ev): 1.9362 1.9362 4.1325 4.1325 4.3111 4.3111 4.9429 4.9429 6.0280 6.0280 7.0915 7.0915 7.4859 7.4859 7.9061 7.9061 8.6105 8.6105 8.8696 8.8696 8.9175 8.9175 9.1371 9.1371 9.4250 9.4250 9.5541 9.5541 9.6782 9.6782 9.9150 9.9150 10.1077 10.1077 10.1926 10.1926 10.4307 10.4307 10.4726 10.4726 10.6627 10.6627 10.8269 10.8269 11.0228 11.0228 11.0620 11.0620 11.1758 11.1758 11.2745 11.2745 11.3633 11.3633 11.4331 11.4331 11.4796 11.4796 11.5176 11.5176 11.6223 11.6223 11.7136 11.7136 11.7885 11.7885 11.9521 11.9521 12.0186 12.0186 12.1212 12.1212 12.3168 12.3168 12.3643 12.3643 12.3993 12.3993 12.5060 12.5060 12.5769 12.5769 12.8118 12.8118 12.8697 12.8697 12.9472 12.9472 13.0454 13.0454 13.1225 13.1225 13.1330 13.1330 13.1749 13.1749 13.2435 13.2435 13.4999 13.4999 13.5091 13.5091 13.7715 13.7715 13.8875 13.8875 13.9337 13.9337 13.9514 13.9514 13.9826 13.9826 14.0215 14.0215 14.0616 14.0616 14.1050 14.1050 14.1616 14.1616 14.1807 14.1807 14.2751 14.2751 14.3625 14.3625 14.4789 14.4789 14.5595 14.5595 k = 0.2250 0.2250-0.0000 ( 6406 PWs) bands (ev): 1.8922 1.8922 4.1726 4.1726 4.3522 4.3522 4.9467 4.9467 6.0519 6.0519 7.0547 7.0547 7.4362 7.4362 7.8589 7.8589 8.6258 8.6258 8.9209 8.9209 8.9443 8.9443 9.1274 9.1274 9.4535 9.4535 9.5713 9.5713 9.6771 9.6771 9.9192 9.9192 10.1335 10.1335 10.1803 10.1803 10.4219 10.4219 10.4558 10.4558 10.6630 10.6630 10.8012 10.8012 11.0072 11.0072 11.0719 11.0719 11.1790 11.1790 11.2779 11.2779 11.3839 11.3839 11.4124 11.4124 11.4859 11.4859 11.5111 11.5111 11.6190 11.6190 11.7018 11.7018 11.7678 11.7678 11.9549 11.9549 12.0151 12.0151 12.1124 12.1124 12.3310 12.3310 12.3890 12.3890 12.4200 12.4200 12.5028 12.5028 12.5805 12.5805 12.7930 12.7930 12.9086 12.9086 12.9879 12.9879 13.0662 13.0662 13.1409 13.1409 13.1594 13.1594 13.1968 13.1968 13.2134 13.2134 13.4742 13.4742 13.4845 13.4845 13.7824 13.7824 13.8861 13.8861 13.9337 13.9337 13.9492 13.9492 13.9728 13.9728 14.0239 14.0239 14.0531 14.0531 14.0904 14.0904 14.1485 14.1485 14.1731 14.1731 14.2539 14.2539 14.3556 14.3556 14.4569 14.4569 14.5186 14.5186 k = 0.2125 0.2125-0.0000 ( 6402 PWs) bands (ev): 1.8501 1.8501 4.2137 4.2137 4.3942 4.3942 4.9481 4.9481 6.0762 6.0762 7.0191 7.0191 7.3847 7.3847 7.8012 7.8012 8.6521 8.6521 8.9716 8.9716 8.9746 8.9746 9.1208 9.1208 9.4826 9.4826 9.5891 9.5891 9.6761 9.6761 9.9177 9.9177 10.1536 10.1536 10.1730 10.1730 10.4146 10.4146 10.4436 10.4436 10.6609 10.6609 10.7752 10.7752 10.9908 10.9908 11.0781 11.0781 11.1847 11.1847 11.2818 11.2818 11.3930 11.3930 11.4025 11.4025 11.4907 11.4907 11.5043 11.5043 11.6134 11.6134 11.6895 11.6895 11.7472 11.7472 11.9594 11.9594 12.0133 12.0133 12.1041 12.1041 12.3471 12.3471 12.4135 12.4135 12.4405 12.4405 12.5005 12.5005 12.5836 12.5836 12.7712 12.7712 12.9480 12.9480 13.0279 13.0279 13.0902 13.0902 13.1508 13.1508 13.1859 13.1859 13.1883 13.1883 13.2185 13.2185 13.4474 13.4474 13.4589 13.4589 13.7927 13.7927 13.8847 13.8847 13.9333 13.9333 13.9467 13.9467 13.9638 13.9638 14.0258 14.0258 14.0427 14.0427 14.0783 14.0783 14.1340 14.1340 14.1651 14.1651 14.2330 14.2330 14.3502 14.3502 14.4383 14.4383 14.4810 14.4810 k = 0.2000 0.2000-0.0000 ( 6398 PWs) bands (ev): 1.8099 1.8099 4.2556 4.2556 4.4370 4.4370 4.9478 4.9478 6.1007 6.1007 6.9847 6.9847 7.3318 7.3318 7.7358 7.7358 8.6872 8.6872 8.9996 8.9996 9.0291 9.0291 9.1170 9.1170 9.5122 9.5122 9.6073 9.6073 9.6757 9.6757 9.9108 9.9108 10.1658 10.1658 10.1698 10.1698 10.4091 10.4091 10.4385 10.4385 10.6562 10.6562 10.7489 10.7489 10.9737 10.9737 11.0794 11.0794 11.1929 11.1929 11.2860 11.2860 11.3767 11.3767 11.4180 11.4180 11.4936 11.4936 11.4979 11.4979 11.6056 11.6056 11.6768 11.6768 11.7266 11.7266 11.9653 11.9653 12.0133 12.0133 12.0968 12.0968 12.3650 12.3650 12.4377 12.4377 12.4599 12.4599 12.5004 12.5004 12.5855 12.5855 12.7484 12.7484 12.9868 12.9868 13.0653 13.0653 13.1181 13.1181 13.1321 13.1321 13.1895 13.1895 13.2133 13.2133 13.2389 13.2389 13.4200 13.4200 13.4325 13.4325 13.8025 13.8025 13.8835 13.8835 13.9324 13.9324 13.9435 13.9435 13.9561 13.9561 14.0260 14.0260 14.0318 14.0318 14.0688 14.0688 14.1189 14.1189 14.1565 14.1565 14.2124 14.2124 14.3453 14.3453 14.4212 14.4212 14.4487 14.4487 k = 0.1875 0.1875-0.0000 ( 6390 PWs) bands (ev): 1.7717 1.7717 4.2979 4.2979 4.4804 4.4804 4.9461 4.9461 6.1252 6.1252 6.9519 6.9519 7.2777 7.2777 7.6648 7.6648 8.7289 8.7289 9.0272 9.0272 9.0848 9.0848 9.1159 9.1159 9.5421 9.5421 9.6257 9.6257 9.6764 9.6764 9.8995 9.8995 10.1691 10.1691 10.1695 10.1695 10.4061 10.4061 10.4423 10.4423 10.6490 10.6490 10.7225 10.7225 10.9563 10.9563 11.0747 11.0747 11.2032 11.2032 11.2908 11.2908 11.3642 11.3642 11.4299 11.4299 11.4917 11.4917 11.4962 11.4962 11.5962 11.5962 11.6637 11.6637 11.7064 11.7064 11.9727 11.9727 12.0153 12.0153 12.0906 12.0906 12.3836 12.3836 12.4610 12.4610 12.4762 12.4762 12.5053 12.5053 12.5860 12.5860 12.7250 12.7250 13.0243 13.0243 13.0971 13.0971 13.1016 13.1016 13.1495 13.1495 13.2039 13.2039 13.2398 13.2398 13.2582 13.2582 13.3922 13.3922 13.4056 13.4056 13.8114 13.8114 13.8825 13.8825 13.9311 13.9311 13.9397 13.9397 13.9497 13.9497 14.0151 14.0151 14.0301 14.0301 14.0612 14.0612 14.1038 14.1038 14.1474 14.1474 14.1923 14.1923 14.3404 14.3404 14.4001 14.4001 14.4264 14.4264 k = 0.1750 0.1750-0.0000 ( 6394 PWs) bands (ev): 1.7357 1.7357 4.3403 4.3403 4.5242 4.5242 4.9435 4.9435 6.1497 6.1497 6.9208 6.9208 7.2230 7.2230 7.5902 7.5902 8.7749 8.7749 9.0541 9.0541 9.1170 9.1170 9.1415 9.1415 9.5722 9.5722 9.6438 9.6438 9.6786 9.6786 9.8851 9.8851 10.1642 10.1642 10.1703 10.1703 10.4059 10.4059 10.4544 10.4544 10.6397 10.6397 10.6957 10.6957 10.9383 10.9383 11.0632 11.0632 11.2154 11.2154 11.2961 11.2961 11.3565 11.3565 11.4371 11.4371 11.4887 11.4887 11.4963 11.4963 11.5852 11.5852 11.6503 11.6503 11.6864 11.6864 11.9809 11.9809 12.0195 12.0195 12.0859 12.0859 12.4018 12.4018 12.4805 12.4805 12.4901 12.4901 12.5182 12.5182 12.5846 12.5846 12.7014 12.7014 13.0506 13.0506 13.0725 13.0725 13.1326 13.1326 13.1830 13.1830 13.2196 13.2196 13.2658 13.2658 13.2764 13.2764 13.3643 13.3643 13.3785 13.3785 13.8193 13.8193 13.8820 13.8820 13.9292 13.9292 13.9354 13.9354 13.9445 13.9445 14.0010 14.0010 14.0305 14.0305 14.0548 14.0548 14.0894 14.0894 14.1375 14.1375 14.1728 14.1728 14.3346 14.3346 14.3743 14.3743 14.4142 14.4142 k = 0.1625 0.1625-0.0000 ( 6406 PWs) bands (ev): 1.7020 1.7020 4.3824 4.3824 4.5680 4.5680 4.9404 4.9404 6.1741 6.1741 6.8913 6.8913 7.1681 7.1681 7.5134 7.5134 8.8235 8.8235 9.0797 9.0797 9.1205 9.1205 9.1986 9.1986 9.6023 9.6023 9.6611 9.6611 9.6829 9.6829 9.8690 9.8690 10.1533 10.1533 10.1708 10.1708 10.4086 10.4086 10.4724 10.4724 10.6287 10.6287 10.6687 10.6687 10.9201 10.9201 11.0449 11.0449 11.2291 11.2291 11.3017 11.3017 11.3538 11.3538 11.4389 11.4389 11.4882 11.4882 11.4954 11.4954 11.5731 11.5731 11.6364 11.6364 11.6668 11.6668 11.9899 11.9899 12.0257 12.0257 12.0828 12.0828 12.4177 12.4177 12.4919 12.4919 12.5098 12.5098 12.5361 12.5361 12.5812 12.5812 12.6776 12.6776 13.0201 13.0201 13.1007 13.1007 13.1641 13.1641 13.2160 13.2160 13.2355 13.2355 13.2895 13.2895 13.2949 13.2949 13.3368 13.3368 13.3524 13.3524 13.8259 13.8259 13.8822 13.8822 13.9260 13.9260 13.9313 13.9313 13.9401 13.9401 13.9872 13.9872 14.0299 14.0299 14.0489 14.0489 14.0762 14.0762 14.1265 14.1265 14.1542 14.1542 14.3270 14.3270 14.3487 14.3487 14.4062 14.4062 k = 0.1500 0.1500-0.0000 ( 6390 PWs) bands (ev): 1.6705 1.6705 4.4237 4.4237 4.6116 4.6116 4.9372 4.9372 6.1986 6.1986 6.8637 6.8637 7.1135 7.1135 7.4355 7.4355 8.8731 8.8731 9.1036 9.1036 9.1263 9.1263 9.2565 9.2565 9.6323 9.6323 9.6773 9.6773 9.6897 9.6897 9.8521 9.8521 10.1393 10.1393 10.1702 10.1702 10.4138 10.4138 10.4931 10.4931 10.6173 10.6173 10.6418 10.6418 10.9017 10.9017 11.0208 11.0208 11.2440 11.2440 11.3079 11.3079 11.3554 11.3554 11.4362 11.4362 11.4892 11.4892 11.4944 11.4944 11.5602 11.5602 11.6225 11.6225 11.6478 11.6478 11.9994 11.9994 12.0339 12.0339 12.0814 12.0814 12.4292 12.4292 12.5047 12.5047 12.5307 12.5307 12.5548 12.5548 12.5766 12.5766 12.6540 12.6540 12.9821 12.9821 13.1349 13.1349 13.1954 13.1954 13.2448 13.2448 13.2524 13.2524 13.3033 13.3033 13.3100 13.3100 13.3182 13.3182 13.3322 13.3322 13.8312 13.8312 13.8833 13.8833 13.9218 13.9218 13.9278 13.9278 13.9363 13.9363 13.9742 13.9742 14.0281 14.0281 14.0436 14.0436 14.0651 14.0651 14.1142 14.1142 14.1373 14.1373 14.3165 14.3165 14.3256 14.3256 14.3947 14.3947 k = 0.1375 0.1375-0.0000 ( 6395 PWs) bands (ev): 1.6413 1.6413 4.4639 4.4639 4.6547 4.6547 4.9342 4.9342 6.2232 6.2232 6.8380 6.8380 7.0597 7.0597 7.3574 7.3574 8.9222 8.9222 9.1243 9.1243 9.1349 9.1349 9.3151 9.3151 9.6618 9.6618 9.6916 9.6916 9.6992 9.6992 9.8352 9.8352 10.1248 10.1248 10.1681 10.1681 10.4209 10.4209 10.5121 10.5121 10.6066 10.6066 10.6160 10.6160 10.8833 10.8833 10.9920 10.9920 11.2597 11.2597 11.3143 11.3143 11.3604 11.3604 11.4309 11.4309 11.4876 11.4876 11.4954 11.4954 11.5469 11.5469 11.6083 11.6083 11.6292 11.6292 12.0091 12.0091 12.0436 12.0436 12.0821 12.0821 12.4359 12.4359 12.5221 12.5221 12.5490 12.5490 12.5653 12.5653 12.5800 12.5800 12.6306 12.6306 12.9435 12.9435 13.1681 13.1681 13.2258 13.2258 13.2602 13.2602 13.2681 13.2681 13.2862 13.2862 13.3047 13.3047 13.3305 13.3305 13.3447 13.3447 13.8350 13.8350 13.8850 13.8850 13.9169 13.9169 13.9238 13.9238 13.9331 13.9331 13.9623 13.9623 14.0242 14.0242 14.0387 14.0387 14.0565 14.0565 14.1003 14.1003 14.1222 14.1222 14.2997 14.2997 14.3080 14.3080 14.3684 14.3684 k = 0.1250 0.1250-0.0000 ( 6399 PWs) bands (ev): 1.6145 1.6145 4.5023 4.5023 4.6967 4.6967 4.9318 4.9318 6.2481 6.2481 6.8144 6.8144 7.0073 7.0073 7.2798 7.2798 8.9697 8.9697 9.1386 9.1386 9.1488 9.1488 9.3740 9.3740 9.6904 9.6904 9.7036 9.7036 9.7112 9.7112 9.8191 9.8191 10.1117 10.1117 10.1649 10.1649 10.4289 10.4289 10.5229 10.5229 10.5855 10.5855 10.6082 10.6082 10.8649 10.8649 10.9600 10.9600 11.2760 11.2760 11.3212 11.3212 11.3678 11.3678 11.4244 11.4244 11.4839 11.4839 11.4974 11.4974 11.5333 11.5333 11.5943 11.5943 11.6114 11.6114 12.0191 12.0191 12.0545 12.0545 12.0848 12.0848 12.4389 12.4389 12.5421 12.5421 12.5521 12.5521 12.5739 12.5739 12.5969 12.5969 12.6088 12.6088 12.9056 12.9056 13.1989 13.1989 13.2475 13.2475 13.2553 13.2553 13.2611 13.2611 13.2856 13.2856 13.3200 13.3200 13.3439 13.3439 13.3686 13.3686 13.8373 13.8373 13.8871 13.8871 13.9115 13.9115 13.9194 13.9194 13.9306 13.9306 13.9517 13.9517 14.0187 14.0187 14.0340 14.0340 14.0504 14.0504 14.0853 14.0853 14.1089 14.1089 14.2802 14.2802 14.2928 14.2928 14.3391 14.3391 k = 0.1125 0.1125-0.0000 ( 6403 PWs) bands (ev): 1.5902 1.5902 4.5383 4.5383 4.7375 4.7375 4.9302 4.9302 6.2736 6.2736 6.7928 6.7928 6.9568 6.9568 7.2033 7.2033 9.0147 9.0147 9.1494 9.1494 9.1650 9.1650 9.4330 9.4330 9.7118 9.7118 9.7190 9.7190 9.7258 9.7258 9.8043 9.8043 10.1017 10.1017 10.1607 10.1607 10.4365 10.4365 10.5201 10.5201 10.5588 10.5588 10.6182 10.6182 10.8469 10.8469 10.9262 10.9262 11.2923 11.2923 11.3284 11.3284 11.3767 11.3767 11.4176 11.4176 11.4793 11.4793 11.4988 11.4988 11.5199 11.5199 11.5804 11.5804 11.5944 11.5944 12.0293 12.0293 12.0660 12.0660 12.0894 12.0894 12.4400 12.4400 12.5400 12.5400 12.5661 12.5661 12.5806 12.5806 12.5959 12.5959 12.6163 12.6163 12.8687 12.8687 13.2192 13.2192 13.2276 13.2276 13.2442 13.2442 13.2855 13.2855 13.2982 13.2982 13.3429 13.3429 13.3581 13.3581 13.3922 13.3922 13.8385 13.8385 13.8892 13.8892 13.9055 13.9055 13.9155 13.9155 13.9286 13.9286 13.9426 13.9426 14.0126 14.0126 14.0287 14.0287 14.0462 14.0462 14.0703 14.0703 14.0965 14.0965 14.2619 14.2619 14.2769 14.2769 14.3107 14.3107 k = 0.1000 0.1000-0.0000 ( 6407 PWs) bands (ev): 1.5683 1.5683 4.5715 4.5715 4.7763 4.7763 4.9296 4.9296 6.2999 6.2999 6.7733 6.7733 6.9089 6.9089 7.1285 7.1285 9.0563 9.0563 9.1601 9.1601 9.1794 9.1794 9.4912 9.4912 9.7173 9.7173 9.7428 9.7428 9.7451 9.7451 9.7914 9.7914 10.0957 10.0957 10.1560 10.1560 10.4426 10.4426 10.5071 10.5071 10.5322 10.5322 10.6368 10.6368 10.8294 10.8294 10.8921 10.8921 11.3085 11.3085 11.3358 11.3358 11.3867 11.3867 11.4108 11.4108 11.4744 11.4744 11.4992 11.4992 11.5071 11.5071 11.5667 11.5667 11.5782 11.5782 12.0396 12.0396 12.0779 12.0779 12.0957 12.0957 12.4398 12.4398 12.5274 12.5274 12.5611 12.5611 12.5893 12.5893 12.6097 12.6097 12.6338 12.6338 12.8338 12.8338 13.2046 13.2046 13.2054 13.2054 13.2640 13.2640 13.3095 13.3095 13.3136 13.3136 13.3640 13.3640 13.3731 13.3731 13.4151 13.4151 13.8388 13.8388 13.8902 13.8902 13.8988 13.8988 13.9127 13.9127 13.9268 13.9268 13.9349 13.9349 14.0068 14.0068 14.0227 14.0227 14.0430 14.0430 14.0561 14.0561 14.0847 14.0847 14.2453 14.2453 14.2606 14.2606 14.2841 14.2841 k = 0.0875 0.0875-0.0000 ( 6407 PWs) bands (ev): 1.5489 1.5489 4.6012 4.6012 4.8126 4.8126 4.9303 4.9303 6.3273 6.3273 6.7560 6.7560 6.8642 6.8642 7.0559 7.0559 9.0938 9.0938 9.1710 9.1710 9.1914 9.1914 9.5472 9.5472 9.7186 9.7186 9.7616 9.7616 9.7698 9.7698 9.7814 9.7814 10.0943 10.0943 10.1513 10.1513 10.4457 10.4457 10.4890 10.4890 10.5066 10.5066 10.6583 10.6583 10.8128 10.8128 10.8591 10.8591 11.3239 11.3239 11.3434 11.3434 11.3970 11.3970 11.4044 11.4044 11.4694 11.4694 11.4942 11.4942 11.4997 11.4997 11.5534 11.5534 11.5630 11.5630 12.0497 12.0497 12.0897 12.0897 12.1035 12.1035 12.4387 12.4387 12.5137 12.5137 12.5413 12.5413 12.6108 12.6108 12.6245 12.6245 12.6502 12.6502 12.8016 12.8016 13.1832 13.1832 13.1847 13.1847 13.2895 13.2895 13.3250 13.3250 13.3342 13.3342 13.3817 13.3817 13.3893 13.3893 13.4366 13.4366 13.8385 13.8385 13.8893 13.8893 13.8921 13.8921 13.9116 13.9116 13.9245 13.9245 13.9292 13.9292 14.0018 14.0018 14.0163 14.0163 14.0388 14.0388 14.0445 14.0445 14.0733 14.0733 14.2307 14.2307 14.2447 14.2447 14.2600 14.2600 k = 0.0750 0.0750-0.0000 ( 6403 PWs) bands (ev): 1.5321 1.5321 4.6270 4.6270 4.8460 4.8460 4.9322 4.9322 6.3560 6.3560 6.7409 6.7409 6.8235 6.8235 6.9861 6.9861 9.1271 9.1271 9.1819 9.1819 9.2013 9.2013 9.5986 9.5986 9.7167 9.7167 9.7758 9.7758 9.7818 9.7818 9.7926 9.7926 10.0973 10.0973 10.1470 10.1470 10.4445 10.4445 10.4686 10.4686 10.4826 10.4826 10.6794 10.6794 10.7973 10.7973 10.8289 10.8289 11.3383 11.3383 11.3510 11.3510 11.3986 11.3986 11.4075 11.4075 11.4646 11.4646 11.4833 11.4833 11.4987 11.4987 11.5406 11.5406 11.5489 11.5489 12.0595 12.0595 12.1014 12.1014 12.1120 12.1120 12.4369 12.4369 12.5001 12.5001 12.5226 12.5226 12.6302 12.6302 12.6380 12.6380 12.6647 12.6647 12.7731 12.7731 13.1636 13.1636 13.1651 13.1651 13.3134 13.3134 13.3385 13.3385 13.3523 13.3523 13.3973 13.3973 13.4055 13.4055 13.4564 13.4564 13.8377 13.8377 13.8857 13.8857 13.8865 13.8865 13.9117 13.9117 13.9212 13.9212 13.9260 13.9260 13.9975 13.9975 14.0098 14.0098 14.0287 14.0287 14.0401 14.0401 14.0631 14.0631 14.2180 14.2180 14.2296 14.2296 14.2390 14.2390 k = 0.0625 0.0625-0.0000 ( 6409 PWs) bands (ev): 1.5178 1.5178 4.6486 4.6486 4.8757 4.8757 4.9352 4.9352 6.3861 6.3861 6.7281 6.7281 6.7874 6.7874 6.9196 6.9196 9.1554 9.1554 9.1922 9.1922 9.2092 9.2092 9.6413 9.6413 9.7122 9.7122 9.7778 9.7778 9.8020 9.8020 9.8128 9.8128 10.1039 10.1039 10.1434 10.1434 10.4379 10.4379 10.4474 10.4474 10.4613 10.4613 10.6988 10.6988 10.7832 10.7832 10.8029 10.8029 11.3511 11.3511 11.3584 11.3584 11.3934 11.3934 11.4177 11.4177 11.4604 11.4604 11.4736 11.4736 11.4974 11.4974 11.5284 11.5284 11.5359 11.5359 12.0686 12.0686 12.1125 12.1125 12.1206 12.1206 12.4341 12.4341 12.4875 12.4875 12.5057 12.5057 12.6444 12.6444 12.6519 12.6519 12.6769 12.6769 12.7496 12.7496 13.1464 13.1464 13.1476 13.1476 13.3345 13.3345 13.3510 13.3510 13.3662 13.3662 13.4123 13.4123 13.4198 13.4198 13.4739 13.4739 13.8367 13.8367 13.8800 13.8800 13.8825 13.8825 13.9110 13.9110 13.9187 13.9187 13.9245 13.9245 13.9938 13.9938 14.0035 14.0035 14.0178 14.0178 14.0377 14.0377 14.0538 14.0538 14.2073 14.2073 14.2161 14.2161 14.2214 14.2214 k = 0.0500 0.0500-0.0000 ( 6395 PWs) bands (ev): 1.5061 1.5061 4.6658 4.6658 4.9012 4.9012 4.9389 4.9389 6.4176 6.4176 6.7176 6.7176 6.7567 6.7567 6.8573 6.8573 9.1786 9.1786 9.2015 9.2015 9.2154 9.2154 9.6699 9.6699 9.7063 9.7063 9.7912 9.7912 9.8212 9.8212 9.8302 9.8302 10.1128 10.1128 10.1409 10.1409 10.4258 10.4258 10.4270 10.4270 10.4433 10.4433 10.7157 10.7157 10.7709 10.7709 10.7822 10.7822 11.3620 11.3620 11.3654 11.3654 11.3893 11.3893 11.4274 11.4274 11.4571 11.4571 11.4655 11.4655 11.4961 11.4961 11.5171 11.5171 11.5243 11.5243 12.0767 12.0767 12.1230 12.1230 12.1287 12.1287 12.4302 12.4302 12.4772 12.4772 12.4910 12.4910 12.6520 12.6520 12.6659 12.6659 12.6854 12.6854 12.7336 12.7336 13.1318 13.1318 13.1327 13.1327 13.3526 13.3526 13.3625 13.3625 13.3765 13.3765 13.4261 13.4261 13.4318 13.4318 13.4890 13.4890 13.8357 13.8357 13.8753 13.8753 13.8781 13.8781 13.9083 13.9083 13.9188 13.9188 13.9234 13.9234 13.9907 13.9907 13.9981 13.9981 14.0083 14.0083 14.0358 14.0358 14.0457 14.0457 14.1986 14.1986 14.2046 14.2046 14.2073 14.2073 k = 0.0375 0.0375-0.0000 ( 6395 PWs) bands (ev): 1.4969 1.4969 4.6788 4.6788 4.9217 4.9217 4.9428 4.9428 6.4500 6.4500 6.7093 6.7093 6.7319 6.7319 6.8003 6.8003 9.1967 9.1967 9.2091 9.2091 9.2206 9.2206 9.6837 9.6837 9.7002 9.7002 9.8144 9.8144 9.8380 9.8380 9.8442 9.8442 10.1227 10.1227 10.1396 10.1396 10.4089 10.4089 10.4106 10.4106 10.4277 10.4277 10.7292 10.7292 10.7606 10.7606 10.7673 10.7673 11.3704 11.3704 11.3716 11.3716 11.3859 11.3859 11.4363 11.4363 11.4547 11.4547 11.4593 11.4593 11.4947 11.4947 11.5070 11.5070 11.5142 11.5142 12.0836 12.0836 12.1320 12.1320 12.1356 12.1356 12.4253 12.4253 12.4697 12.4697 12.4787 12.4787 12.6542 12.6542 12.6775 12.6775 12.6895 12.6895 12.7268 12.7268 13.1201 13.1201 13.1206 13.1206 13.3670 13.3670 13.3722 13.3722 13.3839 13.3839 13.4377 13.4377 13.4412 13.4412 13.5011 13.5011 13.8346 13.8346 13.8715 13.8715 13.8737 13.8737 13.9049 13.9049 13.9198 13.9198 13.9227 13.9227 13.9876 13.9876 13.9941 13.9941 14.0004 14.0004 14.0341 14.0341 14.0397 14.0397 14.1918 14.1918 14.1952 14.1952 14.1965 14.1965 k = 0.0250 0.0250-0.0000 ( 6401 PWs) bands (ev): 1.4904 1.4904 4.6877 4.6877 4.9369 4.9369 4.9462 4.9462 6.4815 6.4815 6.7033 6.7033 6.7139 6.7139 6.7508 6.7508 9.2092 9.2092 9.2145 9.2145 9.2252 9.2252 9.6886 9.6886 9.6950 9.6950 9.8389 9.8389 9.8514 9.8514 9.8545 9.8545 10.1315 10.1315 10.1392 10.1392 10.3947 10.3947 10.3964 10.3964 10.4145 10.4145 10.7386 10.7386 10.7531 10.7531 10.7578 10.7578 11.3757 11.3757 11.3768 11.3768 11.3837 11.3837 11.4440 11.4440 11.4531 11.4531 11.4553 11.4553 11.4932 11.4932 11.4987 11.4987 11.5061 11.5061 12.0888 12.0888 12.1393 12.1393 12.1410 12.1410 12.4203 12.4203 12.4650 12.4650 12.4695 12.4695 12.6521 12.6521 12.6859 12.6859 12.6912 12.6912 12.7269 12.7269 13.1116 13.1116 13.1118 13.1118 13.3776 13.3776 13.3796 13.3796 13.3890 13.3890 13.4462 13.4462 13.4478 13.4478 13.5098 13.5098 13.8337 13.8337 13.8688 13.8688 13.8700 13.8700 13.9020 13.9020 13.9208 13.9208 13.9222 13.9222 13.9850 13.9850 13.9916 13.9916 13.9946 13.9946 14.0330 14.0330 14.0354 14.0354 14.1869 14.1869 14.1883 14.1883 14.1891 14.1891 k = 0.0125 0.0125-0.0000 ( 6403 PWs) bands (ev): 1.4865 1.4865 4.6930 4.6930 4.9461 4.9461 4.9484 4.9484 6.5076 6.5076 6.6992 6.6992 6.7030 6.7030 6.7141 6.7141 9.2162 9.2162 9.2175 9.2175 9.2289 9.2289 9.6900 9.6900 9.6915 9.6915 9.8565 9.8565 9.8599 9.8599 9.8608 9.8608 10.1376 10.1376 10.1396 10.1396 10.3855 10.3855 10.3861 10.3861 10.4053 10.4053 10.7424 10.7424 10.7504 10.7504 10.7526 10.7526 11.3787 11.3787 11.3794 11.3794 11.3832 11.3832 11.4494 11.4494 11.4517 11.4517 11.4544 11.4544 11.4917 11.4917 11.4931 11.4931 11.5009 11.5009 12.0922 12.0922 12.1440 12.1440 12.1444 12.1444 12.4166 12.4166 12.4626 12.4626 12.4638 12.4638 12.6491 12.6491 12.6911 12.6911 12.6923 12.6923 12.7287 12.7287 13.1064 13.1064 13.1064 13.1064 13.3839 13.3839 13.3844 13.3844 13.3921 13.3921 13.4513 13.4513 13.4517 13.4517 13.5151 13.5151 13.8331 13.8331 13.8672 13.8672 13.8675 13.8675 13.9000 13.9000 13.9215 13.9215 13.9219 13.9219 13.9832 13.9832 13.9902 13.9902 13.9910 13.9910 14.0322 14.0322 14.0328 14.0328 14.1836 14.1836 14.1844 14.1844 14.1848 14.1848 k = 0.0000 0.0000 0.0000 ( 6403 PWs) bands (ev): 1.4852 1.4852 4.6947 4.6947 4.9492 4.9492 4.9492 4.9492 6.5187 6.5187 6.6972 6.6972 6.6972 6.6972 6.7021 6.7021 9.2184 9.2184 9.2184 9.2184 9.2304 9.2304 9.6902 9.6902 9.6902 9.6902 9.8628 9.8628 9.8628 9.8628 9.8631 9.8631 10.1399 10.1399 10.1399 10.1399 10.3822 10.3822 10.3822 10.3822 10.4020 10.4020 10.7423 10.7423 10.7509 10.7509 10.7509 10.7509 11.3797 11.3797 11.3797 11.3797 11.3837 11.3837 11.4510 11.4510 11.4510 11.4510 11.4548 11.4548 11.4909 11.4909 11.4909 11.4909 11.4993 11.4993 12.0933 12.0933 12.1456 12.1456 12.1456 12.1456 12.4152 12.4152 12.4618 12.4618 12.4618 12.4618 12.6477 12.6477 12.6928 12.6928 12.6928 12.6928 12.7296 12.7296 13.1046 13.1046 13.1046 13.1046 13.3860 13.3860 13.3860 13.3860 13.3931 13.3931 13.4531 13.4531 13.4531 13.4531 13.5169 13.5169 13.8329 13.8329 13.8666 13.8666 13.8666 13.8666 13.8994 13.8994 13.9218 13.9218 13.9218 13.9218 13.9825 13.9825 13.9898 13.9898 13.9898 13.9898 14.0320 14.0320 14.0320 14.0320 14.1823 14.1823 14.1834 14.1834 14.1834 14.1834 k = 0.0000 0.0000 0.0000 ( 6403 PWs) bands (ev): 1.4852 1.4852 4.6947 4.6947 4.9492 4.9492 4.9492 4.9492 6.5187 6.5187 6.6972 6.6972 6.6972 6.6972 6.7021 6.7021 9.2184 9.2184 9.2184 9.2184 9.2304 9.2304 9.6902 9.6902 9.6902 9.6902 9.8628 9.8628 9.8628 9.8628 9.8631 9.8631 10.1399 10.1399 10.1399 10.1399 10.3822 10.3822 10.3822 10.3822 10.4020 10.4020 10.7423 10.7423 10.7509 10.7509 10.7509 10.7509 11.3797 11.3797 11.3797 11.3797 11.3837 11.3837 11.4510 11.4510 11.4510 11.4510 11.4548 11.4548 11.4909 11.4909 11.4909 11.4909 11.4993 11.4993 12.0933 12.0933 12.1456 12.1456 12.1456 12.1456 12.4152 12.4152 12.4618 12.4618 12.4618 12.4618 12.6477 12.6477 12.6928 12.6928 12.6928 12.6928 12.7296 12.7296 13.1046 13.1046 13.1046 13.1046 13.3860 13.3860 13.3860 13.3860 13.3931 13.3931 13.4531 13.4531 13.4531 13.4531 13.5169 13.5169 13.8329 13.8329 13.8666 13.8666 13.8666 13.8666 13.8994 13.8994 13.9218 13.9218 13.9218 13.9218 13.9825 13.9825 13.9898 13.9898 13.9898 13.9898 14.0320 14.0320 14.0320 14.0320 14.1823 14.1823 14.1834 14.1834 14.1834 14.1834 k = 0.0102 0.0102 0.0102 ( 6403 PWs) bands (ev): 1.4865 1.4865 4.6930 4.6930 4.9473 4.9473 4.9473 4.9473 6.5075 6.5075 6.7001 6.7001 6.7029 6.7029 6.7133 6.7133 9.2164 9.2164 9.2173 9.2173 9.2289 9.2289 9.6907 9.6907 9.6907 9.6907 9.8585 9.8585 9.8592 9.8592 9.8595 9.8595 10.1386 10.1386 10.1386 10.1386 10.3855 10.3855 10.3861 10.3861 10.4053 10.4053 10.7423 10.7423 10.7504 10.7504 10.7526 10.7526 11.3785 11.3785 11.3796 11.3796 11.3832 11.3832 11.4496 11.4496 11.4512 11.4512 11.4546 11.4546 11.4918 11.4918 11.4929 11.4929 11.5009 11.5009 12.0922 12.0922 12.1440 12.1440 12.1445 12.1445 12.4166 12.4166 12.4626 12.4626 12.4637 12.4637 12.6491 12.6491 12.6913 12.6913 12.6922 12.6922 12.7287 12.7287 13.1064 13.1064 13.1064 13.1064 13.3842 13.3842 13.3842 13.3842 13.3921 13.3921 13.4512 13.4512 13.4517 13.4517 13.5151 13.5151 13.8331 13.8331 13.8672 13.8672 13.8675 13.8675 13.9000 13.9000 13.9216 13.9216 13.9217 13.9217 13.9832 13.9832 13.9902 13.9902 13.9910 13.9910 14.0324 14.0324 14.0326 14.0326 14.1837 14.1837 14.1845 14.1845 14.1847 14.1847 k = 0.0204 0.0204 0.0204 ( 6400 PWs) bands (ev): 1.4904 1.4904 4.6879 4.6879 4.9414 4.9414 4.9414 4.9414 6.4808 6.4808 6.7087 6.7087 6.7118 6.7118 6.7481 6.7481 9.2101 9.2101 9.2140 9.2140 9.2247 9.2247 9.6917 9.6917 9.6918 9.6918 9.8457 9.8457 9.8493 9.8493 9.8497 9.8497 10.1352 10.1352 10.1354 10.1354 10.3943 10.3943 10.3968 10.3968 10.4147 10.4147 10.7382 10.7382 10.7534 10.7534 10.7578 10.7578 11.3742 11.3742 11.3792 11.3792 11.3826 11.3826 11.4463 11.4463 11.4482 11.4482 11.4584 11.4584 11.4938 11.4938 11.4983 11.4983 11.5058 11.5058 12.0889 12.0889 12.1392 12.1392 12.1411 12.1411 12.4204 12.4204 12.4649 12.4649 12.4695 12.4695 12.6520 12.6520 12.6867 12.6867 12.6907 12.6907 12.7268 12.7268 13.1116 13.1116 13.1118 13.1118 13.3786 13.3786 13.3788 13.3788 13.3888 13.3888 13.4460 13.4460 13.4479 13.4479 13.5098 13.5098 13.8337 13.8337 13.8688 13.8688 13.8701 13.8701 13.9020 13.9020 13.9213 13.9213 13.9217 13.9217 13.9851 13.9851 13.9916 13.9916 13.9944 13.9944 14.0339 14.0339 14.0345 14.0345 14.1874 14.1874 14.1883 14.1883 14.1886 14.1886 k = 0.0306 0.0306 0.0306 ( 6400 PWs) bands (ev): 1.4969 1.4969 4.6795 4.6795 4.9317 4.9317 4.9318 4.9318 6.4478 6.4478 6.7229 6.7229 6.7260 6.7260 6.7950 6.7950 9.1992 9.1992 9.2085 9.2085 9.2183 9.2183 9.6917 9.6917 9.6920 9.6920 9.8256 9.8256 9.8353 9.8353 9.8359 9.8359 10.1309 10.1309 10.1312 10.1312 10.4068 10.4068 10.4120 10.4120 10.4294 10.4294 10.7281 10.7281 10.7618 10.7618 10.7666 10.7666 11.3665 11.3665 11.3784 11.3784 11.3821 11.3821 11.4425 11.4425 11.4439 11.4439 11.4658 11.4658 11.4960 11.4960 11.5056 11.5056 11.5133 11.5133 12.0836 12.0836 12.1319 12.1319 12.1357 12.1357 12.4259 12.4259 12.4687 12.4687 12.4792 12.4792 12.6534 12.6534 12.6792 12.6792 12.6891 12.6891 12.7263 12.7263 13.1201 13.1201 13.1206 13.1206 13.3698 13.3698 13.3702 13.3702 13.3832 13.3832 13.4372 13.4372 13.4415 13.4415 13.5010 13.5010 13.8346 13.8346 13.8714 13.8714 13.8739 13.8739 13.9048 13.9048 13.9209 13.9209 13.9217 13.9217 13.9883 13.9883 13.9941 13.9941 13.9998 13.9998 14.0363 14.0363 14.0376 14.0376 14.1930 14.1930 14.1949 14.1949 14.1956 14.1956 k = 0.0408 0.0408 0.0408 ( 6406 PWs) bands (ev): 1.5061 1.5061 4.6681 4.6681 4.9186 4.9186 4.9187 4.9187 6.4129 6.4129 6.7424 6.7424 6.7454 6.7454 6.8490 6.8490 9.1839 9.1839 9.2006 9.2006 9.2099 9.2099 9.6877 9.6877 9.6883 9.6883 9.7996 9.7996 9.8216 9.8216 9.8221 9.8221 10.1262 10.1262 10.1267 10.1267 10.4208 10.4208 10.4282 10.4282 10.4495 10.4495 10.7136 10.7136 10.7746 10.7746 10.7792 10.7792 11.3561 11.3561 11.3767 11.3767 11.3810 11.3810 11.4394 11.4394 11.4400 11.4400 11.4758 11.4758 11.4985 11.4985 11.5142 11.5142 11.5223 11.5223 12.0768 12.0768 12.1228 12.1228 12.1286 12.1286 12.4324 12.4324 12.4737 12.4737 12.4924 12.4924 12.6497 12.6497 12.6689 12.6689 12.6851 12.6851 12.7327 12.7327 13.1318 13.1318 13.1326 13.1326 13.3580 13.3580 13.3587 13.3587 13.3748 13.3748 13.4254 13.4254 13.4324 13.4324 13.4890 13.4890 13.8355 13.8355 13.8750 13.8750 13.8782 13.8782 13.9080 13.9080 13.9206 13.9206 13.9217 13.9217 13.9927 13.9927 13.9979 13.9979 14.0068 14.0068 14.0397 14.0397 14.0420 14.0420 14.2006 14.2006 14.2034 14.2034 14.2063 14.2063 k = 0.0510 0.0510 0.0510 ( 6406 PWs) bands (ev): 1.5178 1.5178 4.6539 4.6539 4.9021 4.9021 4.9024 4.9024 6.3776 6.3776 6.7670 6.7670 6.7699 6.7699 6.9082 6.9082 9.1647 9.1647 9.1904 9.1904 9.1993 9.1993 9.6757 9.6757 9.6766 9.6766 9.7689 9.7689 9.8136 9.8136 9.8140 9.8140 10.1220 10.1220 10.1228 10.1228 10.4345 10.4345 10.4427 10.4427 10.4745 10.4745 10.6952 10.6952 10.7913 10.7913 10.7954 10.7954 11.3436 11.3436 11.3737 11.3737 11.3788 11.3788 11.4375 11.4375 11.4379 11.4379 11.4881 11.4881 11.5013 11.5013 11.5236 11.5236 11.5323 11.5323 12.0689 12.0689 12.1126 12.1126 12.1200 12.1200 12.4396 12.4396 12.4799 12.4799 12.5084 12.5084 12.6410 12.6410 12.6559 12.6559 12.6760 12.6760 12.7488 12.7488 13.1464 13.1464 13.1475 13.1475 13.3440 13.3440 13.3448 13.3448 13.3629 13.3629 13.4115 13.4115 13.4209 13.4209 13.4741 13.4741 13.8364 13.8364 13.8796 13.8796 13.8824 13.8824 13.9104 13.9104 13.9213 13.9213 13.9221 13.9221 13.9981 13.9981 14.0031 14.0031 14.0148 14.0148 14.0444 14.0444 14.0479 14.0479 14.2100 14.2100 14.2135 14.2135 14.2209 14.2209 k = 0.0612 0.0612 0.0612 ( 6406 PWs) bands (ev): 1.5321 1.5321 4.6371 4.6371 4.8828 4.8828 4.8831 4.8831 6.3426 6.3426 6.7962 6.7962 6.7989 6.7989 6.9716 6.9716 9.1419 9.1419 9.1771 9.1771 9.1857 9.1857 9.6539 9.6539 9.6552 9.6552 9.7346 9.7346 9.8147 9.8147 9.8149 9.8149 10.1183 10.1183 10.1194 10.1194 10.4469 10.4469 10.4547 10.4547 10.5028 10.5028 10.6734 10.6734 10.8116 10.8116 10.8151 10.8151 11.3294 11.3294 11.3694 11.3694 11.3750 11.3750 11.4371 11.4371 11.4382 11.4382 11.5017 11.5017 11.5050 11.5050 11.5333 11.5333 11.5429 11.5429 12.0602 12.0602 12.1018 12.1018 12.1105 12.1105 12.4472 12.4472 12.4871 12.4871 12.5266 12.5266 12.6284 12.6284 12.6405 12.6405 12.6626 12.6626 12.7725 12.7725 13.1636 13.1636 13.1651 13.1651 13.3282 13.3282 13.3290 13.3290 13.3466 13.3466 13.3966 13.3966 13.4072 13.4072 13.4567 13.4567 13.8371 13.8371 13.8851 13.8851 13.8858 13.8858 13.9108 13.9108 13.9229 13.9229 13.9237 13.9237 14.0044 14.0044 14.0101 14.0101 14.0235 14.0235 14.0501 14.0501 14.0552 14.0552 14.2209 14.2209 14.2252 14.2252 14.2400 14.2400 k = 0.0714 0.0714 0.0714 ( 6418 PWs) bands (ev): 1.5490 1.5490 4.6181 4.6181 4.8609 4.8609 4.8613 4.8613 6.3079 6.3079 6.8296 6.8296 6.8322 6.8322 7.0385 7.0385 9.1162 9.1162 9.1605 9.1605 9.1689 9.1689 9.6247 9.6247 9.6265 9.6265 9.6976 9.6976 9.8241 9.8241 9.8241 9.8241 10.1150 10.1150 10.1164 10.1164 10.4576 10.4576 10.4645 10.4645 10.5327 10.5327 10.6484 10.6484 10.8351 10.8351 10.8378 10.8378 11.3140 11.3140 11.3636 11.3636 11.3697 11.3697 11.4386 11.4386 11.4402 11.4402 11.5062 11.5062 11.5192 11.5192 11.5434 11.5434 11.5538 11.5538 12.0511 12.0511 12.0911 12.0911 12.1002 12.1002 12.4551 12.4551 12.4950 12.4950 12.5458 12.5458 12.6131 12.6131 12.6230 12.6230 12.6460 12.6460 12.8015 12.8015 13.1830 13.1830 13.1847 13.1847 13.3111 13.3111 13.3117 13.3117 13.3255 13.3255 13.3817 13.3817 13.3915 13.3915 13.4372 13.4372 13.8375 13.8375 13.8876 13.8876 13.8915 13.8915 13.9094 13.9094 13.9240 13.9240 13.9272 13.9272 14.0106 14.0106 14.0183 14.0183 14.0322 14.0322 14.0572 14.0572 14.0644 14.0644 14.2328 14.2328 14.2378 14.2378 14.2638 14.2638 k = 0.0816 0.0816 0.0816 ( 6406 PWs) bands (ev): 1.5684 1.5684 4.5973 4.5973 4.8368 4.8368 4.8374 4.8374 6.2735 6.2735 6.8668 6.8668 6.8692 6.8692 7.1088 7.1088 9.0885 9.0885 9.1402 9.1402 9.1485 9.1485 9.5922 9.5922 9.5943 9.5943 9.6583 9.6583 9.8393 9.8393 9.8395 9.8395 10.1119 10.1119 10.1137 10.1137 10.4666 10.4666 10.4725 10.4725 10.5635 10.5635 10.6207 10.6207 10.8609 10.8609 10.8628 10.8628 11.2978 11.2978 11.3569 11.3569 11.3632 11.3632 11.4419 11.4419 11.4439 11.4439 11.5083 11.5083 11.5368 11.5368 11.5535 11.5535 11.5650 11.5650 12.0419 12.0419 12.0809 12.0809 12.0896 12.0896 12.4632 12.4632 12.5034 12.5034 12.5651 12.5651 12.5960 12.5960 12.6037 12.6037 12.6273 12.6273 12.8342 12.8342 13.2043 13.2043 13.2059 13.2059 13.2927 13.2927 13.2935 13.2935 13.3002 13.3002 13.3668 13.3668 13.3739 13.3739 13.4159 13.4159 13.8379 13.8379 13.8882 13.8882 13.8985 13.8985 13.9073 13.9073 13.9256 13.9256 13.9310 13.9310 14.0160 14.0160 14.0271 14.0271 14.0404 14.0404 14.0671 14.0671 14.0769 14.0769 14.2452 14.2452 14.2507 14.2507 14.2927 14.2927 k = 0.0918 0.0918 0.0918 ( 6397 PWs) bands (ev): 1.5903 1.5903 4.5750 4.5750 4.8110 4.8110 4.8117 4.8117 6.2389 6.2389 6.9073 6.9073 6.9096 6.9096 7.1820 7.1820 9.0593 9.0593 9.1154 9.1154 9.1235 9.1235 9.5592 9.5592 9.5616 9.5616 9.6170 9.6170 9.8585 9.8585 9.8587 9.8587 10.1088 10.1088 10.1110 10.1110 10.4742 10.4742 10.4791 10.4791 10.5896 10.5896 10.5953 10.5953 10.8883 10.8883 10.8894 10.8894 11.2813 11.2813 11.3495 11.3495 11.3559 11.3559 11.4465 11.4465 11.4487 11.4487 11.5094 11.5094 11.5558 11.5558 11.5636 11.5636 11.5762 11.5762 12.0327 12.0327 12.0719 12.0719 12.0790 12.0790 12.4712 12.4712 12.5119 12.5119 12.5728 12.5728 12.5833 12.5833 12.5882 12.5882 12.6077 12.6077 12.8699 12.8699 13.2269 13.2269 13.2270 13.2270 13.2679 13.2679 13.2763 13.2763 13.2768 13.2768 13.3518 13.3518 13.3548 13.3548 13.3930 13.3930 13.8379 13.8379 13.8872 13.8872 13.9036 13.9036 13.9069 13.9069 13.9272 13.9272 13.9350 13.9350 14.0203 14.0203 14.0353 14.0353 14.0476 14.0476 14.0803 14.0803 14.0929 14.0929 14.2577 14.2577 14.2636 14.2636 14.3264 14.3264 k = 0.1020 0.1020 0.1020 ( 6391 PWs) bands (ev): 1.6147 1.6147 4.5516 4.5516 4.7837 4.7837 4.7845 4.7845 6.2039 6.2039 6.9507 6.9507 6.9529 6.9529 7.2579 7.2579 9.0293 9.0293 9.0858 9.0858 9.0937 9.0937 9.5281 9.5281 9.5309 9.5309 9.5742 9.5742 9.8802 9.8802 9.8805 9.8805 10.1055 10.1055 10.1083 10.1083 10.4811 10.4811 10.4850 10.4850 10.5578 10.5578 10.6255 10.6255 10.9165 10.9165 10.9169 10.9169 11.2648 11.2648 11.3418 11.3418 11.3482 11.3482 11.4519 11.4519 11.4542 11.4542 11.5094 11.5094 11.5734 11.5734 11.5758 11.5758 11.5872 11.5872 12.0236 12.0236 12.0644 12.0644 12.0688 12.0688 12.4786 12.4786 12.5193 12.5193 12.5537 12.5537 12.5627 12.5627 12.5849 12.5849 12.6073 12.6073 12.9076 12.9076 13.2334 13.2334 13.2383 13.2383 13.2520 13.2520 13.2569 13.2569 13.2699 13.2699 13.3348 13.3348 13.3364 13.3364 13.3691 13.3691 13.8377 13.8377 13.8852 13.8852 13.9008 13.9008 13.9141 13.9141 13.9287 13.9287 13.9391 13.9391 14.0231 14.0231 14.0421 14.0421 14.0537 14.0537 14.0977 14.0977 14.1127 14.1127 14.2696 14.2696 14.2758 14.2758 14.3631 14.3631 k = 0.1122 0.1122 0.1122 ( 6382 PWs) bands (ev): 1.6416 1.6416 4.5273 4.5273 4.7552 4.7552 4.7562 4.7562 6.1682 6.1682 6.9965 6.9965 6.9985 6.9985 7.3362 7.3362 8.9989 8.9989 9.0513 9.0513 9.0588 9.0588 9.5003 9.5003 9.5034 9.5034 9.5299 9.5299 9.9034 9.9034 9.9039 9.9039 10.1024 10.1024 10.1057 10.1057 10.4878 10.4878 10.4908 10.4908 10.5235 10.5235 10.6557 10.6557 10.9446 10.9446 10.9449 10.9449 11.2485 11.2485 11.3341 11.3341 11.3403 11.3403 11.4579 11.4579 11.4602 11.4602 11.5080 11.5080 11.5827 11.5827 11.5965 11.5965 11.5979 11.5979 12.0148 12.0148 12.0587 12.0587 12.0592 12.0592 12.4845 12.4845 12.5203 12.5203 12.5318 12.5318 12.5478 12.5478 12.5649 12.5649 12.6247 12.6247 12.9469 12.9469 13.2001 13.2001 13.2268 13.2268 13.2356 13.2356 13.2745 13.2745 13.2825 13.2825 13.3176 13.3176 13.3208 13.3208 13.3455 13.3455 13.8374 13.8374 13.8824 13.8824 13.8972 13.8972 13.9213 13.9213 13.9301 13.9301 13.9439 13.9439 14.0245 14.0245 14.0473 14.0473 14.0586 14.0586 14.1187 14.1187 14.1359 14.1359 14.2805 14.2805 14.2872 14.2872 14.3823 14.3823 k = 0.1224 0.1224 0.1224 ( 6385 PWs) bands (ev): 1.6709 1.6709 4.5027 4.5027 4.7260 4.7260 4.7270 4.7270 6.1316 6.1316 7.0443 7.0443 7.0460 7.0460 7.4167 7.4167 8.9688 8.9688 9.0119 9.0119 9.0192 9.0192 9.4765 9.4765 9.4796 9.4796 9.4848 9.4848 9.9271 9.9271 9.9278 9.9278 10.0995 10.0995 10.1034 10.1034 10.4875 10.4875 10.4947 10.4947 10.4970 10.4970 10.6854 10.6854 10.9719 10.9719 10.9729 10.9729 11.2327 11.2327 11.3267 11.3267 11.3327 11.3327 11.4639 11.4639 11.4663 11.4663 11.5049 11.5049 11.5914 11.5914 11.6076 11.6076 11.6181 11.6181 12.0065 12.0065 12.0506 12.0506 12.0550 12.0550 12.4865 12.4865 12.5049 12.5049 12.5089 12.5089 12.5475 12.5475 12.5486 12.5486 12.6409 12.6409 12.9872 12.9872 13.1643 13.1643 13.2082 13.2082 13.2153 13.2153 13.2781 13.2781 13.2859 13.2859 13.3057 13.3057 13.3232 13.3232 13.3307 13.3307 13.8371 13.8371 13.8789 13.8789 13.8933 13.8933 13.9274 13.9274 13.9314 13.9314 13.9498 13.9498 14.0248 14.0248 14.0513 14.0513 14.0625 14.0625 14.1428 14.1428 14.1621 14.1621 14.2904 14.2904 14.2975 14.2975 14.3822 14.3822 k = 0.1327 0.1327 0.1327 ( 6379 PWs) bands (ev): 1.7026 1.7026 4.4779 4.4779 4.6962 4.6962 4.6974 4.6974 6.0936 6.0936 7.0934 7.0934 7.0950 7.0950 7.4991 7.4991 8.9391 8.9391 8.9683 8.9683 8.9754 8.9754 9.4375 9.4375 9.4570 9.4570 9.4613 9.4613 9.9496 9.9496 9.9505 9.9505 10.0981 10.0981 10.1025 10.1025 10.4503 10.4503 10.5022 10.5022 10.5039 10.5039 10.7143 10.7143 10.9984 10.9984 11.0000 11.0000 11.2178 11.2178 11.3200 11.3200 11.3257 11.3257 11.4699 11.4699 11.4722 11.4722 11.4998 11.4998 11.5994 11.5994 11.6166 11.6166 11.6400 11.6400 11.9991 11.9991 12.0432 12.0432 12.0533 12.0533 12.4802 12.4802 12.4826 12.4826 12.4854 12.4854 12.5376 12.5376 12.5561 12.5561 12.6553 12.6553 13.0280 13.0280 13.1284 13.1284 13.1880 13.1880 13.1948 13.1948 13.2561 13.2561 13.2736 13.2736 13.2844 13.2844 13.3444 13.3444 13.3470 13.3470 13.8367 13.8367 13.8751 13.8751 13.8893 13.8893 13.9322 13.9322 13.9325 13.9325 13.9572 13.9572 14.0242 14.0242 14.0543 14.0543 14.0654 14.0654 14.1693 14.1693 14.1908 14.1908 14.2991 14.2991 14.3071 14.3071 14.3814 14.3814 k = 0.1429 0.1429 0.1429 ( 6400 PWs) bands (ev): 1.7366 1.7366 4.4532 4.4532 4.6661 4.6661 4.6674 4.6674 6.0541 6.0541 7.1434 7.1434 7.1448 7.1448 7.5831 7.5831 8.9097 8.9097 8.9215 8.9215 8.9289 8.9289 9.3903 9.3903 9.4416 9.4416 9.4463 9.4463 9.9689 9.9689 9.9698 9.9698 10.1001 10.1001 10.1049 10.1049 10.4119 10.4119 10.5107 10.5107 10.5120 10.5120 10.7424 10.7424 11.0236 11.0236 11.0257 11.0257 11.2035 11.2035 11.3141 11.3141 11.3194 11.3194 11.4752 11.4752 11.4775 11.4775 11.4927 11.4927 11.6062 11.6062 11.6244 11.6244 11.6619 11.6619 11.9928 11.9928 12.0371 12.0371 12.0532 12.0532 12.4589 12.4589 12.4607 12.4607 12.4652 12.4652 12.5366 12.5366 12.5644 12.5644 12.6671 12.6671 13.0685 13.0685 13.0932 13.0932 13.1671 13.1671 13.1742 13.1742 13.2306 13.2306 13.2503 13.2503 13.2610 13.2610 13.3690 13.3690 13.3737 13.3737 13.8363 13.8363 13.8711 13.8711 13.8852 13.8852 13.9335 13.9335 13.9356 13.9356 13.9656 13.9656 14.0228 14.0228 14.0563 14.0563 14.0674 14.0674 14.1970 14.1970 14.2209 14.2209 14.3074 14.3074 14.3168 14.3168 14.3814 14.3814 k = 0.1531 0.1531 0.1531 ( 6394 PWs) bands (ev): 1.7729 1.7729 4.4290 4.4290 4.6361 4.6361 4.6375 4.6375 6.0130 6.0130 7.1937 7.1937 7.1949 7.1949 7.6684 7.6684 8.8727 8.8727 8.8755 8.8755 8.8860 8.8860 9.3428 9.3428 9.4299 9.4299 9.4350 9.4350 9.9820 9.9820 9.9827 9.9827 10.1084 10.1084 10.1133 10.1133 10.3728 10.3728 10.5202 10.5202 10.5213 10.5213 10.7696 10.7696 11.0472 11.0472 11.0497 11.0497 11.1902 11.1902 11.3094 11.3094 11.3143 11.3143 11.4798 11.4798 11.4823 11.4823 11.4836 11.4836 11.6119 11.6119 11.6308 11.6308 11.6841 11.6841 11.9881 11.9881 12.0325 12.0325 12.0547 12.0547 12.4353 12.4353 12.4365 12.4365 12.4445 12.4445 12.5404 12.5404 12.5728 12.5728 12.6760 12.6760 13.0592 13.0592 13.1071 13.1071 13.1457 13.1457 13.1557 13.1557 13.2036 13.2036 13.2222 13.2222 13.2385 13.2385 13.3959 13.3959 13.4011 13.4011 13.8361 13.8361 13.8670 13.8670 13.8811 13.8811 13.9344 13.9344 13.9382 13.9382 13.9747 13.9747 14.0211 14.0211 14.0576 14.0576 14.0685 14.0685 14.2243 14.2243 14.2508 14.2508 14.3171 14.3171 14.3282 14.3282 14.3828 14.3828 k = 0.1633 0.1633 0.1633 ( 6394 PWs) bands (ev): 1.8115 1.8115 4.4055 4.4055 4.6061 4.6061 4.6076 4.6076 5.9699 5.9699 7.2435 7.2435 7.2445 7.2445 7.7547 7.7547 8.8229 8.8229 8.8276 8.8276 8.8567 8.8567 9.2957 9.2957 9.4214 9.4214 9.4269 9.4269 9.9870 9.9870 9.9871 9.9871 10.1248 10.1248 10.1294 10.1294 10.3330 10.3330 10.5310 10.5310 10.5320 10.5320 10.7961 10.7961 11.0689 11.0689 11.0717 11.0717 11.1779 11.1779 11.3061 11.3061 11.3106 11.3106 11.4717 11.4717 11.4843 11.4843 11.4864 11.4864 11.6162 11.6162 11.6354 11.6354 11.7061 11.7061 11.9852 11.9852 12.0295 12.0295 12.0573 12.0573 12.4122 12.4122 12.4123 12.4123 12.4224 12.4224 12.5456 12.5456 12.5808 12.5808 12.6817 12.6817 13.0276 13.0276 13.1207 13.1207 13.1237 13.1237 13.1612 13.1612 13.1755 13.1755 13.1923 13.1923 13.2151 13.2151 13.4232 13.4232 13.4285 13.4285 13.8360 13.8360 13.8628 13.8628 13.8772 13.8772 13.9352 13.9352 13.9402 13.9402 13.9837 13.9837 14.0191 14.0191 14.0580 14.0580 14.0687 14.0687 14.2483 14.2483 14.2753 14.2753 14.3332 14.3332 14.3443 14.3443 14.3858 14.3858 k = 0.1735 0.1735 0.1735 ( 6394 PWs) bands (ev): 1.8523 1.8523 4.3829 4.3829 4.5765 4.5765 4.5781 4.5781 5.9249 5.9249 7.2922 7.2922 7.2931 7.2931 7.8416 7.8416 8.7737 8.7737 8.7784 8.7784 8.8294 8.8294 9.2497 9.2497 9.4157 9.4157 9.4215 9.4215 9.9839 9.9839 9.9844 9.9844 10.1484 10.1484 10.1526 10.1526 10.2929 10.2929 10.5429 10.5429 10.5439 10.5439 10.8217 10.8217 11.0884 11.0884 11.0914 11.0914 11.1667 11.1667 11.3046 11.3046 11.3087 11.3087 11.4582 11.4582 11.4874 11.4874 11.4895 11.4895 11.6189 11.6189 11.6381 11.6381 11.7278 11.7278 11.9842 11.9842 12.0281 12.0281 12.0609 12.0609 12.3879 12.3879 12.3903 12.3903 12.4003 12.4003 12.5510 12.5510 12.5881 12.5881 12.6837 12.6837 12.9988 12.9988 13.1011 13.1011 13.1026 13.1026 13.1467 13.1467 13.1615 13.1615 13.1891 13.1891 13.1990 13.1990 13.4504 13.4504 13.4555 13.4555 13.8361 13.8361 13.8588 13.8588 13.8735 13.8735 13.9359 13.9359 13.9418 13.9418 13.9917 13.9917 14.0177 14.0177 14.0577 14.0577 14.0679 14.0679 14.2658 14.2658 14.2892 14.2892 14.3605 14.3605 14.3683 14.3683 14.3914 14.3914 k = 0.1837 0.1837 0.1837 ( 6403 PWs) bands (ev): 1.8952 1.8952 4.3613 4.3613 4.5474 4.5474 4.5491 4.5491 5.8778 5.8778 7.3389 7.3389 7.3395 7.3395 7.9287 7.9287 8.7263 8.7263 8.7309 8.7309 8.8017 8.8017 9.2061 9.2061 9.4122 9.4122 9.4184 9.4184 9.9753 9.9753 9.9764 9.9764 10.1769 10.1769 10.1807 10.1807 10.2526 10.2526 10.5559 10.5559 10.5571 10.5571 10.8465 10.8465 11.1055 11.1055 11.1085 11.1085 11.1567 11.1567 11.3051 11.3051 11.3087 11.3087 11.4426 11.4426 11.4896 11.4896 11.4915 11.4915 11.6199 11.6199 11.6386 11.6386 11.7490 11.7490 11.9853 11.9853 12.0284 12.0284 12.0650 12.0650 12.3638 12.3638 12.3696 12.3696 12.3790 12.3790 12.5559 12.5559 12.5945 12.5945 12.6820 12.6820 12.9732 12.9732 13.0777 13.0777 13.0803 13.0803 13.1174 13.1174 13.1302 13.1302 13.1640 13.1640 13.2373 13.2373 13.4772 13.4772 13.4818 13.4818 13.8364 13.8364 13.8551 13.8551 13.8702 13.8702 13.9364 13.9364 13.9429 13.9429 13.9972 13.9972 14.0184 14.0184 14.0566 14.0566 14.0663 14.0663 14.2762 14.2762 14.2949 14.2949 14.3907 14.3907 14.4010 14.4010 14.4057 14.4057 k = 0.1939 0.1939 0.1939 ( 6397 PWs) bands (ev): 1.9401 1.9401 4.3411 4.3411 4.5188 4.5188 4.5207 4.5207 5.8287 5.8287 7.3823 7.3823 7.3828 7.3828 8.0153 8.0153 8.6823 8.6823 8.6868 8.6868 8.7729 8.7729 9.1664 9.1664 9.4108 9.4108 9.4173 9.4173 9.9631 9.9631 9.9647 9.9647 10.2084 10.2084 10.2100 10.2100 10.2143 10.2143 10.5700 10.5700 10.5714 10.5714 10.8706 10.8706 11.1201 11.1201 11.1229 11.1229 11.1479 11.1479 11.3075 11.3075 11.3108 11.3108 11.4254 11.4254 11.4909 11.4909 11.4928 11.4928 11.6192 11.6192 11.6370 11.6370 11.7694 11.7694 11.9885 11.9885 12.0302 12.0302 12.0694 12.0694 12.3401 12.3401 12.3505 12.3505 12.3589 12.3589 12.5599 12.5599 12.6000 12.6000 12.6767 12.6767 12.9506 12.9506 13.0535 13.0535 13.0568 13.0568 13.0877 13.0877 13.0988 13.0988 13.1368 13.1368 13.2764 13.2764 13.5034 13.5034 13.5072 13.5072 13.8370 13.8370 13.8516 13.8516 13.8673 13.8673 13.9369 13.9369 13.9438 13.9438 13.9982 13.9982 14.0231 14.0231 14.0547 14.0547 14.0638 14.0638 14.2811 14.2811 14.2964 14.2964 14.4045 14.4045 14.4407 14.4407 14.4445 14.4445 k = 0.2041 0.2041 0.2041 ( 6400 PWs) bands (ev): 1.9871 1.9871 4.3224 4.3224 4.4911 4.4911 4.4931 4.4931 5.7775 5.7775 7.4214 7.4214 7.4217 7.4217 8.1004 8.1004 8.6432 8.6432 8.6475 8.6475 8.7420 8.7420 9.1322 9.1322 9.4110 9.4110 9.4179 9.4179 9.9487 9.9487 9.9506 9.9506 10.1720 10.1720 10.2418 10.2418 10.2456 10.2456 10.5849 10.5849 10.5866 10.5866 10.8937 10.8937 11.1324 11.1324 11.1338 11.1338 11.1412 11.1412 11.3118 11.3118 11.3148 11.3148 11.4068 11.4068 11.4914 11.4914 11.4932 11.4932 11.6166 11.6166 11.6333 11.6333 11.7888 11.7888 11.9937 11.9937 12.0335 12.0335 12.0738 12.0738 12.3170 12.3170 12.3329 12.3329 12.3403 12.3403 12.5627 12.5627 12.6044 12.6044 12.6684 12.6684 12.9307 12.9307 13.0280 13.0280 13.0324 13.0324 13.0580 13.0580 13.0674 13.0674 13.1081 13.1081 13.3149 13.3149 13.5287 13.5287 13.5317 13.5317 13.8378 13.8378 13.8486 13.8486 13.8649 13.8649 13.9372 13.9372 13.9442 13.9442 13.9960 13.9960 14.0302 14.0302 14.0520 14.0520 14.0605 14.0605 14.2827 14.2827 14.2957 14.2957 14.4174 14.4174 14.4856 14.4856 14.4909 14.4909 k = 0.2143 0.2143 0.2143 ( 6412 PWs) bands (ev): 2.0359 2.0359 4.3053 4.3053 4.4641 4.4641 4.4662 4.4662 5.7244 5.7244 7.4547 7.4547 7.4548 7.4548 8.1822 8.1822 8.6107 8.6107 8.6147 8.6147 8.7090 8.7090 9.1049 9.1049 9.4127 9.4127 9.4199 9.4199 9.9327 9.9327 9.9348 9.9348 10.1322 10.1322 10.2761 10.2761 10.2800 10.2800 10.6003 10.6003 10.6024 10.6024 10.9160 10.9160 11.1321 11.1321 11.1427 11.1427 11.1462 11.1462 11.3174 11.3174 11.3203 11.3203 11.3870 11.3870 11.4910 11.4910 11.4929 11.4929 11.6123 11.6123 11.6276 11.6276 11.8069 11.8069 12.0007 12.0007 12.0382 12.0382 12.0777 12.0777 12.2951 12.2951 12.3170 12.3170 12.3231 12.3231 12.5640 12.5640 12.6076 12.6076 12.6576 12.6576 12.9125 12.9125 13.0012 13.0012 13.0071 13.0071 13.0286 13.0286 13.0364 13.0364 13.0781 13.0781 13.3525 13.3525 13.5532 13.5532 13.5551 13.5551 13.8389 13.8389 13.8461 13.8461 13.8632 13.8632 13.9373 13.9373 13.9444 13.9444 13.9925 13.9925 14.0380 14.0380 14.0487 14.0487 14.0567 14.0567 14.2820 14.2820 14.2935 14.2935 14.4330 14.4330 14.5345 14.5345 14.5409 14.5409 k = 0.2245 0.2245 0.2245 ( 6400 PWs) bands (ev): 2.0866 2.0866 4.2899 4.2899 4.4382 4.4382 4.4403 4.4403 5.6693 5.6693 7.4808 7.4808 7.4808 7.4808 8.2574 8.2574 8.5864 8.5864 8.5902 8.5902 8.6762 8.6762 9.0857 9.0857 9.4158 9.4158 9.4233 9.4233 9.9157 9.9157 9.9180 9.9180 10.0929 10.0929 10.3111 10.3111 10.3152 10.3152 10.6164 10.6164 10.6188 10.6188 10.9374 10.9374 11.1269 11.1269 11.1516 11.1516 11.1542 11.1542 11.3238 11.3238 11.3266 11.3266 11.3668 11.3668 11.4902 11.4902 11.4920 11.4920 11.6066 11.6066 11.6203 11.6203 11.8233 11.8233 12.0093 12.0093 12.0443 12.0443 12.0811 12.0811 12.2746 12.2746 12.3029 12.3029 12.3075 12.3075 12.5635 12.5635 12.6094 12.6094 12.6454 12.6454 12.8952 12.8952 12.9728 12.9728 12.9811 12.9811 12.9996 12.9996 13.0060 13.0060 13.0468 13.0468 13.3891 13.3891 13.5766 13.5766 13.5774 13.5774 13.8403 13.8403 13.8441 13.8441 13.8621 13.8621 13.9373 13.9373 13.9442 13.9442 13.9883 13.9883 14.0444 14.0444 14.0448 14.0448 14.0537 14.0537 14.2797 14.2797 14.2901 14.2901 14.4518 14.4518 14.5870 14.5870 14.5940 14.5940 k = 0.2347 0.2347 0.2347 ( 6391 PWs) bands (ev): 2.1390 2.1390 4.2764 4.2764 4.4132 4.4132 4.4154 4.4154 5.6126 5.6126 7.4983 7.4983 7.4983 7.4983 8.3184 8.3184 8.5718 8.5718 8.5754 8.5754 8.6504 8.6504 9.0750 9.0750 9.4199 9.4199 9.4276 9.4276 9.8980 9.8980 9.9004 9.9004 10.0541 10.0541 10.3463 10.3463 10.3507 10.3507 10.6328 10.6328 10.6355 10.6355 10.9578 10.9578 11.1226 11.1226 11.1596 11.1596 11.1616 11.1616 11.3300 11.3300 11.3328 11.3328 11.3462 11.3462 11.4888 11.4888 11.4908 11.4908 11.5996 11.5996 11.6119 11.6119 11.8376 11.8376 12.0194 12.0194 12.0516 12.0516 12.0837 12.0837 12.2561 12.2561 12.2905 12.2905 12.2935 12.2935 12.5611 12.5611 12.6097 12.6097 12.6325 12.6325 12.8771 12.8771 12.9430 12.9430 12.9551 12.9551 12.9709 12.9709 12.9762 12.9762 13.0143 13.0143 13.4246 13.4246 13.5986 13.5986 13.5992 13.5992 13.8420 13.8420 13.8427 13.8427 13.8618 13.8618 13.9371 13.9371 13.9437 13.9437 13.9839 13.9839 14.0403 14.0403 14.0433 14.0433 14.0573 14.0573 14.2762 14.2762 14.2857 14.2857 14.4743 14.4743 14.6428 14.6428 14.6502 14.6502 k = 0.2449 0.2449 0.2449 ( 6388 PWs) bands (ev): 2.1930 2.1930 4.2649 4.2649 4.3892 4.3892 4.3916 4.3916 5.5542 5.5542 7.5064 7.5064 7.5065 7.5065 8.3507 8.3507 8.5680 8.5680 8.5713 8.5713 8.6462 8.6462 9.0725 9.0725 9.4249 9.4249 9.4330 9.4330 9.8799 9.8799 9.8824 9.8824 10.0161 10.0161 10.3813 10.3813 10.3862 10.3862 10.6494 10.6494 10.6524 10.6524 10.9770 10.9770 11.1193 11.1193 11.1672 11.1672 11.1686 11.1686 11.3253 11.3253 11.3356 11.3356 11.3390 11.3390 11.4868 11.4868 11.4889 11.4889 11.5924 11.5924 11.6033 11.6033 11.8493 11.8493 12.0306 12.0306 12.0599 12.0599 12.0853 12.0853 12.2400 12.2400 12.2798 12.2798 12.2810 12.2810 12.5566 12.5566 12.6084 12.6084 12.6197 12.6197 12.8571 12.8571 12.9121 12.9121 12.9294 12.9294 12.9424 12.9424 12.9474 12.9474 12.9808 12.9808 13.4590 13.4590 13.6187 13.6187 13.6206 13.6206 13.8418 13.8418 13.8439 13.8439 13.8621 13.8621 13.9367 13.9367 13.9428 13.9428 13.9792 13.9792 14.0352 14.0352 14.0377 14.0377 14.0644 14.0644 14.2716 14.2716 14.2803 14.2803 14.5004 14.5004 14.7015 14.7015 14.7091 14.7091 k = 0.2551 0.2551 0.2551 ( 6388 PWs) bands (ev): 2.2486 2.2486 4.2554 4.2554 4.3664 4.3664 4.3689 4.3689 5.4944 5.4944 7.5048 7.5048 7.5048 7.5048 8.3422 8.3422 8.5754 8.5754 8.5785 8.5785 8.6756 8.6756 9.0780 9.0780 9.4307 9.4307 9.4391 9.4391 9.8616 9.8616 9.8642 9.8642 9.9789 9.9789 10.4158 10.4158 10.4213 10.4213 10.6661 10.6661 10.6693 10.6693 10.9951 10.9951 11.1170 11.1170 11.1750 11.1750 11.1757 11.1757 11.3053 11.3053 11.3397 11.3397 11.3432 11.3432 11.4839 11.4839 11.4862 11.4862 11.5856 11.5856 11.5954 11.5954 11.8577 11.8577 12.0427 12.0427 12.0691 12.0691 12.0859 12.0859 12.2268 12.2268 12.2700 12.2700 12.2707 12.2707 12.5498 12.5498 12.6056 12.6056 12.6072 12.6072 12.8341 12.8341 12.8804 12.8804 12.9043 12.9043 12.9139 12.9139 12.9198 12.9198 12.9465 12.9465 13.4921 13.4921 13.6376 13.6376 13.6409 13.6409 13.8414 13.8414 13.8461 13.8461 13.8630 13.8630 13.9360 13.9360 13.9415 13.9415 13.9745 13.9745 14.0297 14.0297 14.0309 14.0309 14.0718 14.0718 14.2661 14.2661 14.2741 14.2741 14.5302 14.5302 14.7633 14.7633 14.7709 14.7709 k = 0.2653 0.2653 0.2653 ( 6388 PWs) bands (ev): 2.3056 2.3056 4.2481 4.2481 4.3448 4.3448 4.3473 4.3473 5.4334 5.4334 7.4938 7.4938 7.4938 7.4938 8.3011 8.3011 8.5938 8.5938 8.5965 8.5965 8.7308 8.7308 9.0909 9.0909 9.4373 9.4373 9.4460 9.4460 9.8435 9.8435 9.8461 9.8461 9.9428 9.9428 10.4493 10.4493 10.4555 10.4555 10.6830 10.6830 10.6861 10.6861 11.0118 11.0118 11.1158 11.1158 11.1833 11.1833 11.1834 11.1834 11.2860 11.2860 11.3419 11.3419 11.3457 11.3457 11.4792 11.4792 11.4818 11.4818 11.5807 11.5807 11.5895 11.5895 11.8625 11.8625 12.0553 12.0553 12.0791 12.0791 12.0858 12.0858 12.2169 12.2169 12.2605 12.2605 12.2630 12.2630 12.5410 12.5410 12.5951 12.5951 12.6011 12.6011 12.8080 12.8080 12.8483 12.8483 12.8785 12.8785 12.8850 12.8850 12.8941 12.8941 12.9117 12.9117 13.5238 13.5238 13.6555 13.6555 13.6602 13.6602 13.8416 13.8416 13.8486 13.8486 13.8646 13.8646 13.9351 13.9351 13.9398 13.9398 13.9697 13.9697 14.0233 14.0233 14.0236 14.0236 14.0789 14.0789 14.2599 14.2599 14.2671 14.2671 14.5633 14.5633 14.8279 14.8279 14.8355 14.8355 k = 0.2755 0.2755 0.2755 ( 6388 PWs) bands (ev): 2.3638 2.3638 4.2429 4.2429 4.3243 4.3243 4.3269 4.3269 5.3714 5.3714 7.4743 7.4743 7.4743 7.4743 8.2418 8.2418 8.6222 8.6222 8.6246 8.6246 8.7973 8.7973 9.1112 9.1112 9.4445 9.4445 9.4535 9.4535 9.8255 9.8255 9.8281 9.8281 9.9076 9.9076 10.4814 10.4814 10.4884 10.4884 10.7001 10.7001 10.7031 10.7031 11.0270 11.0270 11.1156 11.1156 11.1919 11.1919 11.1924 11.1924 11.2677 11.2677 11.3423 11.3423 11.3462 11.3462 11.4722 11.4722 11.4749 11.4749 11.5784 11.5784 11.5865 11.5865 11.8633 11.8633 12.0678 12.0678 12.0855 12.0855 12.0898 12.0898 12.2104 12.2104 12.2525 12.2525 12.2568 12.2568 12.5307 12.5307 12.5832 12.5832 12.5948 12.5948 12.7794 12.7794 12.8159 12.8159 12.8506 12.8506 12.8558 12.8558 12.8696 12.8696 12.8781 12.8781 13.5542 13.5542 13.6726 13.6726 13.6785 13.6785 13.8422 13.8422 13.8514 13.8514 13.8666 13.8666 13.9339 13.9339 13.9378 13.9378 13.9649 13.9649 14.0154 14.0154 14.0172 14.0172 14.0857 14.0857 14.2530 14.2530 14.2595 14.2595 14.5991 14.5991 14.8951 14.8951 14.9027 14.9027 k = 0.2857 0.2857 0.2857 ( 6376 PWs) bands (ev): 2.4232 2.4232 4.2400 4.2400 4.3049 4.3049 4.3077 4.3077 5.3085 5.3085 7.4478 7.4478 7.4479 7.4479 8.1725 8.1725 8.6595 8.6595 8.6616 8.6616 8.8666 8.8666 9.1391 9.1391 9.4522 9.4522 9.4615 9.4615 9.8078 9.8078 9.8105 9.8105 9.8735 9.8735 10.5114 10.5114 10.5194 10.5194 10.7178 10.7178 10.7205 10.7205 11.0409 11.0409 11.1164 11.1164 11.2015 11.2015 11.2025 11.2025 11.2505 11.2505 11.3409 11.3409 11.3450 11.3450 11.4626 11.4626 11.4654 11.4654 11.5794 11.5794 11.5869 11.5869 11.8599 11.8599 12.0769 12.0769 12.0885 12.0885 12.1009 12.1009 12.2070 12.2070 12.2460 12.2460 12.2519 12.2519 12.5192 12.5192 12.5710 12.5710 12.5868 12.5868 12.7490 12.7490 12.7833 12.7833 12.8207 12.8207 12.8263 12.8263 12.8390 12.8390 12.8524 12.8524 13.5833 13.5833 13.6889 13.6889 13.6960 13.6960 13.8431 13.8431 13.8547 13.8547 13.8691 13.8691 13.9325 13.9325 13.9355 13.9355 13.9602 13.9602 14.0069 14.0069 14.0105 14.0105 14.0922 14.0922 14.2457 14.2457 14.2514 14.2514 14.6358 14.6358 14.9648 14.9648 14.9723 14.9723 k = 0.2959 0.2959 0.2959 ( 6382 PWs) bands (ev): 2.4836 2.4836 4.2392 4.2392 4.2868 4.2868 4.2896 4.2896 5.2451 5.2451 7.4157 7.4157 7.4158 7.4158 8.0971 8.0971 8.7039 8.7039 8.7057 8.7057 8.9337 8.9337 9.1752 9.1752 9.4604 9.4604 9.4700 9.4700 9.7906 9.7906 9.7934 9.7934 9.8405 9.8405 10.5385 10.5385 10.5476 10.5476 10.7366 10.7366 10.7389 10.7389 11.0530 11.0530 11.1180 11.1180 11.2120 11.2120 11.2134 11.2134 11.2344 11.2344 11.3377 11.3377 11.3420 11.3420 11.4507 11.4507 11.4536 11.4536 11.5831 11.5831 11.5903 11.5903 11.8525 11.8525 12.0783 12.0783 12.0990 12.0990 12.1125 12.1125 12.2062 12.2062 12.2414 12.2414 12.2483 12.2483 12.5069 12.5069 12.5580 12.5580 12.5771 12.5771 12.7176 12.7176 12.7509 12.7509 12.7889 12.7889 12.7964 12.7964 12.8056 12.8056 12.8307 12.8307 13.6109 13.6109 13.7044 13.7044 13.7127 13.7127 13.8443 13.8443 13.8582 13.8582 13.8718 13.8718 13.9307 13.9307 13.9329 13.9329 13.9555 13.9555 13.9983 13.9983 14.0037 14.0037 14.0983 14.0983 14.2378 14.2378 14.2427 14.2427 14.6684 14.6684 14.9753 14.9753 15.0367 15.0367 k = 0.3061 0.3061 0.3061 ( 6382 PWs) bands (ev): 2.5449 2.5449 4.2407 4.2407 4.2699 4.2699 4.2728 4.2728 5.1813 5.1813 7.3795 7.3795 7.3796 7.3796 8.0178 8.0178 8.7542 8.7542 8.7557 8.7557 8.9957 8.9957 9.2203 9.2203 9.4689 9.4689 9.4788 9.4788 9.7741 9.7741 9.7769 9.7769 9.8088 9.8088 10.5619 10.5619 10.5720 10.5720 10.7570 10.7570 10.7588 10.7588 11.0637 11.0637 11.1207 11.1207 11.2182 11.2182 11.2243 11.2243 11.2252 11.2252 11.3333 11.3333 11.3377 11.3377 11.4374 11.4374 11.4404 11.4404 11.5886 11.5886 11.5957 11.5957 11.8417 11.8417 12.0772 12.0772 12.1119 12.1119 12.1242 12.1242 12.2074 12.2074 12.2390 12.2390 12.2459 12.2459 12.4942 12.4942 12.5441 12.5441 12.5657 12.5657 12.6858 12.6858 12.7186 12.7186 12.7551 12.7551 12.7664 12.7664 12.7735 12.7735 12.8090 12.8090 13.6372 13.6372 13.7194 13.7194 13.7287 13.7287 13.8457 13.8457 13.8620 13.8620 13.8747 13.8747 13.9287 13.9287 13.9300 13.9300 13.9509 13.9509 13.9894 13.9894 13.9967 13.9967 14.1041 14.1041 14.2296 14.2296 14.2336 14.2336 14.6870 14.6870 14.9428 14.9428 15.1107 15.1107 k = 0.3163 0.3163 0.3163 ( 6376 PWs) bands (ev): 2.6068 2.6068 4.2443 4.2443 4.2542 4.2542 4.2571 4.2571 5.1173 5.1173 7.3405 7.3405 7.3406 7.3406 7.9358 7.9358 8.8089 8.8089 8.8102 8.8102 9.0512 9.0512 9.2743 9.2743 9.4777 9.4777 9.4879 9.4879 9.7584 9.7584 9.7612 9.7612 9.7785 9.7785 10.5809 10.5809 10.5919 10.5919 10.7794 10.7794 10.7808 10.7808 11.0732 11.0732 11.1242 11.1242 11.2038 11.2038 11.2357 11.2357 11.2373 11.2373 11.3280 11.3280 11.3325 11.3325 11.4239 11.4239 11.4269 11.4269 11.5951 11.5951 11.6022 11.6022 11.8279 11.8279 12.0760 12.0760 12.1248 12.1248 12.1362 12.1362 12.2096 12.2096 12.2392 12.2392 12.2447 12.2447 12.4810 12.4810 12.5291 12.5291 12.5527 12.5527 12.6539 12.6539 12.6865 12.6865 12.7203 12.7203 12.7364 12.7364 12.7427 12.7427 12.7867 12.7867 13.6620 13.6620 13.7338 13.7338 13.7440 13.7440 13.8470 13.8470 13.8660 13.8660 13.8777 13.8777 13.9264 13.9264 13.9270 13.9270 13.9464 13.9464 13.9805 13.9805 13.9898 13.9898 14.1096 14.1096 14.2212 14.2212 14.2242 14.2242 14.6797 14.6797 14.9456 14.9456 15.1864 15.1864 k = 0.3265 0.3265 0.3265 ( 6370 PWs) bands (ev): 2.6693 2.6693 4.2396 4.2396 4.2426 4.2426 4.2500 4.2500 5.0535 5.0535 7.2998 7.2998 7.2999 7.2999 7.8523 7.8523 8.8669 8.8669 8.8680 8.8680 9.1004 9.1004 9.3359 9.3359 9.4867 9.4867 9.4972 9.4972 9.7438 9.7438 9.7462 9.7462 9.7499 9.7499 10.5949 10.5949 10.6065 10.6065 10.8042 10.8042 10.8055 10.8055 11.0817 11.0817 11.1285 11.1285 11.1888 11.1888 11.2475 11.2475 11.2492 11.2492 11.3220 11.3220 11.3267 11.3267 11.4115 11.4115 11.4145 11.4145 11.6017 11.6017 11.6091 11.6091 11.8119 11.8119 12.0750 12.0750 12.1371 12.1371 12.1482 12.1482 12.2121 12.2121 12.2424 12.2424 12.2447 12.2447 12.4675 12.4675 12.5129 12.5129 12.5381 12.5381 12.6223 12.6223 12.6549 12.6549 12.6853 12.6853 12.7066 12.7066 12.7130 12.7130 12.7634 12.7634 13.6852 13.6852 13.7476 13.7476 13.7587 13.7587 13.8484 13.8484 13.8702 13.8702 13.8808 13.8808 13.9239 13.9239 13.9240 13.9240 13.9418 13.9418 13.9716 13.9716 13.9830 13.9830 14.1148 14.1148 14.2128 14.2128 14.2147 14.2147 14.6486 14.6486 14.9813 14.9813 15.2635 15.2635 k = 0.3367 0.3367 0.3367 ( 6364 PWs) bands (ev): 2.7321 2.7321 4.2262 4.2262 4.2293 4.2293 4.2576 4.2576 4.9901 4.9901 7.2582 7.2582 7.2584 7.2584 7.7678 7.7678 8.9273 8.9273 8.9281 8.9281 9.1450 9.1450 9.4029 9.4029 9.4957 9.4957 9.5066 9.5066 9.7217 9.7217 9.7303 9.7303 9.7335 9.7335 10.6039 10.6039 10.6157 10.6157 10.8313 10.8313 10.8327 10.8327 11.0896 11.0896 11.1336 11.1336 11.1730 11.1730 11.2579 11.2579 11.2597 11.2597 11.3156 11.3156 11.3205 11.3205 11.4017 11.4017 11.4046 11.4046 11.6078 11.6078 11.6155 11.6155 11.7942 11.7942 12.0745 12.0745 12.1486 12.1486 12.1600 12.1600 12.2148 12.2148 12.2457 12.2457 12.2482 12.2482 12.4534 12.4534 12.4958 12.4958 12.5222 12.5222 12.5913 12.5913 12.6237 12.6237 12.6509 12.6509 12.6770 12.6770 12.6841 12.6841 12.7391 12.7391 13.7069 13.7069 13.7609 13.7609 13.7727 13.7727 13.8496 13.8496 13.8744 13.8744 13.8839 13.8839 13.9209 13.9209 13.9210 13.9210 13.9372 13.9372 13.9630 13.9630 13.9765 13.9765 14.1196 14.1196 14.2043 14.2043 14.2050 14.2050 14.6061 14.6061 15.0376 15.0376 15.3417 15.3417 k = 0.3469 0.3469 0.3469 ( 6376 PWs) bands (ev): 2.7950 2.7950 4.2139 4.2139 4.2171 4.2171 4.2670 4.2670 4.9274 4.9274 7.2167 7.2167 7.2168 7.2168 7.6832 7.6832 8.9888 8.9888 8.9894 8.9894 9.1862 9.1862 9.4730 9.4730 9.5048 9.5048 9.5160 9.5160 9.6956 9.6956 9.7184 9.7184 9.7215 9.7215 10.6080 10.6080 10.6198 10.6198 10.8602 10.8602 10.8620 10.8620 11.0972 11.0972 11.1389 11.1389 11.1561 11.1561 11.2654 11.2654 11.2673 11.2673 11.3089 11.3089 11.3140 11.3140 11.3964 11.3964 11.3990 11.3990 11.6130 11.6130 11.6209 11.6209 11.7752 11.7752 12.0749 12.0749 12.1587 12.1587 12.1717 12.1717 12.2180 12.2180 12.2477 12.2477 12.2558 12.2558 12.4386 12.4386 12.4778 12.4778 12.5051 12.5051 12.5612 12.5612 12.5932 12.5932 12.6173 12.6173 12.6479 12.6479 12.6560 12.6560 12.7140 12.7140 13.7269 13.7269 13.7735 13.7735 13.7860 13.7860 13.8505 13.8505 13.8783 13.8783 13.8868 13.8868 13.9177 13.9177 13.9179 13.9179 13.9324 13.9324 13.9548 13.9548 13.9702 13.9702 14.1240 14.1240 14.1953 14.1953 14.1959 14.1959 14.5606 14.5606 15.1058 15.1058 15.4206 15.4206 k = 0.3571 0.3571 0.3571 ( 6386 PWs) bands (ev): 2.8579 2.8579 4.2027 4.2027 4.2059 4.2059 4.2777 4.2777 4.8657 4.8657 7.1758 7.1758 7.1758 7.1758 7.5990 7.5990 9.0507 9.0507 9.0512 9.0512 9.2252 9.2252 9.5137 9.5137 9.5246 9.5246 9.5452 9.5452 9.6711 9.6711 9.7083 9.7083 9.7115 9.7115 10.6075 10.6075 10.6190 10.6190 10.8905 10.8905 10.8929 10.8929 11.1046 11.1046 11.1339 11.1339 11.1480 11.1480 11.2687 11.2687 11.2707 11.2707 11.3021 11.3021 11.3072 11.3072 11.3974 11.3974 11.3995 11.3995 11.6168 11.6168 11.6250 11.6250 11.7556 11.7556 12.0763 12.0763 12.1673 12.1673 12.1831 12.1831 12.2220 12.2220 12.2505 12.2505 12.2646 12.2646 12.4229 12.4229 12.4592 12.4592 12.4869 12.4869 12.5324 12.5324 12.5636 12.5636 12.5853 12.5853 12.6195 12.6195 12.6288 12.6288 12.6882 12.6882 13.7452 13.7452 13.7854 13.7854 13.7985 13.7985 13.8513 13.8513 13.8819 13.8819 13.8897 13.8897 13.9142 13.9142 13.9152 13.9152 13.9275 13.9275 13.9474 13.9474 13.9644 13.9644 14.1280 14.1280 14.1858 14.1858 14.1878 14.1878 14.5157 14.5157 15.1821 15.1821 15.4997 15.4997 k = 0.3673 0.3673 0.3673 ( 6386 PWs) bands (ev): 2.9206 2.9206 4.1925 4.1925 4.1958 4.1958 4.2893 4.2893 4.8056 4.8056 7.1359 7.1359 7.1360 7.1360 7.5159 7.5159 9.1120 9.1120 9.1124 9.1124 9.2625 9.2625 9.5222 9.5222 9.5335 9.5335 9.6167 9.6167 9.6484 9.6484 9.7006 9.7006 9.7040 9.7040 10.6027 10.6027 10.6140 10.6140 10.9217 10.9217 10.9248 10.9248 11.1076 11.1076 11.1175 11.1175 11.1543 11.1543 11.2676 11.2676 11.2698 11.2698 11.2949 11.2949 11.3001 11.3001 11.4052 11.4052 11.4065 11.4065 11.6190 11.6190 11.6273 11.6273 11.7357 11.7357 12.0791 12.0791 12.1744 12.1744 12.1942 12.1942 12.2268 12.2268 12.2540 12.2540 12.2739 12.2739 12.4063 12.4063 12.4405 12.4405 12.4679 12.4679 12.5052 12.5052 12.5352 12.5352 12.5551 12.5551 12.5920 12.5920 12.6028 12.6028 12.6619 12.6619 13.7617 13.7617 13.7965 13.7965 13.8104 13.8104 13.8518 13.8518 13.8848 13.8848 13.8927 13.8927 13.9106 13.9106 13.9128 13.9128 13.9223 13.9223 13.9411 13.9411 13.9591 13.9591 14.1317 14.1317 14.1766 14.1766 14.1801 14.1801 14.4732 14.4732 15.2645 15.2645 15.5788 15.5788 k = 0.3776 0.3776 0.3776 ( 6380 PWs) bands (ev): 2.9827 2.9827 4.1834 4.1834 4.1868 4.1868 4.3011 4.3011 4.7478 4.7478 7.0977 7.0977 7.0977 7.0977 7.4345 7.4345 9.1719 9.1719 9.1723 9.1723 9.2984 9.2984 9.5301 9.5301 9.5414 9.5414 9.6261 9.6261 9.6882 9.6882 9.6960 9.6960 9.7008 9.7008 10.5941 10.5941 10.6050 10.6050 10.9534 10.9534 10.9572 10.9572 11.0848 11.0848 11.1234 11.1234 11.1621 11.1621 11.2632 11.2632 11.2655 11.2655 11.2876 11.2876 11.2927 11.2927 11.4184 11.4184 11.4189 11.4189 11.6195 11.6195 11.6278 11.6278 11.7157 11.7157 12.0833 12.0833 12.1799 12.1799 12.2048 12.2048 12.2318 12.2318 12.2579 12.2579 12.2832 12.2832 12.3887 12.3887 12.4219 12.4219 12.4483 12.4483 12.4802 12.4802 12.5082 12.5082 12.5271 12.5271 12.5655 12.5655 12.5779 12.5779 12.6356 12.6356 13.7762 13.7762 13.8066 13.8066 13.8213 13.8213 13.8521 13.8521 13.8864 13.8864 13.8958 13.8958 13.9068 13.9068 13.9107 13.9107 13.9171 13.9171 13.9364 13.9364 13.9545 13.9545 14.1348 14.1348 14.1678 14.1678 14.1728 14.1728 14.4338 14.4338 15.3519 15.3519 15.6572 15.6572 k = 0.3878 0.3878 0.3878 ( 6386 PWs) bands (ev): 3.0441 3.0441 4.1752 4.1752 4.1786 4.1786 4.3120 4.3120 4.6933 4.6933 7.0613 7.0613 7.0613 7.0613 7.3555 7.3555 9.2291 9.2291 9.2295 9.2295 9.3328 9.3328 9.5369 9.5369 9.5481 9.5481 9.6064 9.6064 9.6953 9.6953 9.6986 9.6986 9.7610 9.7610 10.5818 10.5818 10.5924 10.5924 10.9851 10.9851 10.9896 10.9896 11.0556 11.0556 11.1328 11.1328 11.1704 11.1704 11.2569 11.2569 11.2593 11.2593 11.2806 11.2806 11.2856 11.2856 11.4349 11.4349 11.4354 11.4354 11.6182 11.6182 11.6261 11.6261 11.6960 11.6960 12.0887 12.0887 12.1840 12.1840 12.2147 12.2147 12.2363 12.2363 12.2618 12.2618 12.2920 12.2920 12.3704 12.3704 12.4040 12.4040 12.4285 12.4285 12.4575 12.4575 12.4831 12.4831 12.5015 12.5015 12.5403 12.5403 12.5544 12.5544 12.6093 12.6093 13.7887 13.7887 13.8151 13.8151 13.8311 13.8311 13.8524 13.8524 13.8867 13.8867 13.8987 13.8987 13.9031 13.9031 13.9083 13.9083 13.9130 13.9130 13.9334 13.9334 13.9507 13.9507 14.1373 14.1373 14.1595 14.1595 14.1661 14.1661 14.3980 14.3980 15.4432 15.4432 15.7345 15.7345 k = 0.3980 0.3980 0.3980 ( 6380 PWs) bands (ev): 3.1044 3.1044 4.1680 4.1680 4.1714 4.1714 4.3205 4.3205 4.6436 4.6436 7.0272 7.0272 7.0272 7.0272 7.2795 7.2795 9.2825 9.2825 9.2831 9.2831 9.3657 9.3657 9.5424 9.5424 9.5532 9.5532 9.5883 9.5883 9.6997 9.6997 9.7034 9.7034 9.8312 9.8312 10.5661 10.5661 10.5764 10.5764 11.0165 11.0165 11.0200 11.0200 11.0247 11.0247 11.1430 11.1430 11.1791 11.1791 11.2498 11.2498 11.2521 11.2521 11.2739 11.2739 11.2789 11.2789 11.4531 11.4531 11.4547 11.4547 11.6153 11.6153 11.6223 11.6223 11.6771 11.6771 12.0954 12.0954 12.1869 12.1869 12.2235 12.2235 12.2393 12.2393 12.2653 12.2653 12.2998 12.2998 12.3520 12.3520 12.3874 12.3874 12.4091 12.4091 12.4375 12.4375 12.4602 12.4602 12.4784 12.4784 12.5165 12.5165 12.5325 12.5325 12.5836 12.5836 13.7988 13.7988 13.8217 13.8217 13.8397 13.8397 13.8529 13.8529 13.8858 13.8858 13.8997 13.8997 13.8998 13.8998 13.9055 13.9055 13.9120 13.9120 13.9321 13.9321 13.9476 13.9476 14.1389 14.1389 14.1520 14.1520 14.1600 14.1600 14.3660 14.3660 15.5377 15.5377 15.8099 15.8099 k = 0.4082 0.4082 0.4082 ( 6380 PWs) bands (ev): 3.1634 3.1634 4.1616 4.1616 4.1651 4.1651 4.3238 4.3238 4.6012 4.6012 6.9956 6.9956 6.9956 6.9956 7.2074 7.2074 9.3307 9.3307 9.3317 9.3317 9.3966 9.3966 9.5463 9.5463 9.5564 9.5564 9.5718 9.5718 9.7102 9.7102 9.7142 9.7142 9.9001 9.9001 10.5474 10.5474 10.5575 10.5575 10.9864 10.9864 11.0471 11.0471 11.0534 11.0534 11.1538 11.1538 11.1882 11.1882 11.2427 11.2427 11.2449 11.2449 11.2679 11.2679 11.2727 11.2727 11.4723 11.4723 11.4751 11.4751 11.6108 11.6108 11.6162 11.6162 11.6593 11.6593 12.1029 12.1029 12.1884 12.1884 12.2310 12.2310 12.2399 12.2399 12.2681 12.2681 12.3061 12.3061 12.3341 12.3341 12.3733 12.3733 12.3905 12.3905 12.4202 12.4202 12.4399 12.4399 12.4580 12.4580 12.4944 12.4944 12.5121 12.5121 12.5588 12.5588 13.8069 13.8069 13.8260 13.8260 13.8466 13.8466 13.8537 13.8537 13.8843 13.8843 13.8965 13.8965 13.8969 13.8969 13.9055 13.9055 13.9137 13.9137 13.9323 13.9323 13.9454 13.9454 14.1386 14.1386 14.1463 14.1463 14.1545 14.1545 14.3380 14.3380 15.6341 15.6341 15.8830 15.8830 k = 0.4184 0.4184 0.4184 ( 6374 PWs) bands (ev): 3.2207 3.2207 4.1560 4.1560 4.1596 4.1596 4.3189 4.3189 4.5690 4.5690 6.9667 6.9667 6.9668 6.9668 7.1398 7.1398 9.3726 9.3726 9.3742 9.3742 9.4254 9.4254 9.5483 9.5483 9.5562 9.5562 9.5586 9.5586 9.7276 9.7276 9.7317 9.7317 9.9676 9.9676 10.5258 10.5258 10.5358 10.5358 10.9470 10.9470 11.0767 11.0767 11.0837 11.0837 11.1650 11.1650 11.1973 11.1973 11.2362 11.2362 11.2383 11.2383 11.2625 11.2625 11.2671 11.2671 11.4914 11.4914 11.4959 11.4959 11.6051 11.6051 11.6078 11.6078 11.6430 11.6430 12.1108 12.1108 12.1884 12.1884 12.2365 12.2365 12.2378 12.2378 12.2697 12.2697 12.3100 12.3100 12.3172 12.3172 12.3629 12.3629 12.3735 12.3735 12.4056 12.4056 12.4225 12.4225 12.4406 12.4406 12.4742 12.4742 12.4933 12.4933 12.5354 12.5354 13.8129 13.8129 13.8279 13.8279 13.8514 13.8514 13.8546 13.8546 13.8824 13.8824 13.8928 13.8928 13.8951 13.8951 13.9056 13.9056 13.9173 13.9173 13.9334 13.9334 13.9439 13.9439 14.1349 14.1349 14.1438 14.1438 14.1497 14.1497 14.3142 14.3142 15.7315 15.7315 15.9528 15.9528 k = 0.4286 0.4286 0.4286 ( 6368 PWs) bands (ev): 3.2756 3.2756 4.1512 4.1512 4.1548 4.1548 4.3035 4.3035 4.5494 4.5494 6.9408 6.9408 6.9409 6.9409 7.0775 7.0775 9.4075 9.4075 9.4098 9.4098 9.4518 9.4518 9.5437 9.5437 9.5488 9.5488 9.5578 9.5578 9.7516 9.7516 9.7555 9.7555 10.0335 10.0335 10.5021 10.5021 10.5120 10.5120 10.9050 10.9050 11.1050 11.1050 11.1126 11.1126 11.1762 11.1762 11.2065 11.2065 11.2306 11.2306 11.2325 11.2325 11.2577 11.2577 11.2622 11.2622 11.5096 11.5096 11.5162 11.5162 11.5974 11.5974 11.5986 11.5986 11.6286 11.6286 12.1183 12.1183 12.1868 12.1868 12.2334 12.2334 12.2396 12.2396 12.2700 12.2700 12.3009 12.3009 12.3115 12.3115 12.3567 12.3567 12.3587 12.3587 12.3938 12.3938 12.4084 12.4084 12.4264 12.4264 12.4561 12.4561 12.4763 12.4763 12.5138 12.5138 13.8170 13.8170 13.8281 13.8281 13.8537 13.8537 13.8549 13.8549 13.8800 13.8800 13.8913 13.8913 13.8945 13.8945 13.9051 13.9051 13.9217 13.9217 13.9351 13.9351 13.9432 13.9432 14.1296 14.1296 14.1427 14.1427 14.1456 14.1456 14.2945 14.2945 15.8286 15.8286 16.0186 16.0186 k = 0.4388 0.4388 0.4388 ( 6344 PWs) bands (ev): 3.3277 3.3277 4.1472 4.1472 4.1508 4.1508 4.2784 4.2784 4.5416 4.5416 6.9180 6.9180 6.9182 6.9182 7.0213 7.0213 9.4354 9.4354 9.4384 9.4384 9.4755 9.4755 9.5325 9.5325 9.5482 9.5482 9.5568 9.5568 9.7812 9.7812 9.7846 9.7846 10.0975 10.0975 10.4767 10.4767 10.4867 10.4867 10.8608 10.8608 11.1313 11.1313 11.1396 11.1396 11.1871 11.1871 11.2153 11.2153 11.2261 11.2261 11.2277 11.2277 11.2537 11.2537 11.2579 11.2579 11.5259 11.5259 11.5354 11.5354 11.5859 11.5859 11.5923 11.5923 11.6159 11.6159 12.1248 12.1248 12.1837 12.1837 12.2285 12.2285 12.2400 12.2400 12.2685 12.2685 12.2859 12.2859 12.3106 12.3106 12.3467 12.3467 12.3527 12.3527 12.3853 12.3853 12.3978 12.3978 12.4159 12.4159 12.4405 12.4405 12.4611 12.4611 12.4946 12.4946 13.8194 13.8194 13.8273 13.8273 13.8538 13.8538 13.8543 13.8543 13.8768 13.8768 13.8925 13.8925 13.8951 13.8951 13.9045 13.9045 13.9262 13.9262 13.9372 13.9372 13.9432 13.9432 14.1244 14.1244 14.1415 14.1415 14.1421 14.1421 14.2788 14.2788 15.9234 15.9234 16.0794 16.0794 k = 0.4490 0.4490 0.4490 ( 6356 PWs) bands (ev): 3.3761 3.3761 4.1439 4.1439 4.1475 4.1475 4.2474 4.2474 4.5419 4.5419 6.8984 6.8984 6.8987 6.8987 6.9721 6.9721 9.4566 9.4566 9.4604 9.4604 9.4959 9.4959 9.5229 9.5229 9.5469 9.5469 9.5551 9.5551 9.8141 9.8141 9.8169 9.8169 10.1591 10.1591 10.4503 10.4503 10.4605 10.4605 10.8153 10.8153 11.1551 11.1551 11.1638 11.1638 11.1974 11.1974 11.2222 11.2222 11.2239 11.2239 11.2241 11.2241 11.2504 11.2504 11.2542 11.2542 11.5380 11.5380 11.5518 11.5518 11.5750 11.5750 11.5879 11.5879 11.6045 11.6045 12.1293 12.1293 12.1790 12.1790 12.2248 12.2248 12.2381 12.2381 12.2649 12.2649 12.2723 12.2723 12.3087 12.3087 12.3378 12.3378 12.3482 12.3482 12.3802 12.3802 12.3904 12.3904 12.4089 12.4089 12.4275 12.4275 12.4476 12.4476 12.4781 12.4781 13.8207 13.8207 13.8258 13.8258 13.8525 13.8525 13.8528 13.8528 13.8735 13.8735 13.8951 13.8951 13.8963 13.8963 13.9037 13.9037 13.9303 13.9303 13.9394 13.9394 13.9436 13.9436 14.1197 14.1197 14.1392 14.1392 14.1397 14.1397 14.2668 14.2668 16.0139 16.0139 16.1340 16.1340 k = 0.4592 0.4592 0.4592 ( 6359 PWs) bands (ev): 3.4195 3.4195 4.1412 4.1412 4.1448 4.1448 4.2149 4.2149 4.5465 4.5465 6.8823 6.8823 6.8825 6.8825 6.9305 6.9305 9.4723 9.4723 9.4767 9.4767 9.5118 9.5118 9.5162 9.5162 9.5454 9.5454 9.5534 9.5534 9.8478 9.8478 9.8498 9.8498 10.2178 10.2178 10.4242 10.4242 10.4347 10.4347 10.7692 10.7692 11.1755 11.1755 11.1842 11.1842 11.2064 11.2064 11.2210 11.2210 11.2212 11.2212 11.2312 11.2312 11.2479 11.2479 11.2512 11.2512 11.5436 11.5436 11.5568 11.5568 11.5736 11.5736 11.5879 11.5879 11.5949 11.5949 12.1314 12.1314 12.1734 12.1734 12.2237 12.2237 12.2351 12.2351 12.2594 12.2594 12.2603 12.2603 12.3063 12.3063 12.3319 12.3319 12.3423 12.3423 12.3784 12.3784 12.3857 12.3857 12.4049 12.4049 12.4173 12.4173 12.4359 12.4359 12.4646 12.4646 13.8212 13.8212 13.8242 13.8242 13.8507 13.8507 13.8510 13.8510 13.8705 13.8705 13.8977 13.8977 13.8981 13.8981 13.9029 13.9029 13.9338 13.9338 13.9416 13.9416 13.9444 13.9444 14.1156 14.1156 14.1370 14.1370 14.1378 14.1378 14.2580 14.2580 16.0973 16.0973 16.1815 16.1815 k = 0.4694 0.4694 0.4694 ( 6347 PWs) bands (ev): 3.4566 3.4566 4.1391 4.1391 4.1427 4.1427 4.1848 4.1848 4.5525 4.5525 6.8696 6.8696 6.8699 6.8699 6.8973 6.8973 9.4836 9.4836 9.4880 9.4880 9.5091 9.5091 9.5267 9.5267 9.5441 9.5441 9.5522 9.5522 9.8793 9.8793 9.8806 9.8806 10.2719 10.2719 10.4001 10.4001 10.4111 10.4111 10.7244 10.7244 11.1916 11.1916 11.1986 11.1986 11.2137 11.2137 11.2200 11.2200 11.2231 11.2231 11.2377 11.2377 11.2465 11.2465 11.2490 11.2490 11.5430 11.5430 11.5492 11.5492 11.5804 11.5804 11.5902 11.5902 11.5924 11.5924 12.1316 12.1316 12.1678 12.1678 12.2252 12.2252 12.2324 12.2324 12.2505 12.2505 12.2527 12.2527 12.3041 12.3041 12.3285 12.3285 12.3360 12.3360 12.3783 12.3783 12.3827 12.3827 12.4032 12.4032 12.4099 12.4099 12.4265 12.4265 12.4542 12.4542 13.8211 13.8211 13.8228 13.8228 13.8490 13.8490 13.8492 13.8492 13.8681 13.8681 13.8990 13.8990 13.9006 13.9006 13.9024 13.9024 13.9365 13.9365 13.9437 13.9437 13.9454 13.9454 14.1123 14.1123 14.1352 14.1352 14.1359 14.1359 14.2519 14.2519 16.1699 16.1699 16.2204 16.2204 k = 0.4796 0.4796 0.4796 ( 6335 PWs) bands (ev): 3.4853 3.4853 4.1377 4.1377 4.1411 4.1411 4.1605 4.1605 4.5579 4.5579 6.8605 6.8605 6.8608 6.8608 6.8731 6.8731 9.4910 9.4910 9.4946 9.4946 9.5061 9.5061 9.5358 9.5358 9.5430 9.5430 9.5516 9.5516 9.9055 9.9055 9.9061 9.9061 10.3187 10.3187 10.3799 10.3799 10.3917 10.3917 10.6838 10.6838 11.2018 11.2018 11.2051 11.2051 11.2189 11.2189 11.2207 11.2207 11.2295 11.2295 11.2427 11.2427 11.2462 11.2462 11.2475 11.2475 11.5397 11.5397 11.5420 11.5420 11.5769 11.5769 11.5962 11.5962 11.5980 11.5980 12.1306 12.1306 12.1632 12.1632 12.2280 12.2280 12.2309 12.2309 12.2432 12.2432 12.2456 12.2456 12.3022 12.3022 12.3267 12.3267 12.3305 12.3305 12.3787 12.3787 12.3807 12.3807 12.4025 12.4025 12.4052 12.4052 12.4195 12.4195 12.4470 12.4470 13.8209 13.8209 13.8216 13.8216 13.8477 13.8477 13.8478 13.8478 13.8664 13.8664 13.9000 13.9000 13.9012 13.9012 13.9032 13.9032 13.9384 13.9384 13.9455 13.9455 13.9462 13.9462 14.1098 14.1098 14.1341 14.1341 14.1344 14.1344 14.2480 14.2480 16.2268 16.2268 16.2495 16.2496 k = 0.4898 0.4898 0.4898 ( 6302 PWs) bands (ev): 3.5036 3.5036 4.1368 4.1368 4.1392 4.1392 4.1455 4.1455 4.5616 4.5616 6.8551 6.8551 6.8554 6.8554 6.8583 6.8583 9.4953 9.4953 9.4966 9.4966 9.5060 9.5060 9.5407 9.5407 9.5423 9.5423 9.5519 9.5519 9.9230 9.9230 9.9232 9.9232 10.3515 10.3515 10.3663 10.3663 10.3801 10.3801 10.6532 10.6532 11.2061 11.2061 11.2068 11.2068 11.2224 11.2224 11.2227 11.2227 11.2355 11.2355 11.2458 11.2458 11.2468 11.2468 11.2470 11.2470 11.5367 11.5367 11.5372 11.5372 11.5731 11.5731 11.6018 11.6018 11.6022 11.6022 12.1296 12.1296 12.1602 12.1602 12.2307 12.2307 12.2311 12.2311 12.2385 12.2385 12.2397 12.2397 12.3009 12.3009 12.3259 12.3259 12.3270 12.3270 12.3790 12.3790 12.3796 12.3796 12.4022 12.4022 12.4029 12.4029 12.4153 12.4153 12.4428 12.4428 13.8208 13.8208 13.8210 13.8210 13.8469 13.8469 13.8469 13.8469 13.8655 13.8655 13.9007 13.9007 13.9011 13.9011 13.9045 13.9045 13.9396 13.9396 13.9466 13.9466 13.9468 13.9468 14.1084 14.1084 14.1335 14.1335 14.1335 14.1335 14.2459 14.2459 16.2623 16.2623 16.2676 16.2678 k = 0.5000 0.5000 0.5000 ( 6272 PWs) bands (ev): 3.5100 3.5100 4.1366 4.1366 4.1366 4.1366 4.1422 4.1422 4.5629 4.5629 6.8531 6.8531 6.8535 6.8535 6.8535 6.8535 9.4967 9.4967 9.4967 9.4967 9.5065 9.5065 9.5421 9.5421 9.5421 9.5421 9.5523 9.5523 9.9292 9.9292 9.9292 9.9292 10.3615 10.3615 10.3615 10.3615 10.3788 10.3788 10.6413 10.6413 11.2072 11.2072 11.2072 11.2072 11.2237 11.2237 11.2237 11.2237 11.2377 11.2377 11.2466 11.2466 11.2473 11.2473 11.2473 11.2473 11.5356 11.5356 11.5356 11.5356 11.5718 11.5718 11.6038 11.6038 11.6038 11.6038 12.1293 12.1293 12.1592 12.1592 12.2321 12.2321 12.2321 12.2321 12.2368 12.2368 12.2368 12.2368 12.3005 12.3005 12.3257 12.3257 12.3257 12.3257 12.3792 12.3792 12.3792 12.3792 12.4022 12.4022 12.4022 12.4022 12.4139 12.4139 12.4415 12.4415 13.8208 13.8208 13.8208 13.8208 13.8466 13.8466 13.8466 13.8466 13.8652 13.8652 13.9011 13.9011 13.9011 13.9011 13.9049 13.9049 13.9401 13.9401 13.9470 13.9470 13.9470 13.9470 14.1080 14.1080 14.1333 14.1333 14.1333 14.1333 14.2453 14.2453 16.2738 16.2738 16.2738 16.2748 k = 0.5000 0.5000 0.5000 ( 6272 PWs) bands (ev): 3.5100 3.5100 4.1366 4.1366 4.1366 4.1366 4.1422 4.1422 4.5629 4.5629 6.8531 6.8531 6.8535 6.8535 6.8535 6.8535 9.4967 9.4967 9.4967 9.4967 9.5065 9.5065 9.5421 9.5421 9.5421 9.5421 9.5523 9.5523 9.9292 9.9292 9.9292 9.9292 10.3615 10.3615 10.3615 10.3615 10.3788 10.3788 10.6413 10.6413 11.2072 11.2072 11.2072 11.2072 11.2237 11.2237 11.2237 11.2237 11.2377 11.2377 11.2466 11.2466 11.2473 11.2473 11.2473 11.2473 11.5356 11.5356 11.5356 11.5356 11.5718 11.5718 11.6038 11.6038 11.6038 11.6038 12.1293 12.1293 12.1592 12.1592 12.2321 12.2321 12.2321 12.2321 12.2368 12.2368 12.2368 12.2368 12.3005 12.3005 12.3257 12.3257 12.3257 12.3257 12.3792 12.3792 12.3792 12.3792 12.4022 12.4022 12.4022 12.4022 12.4139 12.4139 12.4415 12.4415 13.8208 13.8208 13.8208 13.8208 13.8466 13.8466 13.8466 13.8466 13.8652 13.8652 13.9011 13.9011 13.9011 13.9011 13.9049 13.9049 13.9401 13.9401 13.9470 13.9470 13.9470 13.9470 14.1080 14.1080 14.1333 14.1333 14.1333 14.1333 14.2453 14.2453 16.2738 16.2738 16.2739 16.2741 k = 0.4875 0.5000 0.4875 ( 6294 PWs) bands (ev): 3.5037 3.5037 4.1362 4.1362 4.1393 4.1393 4.1460 4.1460 4.5616 4.5616 6.8547 6.8547 6.8562 6.8562 6.8579 6.8579 9.4954 9.4954 9.4966 9.4966 9.5060 9.5060 9.5409 9.5409 9.5422 9.5422 9.5519 9.5519 9.9201 9.9201 9.9261 9.9261 10.3535 10.3535 10.3645 10.3645 10.3800 10.3800 10.6533 10.6533 11.2062 11.2062 11.2068 11.2068 11.2225 11.2225 11.2227 11.2227 11.2355 11.2355 11.2459 11.2459 11.2467 11.2467 11.2470 11.2470 11.5365 11.5365 11.5375 11.5375 11.5732 11.5732 11.6012 11.6012 11.6028 11.6028 12.1296 12.1296 12.1602 12.1602 12.2305 12.2305 12.2313 12.2313 12.2382 12.2382 12.2401 12.2401 12.3009 12.3009 12.3259 12.3259 12.3269 12.3269 12.3791 12.3791 12.3796 12.3796 12.4023 12.4023 12.4028 12.4028 12.4153 12.4153 12.4428 12.4428 13.8208 13.8208 13.8210 13.8210 13.8468 13.8468 13.8470 13.8470 13.8655 13.8655 13.9008 13.9008 13.9011 13.9011 13.9045 13.9045 13.9396 13.9396 13.9465 13.9465 13.9470 13.9470 14.1084 14.1084 14.1335 14.1335 14.1335 14.1335 14.2459 14.2459 16.2618 16.2618 16.2680 16.2680 k = 0.4750 0.5000 0.4750 ( 6332 PWs) bands (ev): 3.4854 3.4854 4.1335 4.1335 4.1425 4.1425 4.1633 4.1633 4.5579 4.5579 6.8587 6.8587 6.8646 6.8646 6.8711 6.8711 9.4912 9.4912 9.4951 9.4951 9.5055 9.5055 9.5367 9.5367 9.5422 9.5422 9.5515 9.5515 9.8947 9.8947 9.9165 9.9165 10.3279 10.3279 10.3665 10.3665 10.3957 10.3957 10.6844 10.6844 11.2020 11.2020 11.2048 11.2048 11.2190 11.2190 11.2206 11.2206 11.2294 11.2294 11.2437 11.2437 11.2454 11.2454 11.2473 11.2473 11.5389 11.5389 11.5426 11.5426 11.5771 11.5771 11.5941 11.5941 11.6003 11.6003 12.1305 12.1305 12.1632 12.1632 12.2269 12.2269 12.2320 12.2320 12.2420 12.2420 12.2470 12.2470 12.3022 12.3022 12.3266 12.3266 12.3305 12.3305 12.3786 12.3786 12.3808 12.3808 12.4027 12.4027 12.4047 12.4047 12.4198 12.4198 12.4470 12.4470 13.8210 13.8210 13.8216 13.8216 13.8472 13.8472 13.8482 13.8482 13.8664 13.8664 13.9001 13.9001 13.9012 13.9012 13.9032 13.9032 13.9383 13.9383 13.9450 13.9450 13.9468 13.9468 14.1099 14.1099 14.1342 14.1342 14.1344 14.1344 14.2479 14.2479 16.2250 16.2250 16.2502 16.2502 k = 0.4625 0.5000 0.4625 ( 6348 PWs) bands (ev): 3.4570 3.4570 4.1279 4.1279 4.1472 4.1472 4.1914 4.1914 4.5521 4.5521 6.8654 6.8654 6.8787 6.8787 6.8929 6.8929 9.4836 9.4836 9.4900 9.4900 9.5073 9.5073 9.5291 9.5291 9.5414 9.5414 9.5526 9.5526 9.8577 9.8577 9.9002 9.9002 10.2932 10.2932 10.3667 10.3667 10.4229 10.4229 10.7261 10.7261 11.1918 11.1918 11.1982 11.1982 11.2137 11.2137 11.2203 11.2203 11.2227 11.2227 11.2411 11.2411 11.2443 11.2443 11.2482 11.2482 11.5416 11.5416 11.5500 11.5500 11.5793 11.5793 11.5875 11.5875 11.5969 11.5969 12.1312 12.1312 12.1679 12.1679 12.2221 12.2221 12.2357 12.2357 12.2477 12.2477 12.2563 12.2563 12.3041 12.3041 12.3275 12.3275 12.3361 12.3361 12.3777 12.3777 12.3832 12.3832 12.4036 12.4036 12.4078 12.4078 12.4279 12.4279 12.4545 12.4545 13.8212 13.8212 13.8227 13.8227 13.8481 13.8481 13.8502 13.8502 13.8681 13.8681 13.8991 13.8991 13.9005 13.9005 13.9021 13.9021 13.9362 13.9362 13.9428 13.9428 13.9467 13.9467 14.1124 14.1124 14.1353 14.1353 14.1361 14.1361 14.2517 14.2517 16.1676 16.1676 16.2208 16.2208 k = 0.4500 0.5000 0.4500 ( 6352 PWs) bands (ev): 3.4208 3.4208 4.1194 4.1194 4.1539 4.1539 4.2275 4.2275 4.5451 4.5451 6.8747 6.8747 6.8981 6.8981 6.9227 6.9227 9.4723 9.4723 9.4805 9.4805 9.5111 9.5111 9.5185 9.5185 9.5392 9.5392 9.5555 9.5555 9.8139 9.8139 9.8769 9.8769 10.2568 10.2568 10.3664 10.3664 10.4553 10.4553 10.7726 10.7726 11.1752 11.1752 11.1844 11.1844 11.2062 11.2062 11.2196 11.2196 11.2224 11.2224 11.2380 11.2380 11.2440 11.2440 11.2499 11.2499 11.5408 11.5408 11.5580 11.5580 11.5704 11.5704 11.5894 11.5894 11.5991 11.5991 12.1308 12.1308 12.1736 12.1736 12.2168 12.2168 12.2422 12.2422 12.2548 12.2548 12.2676 12.2676 12.3064 12.3064 12.3288 12.3288 12.3430 12.3430 12.3770 12.3770 12.3869 12.3869 12.4053 12.4053 12.4119 12.4119 12.4395 12.4395 12.4656 12.4656 13.8215 13.8215 13.8240 13.8240 13.8492 13.8492 13.8528 13.8528 13.8704 13.8704 13.8974 13.8974 13.8980 13.8980 13.9027 13.9027 13.9332 13.9332 13.9401 13.9401 13.9469 13.9469 14.1158 14.1158 14.1369 14.1369 14.1386 14.1386 14.2574 14.2574 16.0965 16.0965 16.1818 16.1818 k = 0.4375 0.5000 0.4375 ( 6356 PWs) bands (ev): 3.3789 3.3789 4.1076 4.1076 4.1626 4.1626 4.2696 4.2696 4.5377 4.5377 6.8866 6.8866 6.9229 6.9229 6.9600 6.9600 9.4574 9.4574 9.4655 9.4655 9.5048 9.5048 9.5169 9.5169 9.5355 9.5355 9.5600 9.5600 9.7680 9.7680 9.8463 9.8463 10.2226 10.2226 10.3656 10.3656 10.4896 10.4896 10.8206 10.8206 11.1534 11.1534 11.1656 11.1656 11.1963 11.1963 11.2196 11.2196 11.2251 11.2251 11.2355 11.2355 11.2443 11.2443 11.2520 11.2520 11.5293 11.5293 11.5621 11.5621 11.5682 11.5682 11.5882 11.5882 11.6109 11.6109 12.1287 12.1287 12.1794 12.1794 12.2121 12.2121 12.2505 12.2505 12.2628 12.2628 12.2804 12.2804 12.3089 12.3089 12.3307 12.3307 12.3499 12.3499 12.3780 12.3780 12.3927 12.3927 12.4079 12.4079 12.4172 12.4172 12.4541 12.4541 12.4810 12.4810 13.8215 13.8215 13.8251 13.8251 13.8505 13.8505 13.8556 13.8556 13.8732 13.8732 13.8935 13.8935 13.8964 13.8964 13.9036 13.9036 13.9291 13.9291 13.9373 13.9373 13.9476 13.9476 14.1200 14.1200 14.1387 14.1387 14.1420 14.1420 14.2655 14.2655 16.0167 16.0167 16.1356 16.1356 k = 0.4250 0.5000 0.4250 ( 6364 PWs) bands (ev): 3.3329 3.3329 4.0922 4.0922 4.1731 4.1731 4.3160 4.3160 4.5309 4.5309 6.9012 6.9012 6.9528 6.9528 7.0042 7.0042 9.4387 9.4387 9.4426 9.4426 9.4894 9.4894 9.5232 9.5232 9.5301 9.5301 9.5657 9.5657 9.7245 9.7245 9.8087 9.8087 10.1926 10.1926 10.3640 10.3640 10.5235 10.5235 10.8678 10.8678 11.1276 11.1276 11.1442 11.1442 11.1848 11.1848 11.2210 11.2210 11.2246 11.2246 11.2382 11.2382 11.2448 11.2448 11.2549 11.2549 11.5091 11.5091 11.5584 11.5584 11.5729 11.5729 11.5923 11.5923 11.6256 11.6256 12.1246 12.1246 12.1833 12.1833 12.2093 12.2093 12.2591 12.2591 12.2704 12.2704 12.2932 12.2932 12.3125 12.3125 12.3334 12.3334 12.3553 12.3553 12.3833 12.3833 12.4014 12.4014 12.4117 12.4117 12.4236 12.4236 12.4706 12.4706 12.5010 12.5010 13.8210 13.8210 13.8257 13.8257 13.8517 13.8517 13.8584 13.8584 13.8763 13.8763 13.8890 13.8890 13.8948 13.8948 13.9048 13.9048 13.9242 13.9242 13.9348 13.9348 13.9488 13.9488 14.1247 14.1247 14.1406 14.1406 14.1469 14.1469 14.2761 14.2761 15.9317 15.9317 16.0831 16.0831 k = 0.4125 0.5000 0.4125 ( 6364 PWs) bands (ev): 3.2841 3.2841 4.0729 4.0729 4.1856 4.1856 4.3655 4.3655 4.5254 4.5254 6.9183 6.9183 6.9876 6.9876 7.0545 7.0545 9.4084 9.4084 9.4170 9.4170 9.4726 9.4726 9.5207 9.5207 9.5324 9.5324 9.5726 9.5726 9.6875 9.6875 9.7656 9.7656 10.1677 10.1677 10.3615 10.3615 10.5558 10.5558 10.9126 10.9126 11.0988 11.0988 11.1212 11.1212 11.1718 11.1718 11.2205 11.2205 11.2236 11.2236 11.2446 11.2446 11.2469 11.2469 11.2585 11.2585 11.4850 11.4850 11.5511 11.5511 11.5768 11.5768 11.6016 11.6016 11.6417 11.6417 12.1189 12.1189 12.1836 12.1836 12.2098 12.2098 12.2662 12.2662 12.2772 12.2772 12.3014 12.3014 12.3208 12.3208 12.3372 12.3372 12.3594 12.3594 12.3936 12.3936 12.4136 12.4136 12.4180 12.4180 12.4311 12.4311 12.4886 12.4886 12.5253 12.5253 13.8197 13.8197 13.8252 13.8252 13.8525 13.8525 13.8606 13.8606 13.8786 13.8786 13.8851 13.8851 13.8936 13.8936 13.9063 13.9063 13.9190 13.9190 13.9327 13.9327 13.9509 13.9509 14.1293 14.1293 14.1426 14.1426 14.1537 14.1537 14.2897 14.2897 15.8437 15.8437 16.0216 16.0216 k = 0.4000 0.5000 0.4000 ( 6370 PWs) bands (ev): 3.2335 3.2335 4.0496 4.0496 4.1999 4.1999 4.4174 4.4174 4.5221 4.5221 6.9381 6.9381 7.0270 7.0270 7.1100 7.1100 9.3625 9.3625 9.3913 9.3913 9.4548 9.4548 9.5087 9.5087 9.5415 9.5415 9.5806 9.5806 9.6590 9.6590 9.7189 9.7189 10.1478 10.1478 10.3579 10.3579 10.5857 10.5857 10.9538 10.9538 11.0675 11.0675 11.0977 11.0977 11.1579 11.1579 11.2156 11.2156 11.2272 11.2272 11.2453 11.2453 11.2575 11.2575 11.2627 11.2627 11.4590 11.4590 11.5422 11.5422 11.5796 11.5796 11.6137 11.6137 11.6584 11.6584 12.1119 12.1119 12.1804 12.1804 12.2123 12.2123 12.2700 12.2700 12.2825 12.2825 12.3048 12.3048 12.3325 12.3325 12.3436 12.3436 12.3650 12.3650 12.4069 12.4069 12.4218 12.4218 12.4355 12.4355 12.4398 12.4398 12.5077 12.5077 12.5536 12.5536 13.8173 13.8173 13.8227 13.8227 13.8524 13.8524 13.8613 13.8613 13.8770 13.8770 13.8850 13.8850 13.8937 13.8937 13.9083 13.9083 13.9139 13.9139 13.9311 13.9311 13.9538 13.9538 14.1333 14.1333 14.1452 14.1452 14.1624 14.1624 14.3064 14.3064 15.7543 15.7543 15.9468 15.9468 k = 0.3875 0.5000 0.3875 ( 6386 PWs) bands (ev): 3.1818 3.1818 4.0222 4.0222 4.2160 4.2160 4.4710 4.4710 4.5214 4.5214 6.9604 6.9604 7.0708 7.0708 7.1701 7.1701 9.3054 9.3054 9.3624 9.3624 9.4365 9.4365 9.4906 9.4906 9.5518 9.5518 9.5896 9.5896 9.6389 9.6389 9.6715 9.6715 10.1325 10.1325 10.3529 10.3529 10.6124 10.6124 10.9884 10.9884 11.0346 11.0346 11.0755 11.0755 11.1432 11.1432 11.2105 11.2105 11.2319 11.2319 11.2450 11.2450 11.2671 11.2671 11.2718 11.2718 11.4325 11.4325 11.5326 11.5326 11.5808 11.5808 11.6274 11.6274 11.6751 11.6751 12.1043 12.1043 12.1752 12.1752 12.2143 12.2143 12.2698 12.2698 12.2852 12.2852 12.3084 12.3084 12.3411 12.3411 12.3557 12.3557 12.3733 12.3733 12.4219 12.4219 12.4298 12.4298 12.4498 12.4498 12.4607 12.4607 12.5277 12.5277 12.5849 12.5849 13.8135 13.8135 13.8177 13.8177 13.8515 13.8515 13.8591 13.8591 13.8745 13.8745 13.8862 13.8862 13.8959 13.8959 13.9077 13.9077 13.9127 13.9127 13.9302 13.9302 13.9578 13.9578 14.1359 14.1359 14.1493 14.1493 14.1733 14.1733 14.3261 14.3261 15.6647 15.6647 15.8636 15.8636 k = 0.3750 0.5000 0.3750 ( 6386 PWs) bands (ev): 3.1295 3.1295 3.9913 3.9913 4.2339 4.2339 4.5234 4.5234 4.5262 4.5262 6.9852 6.9852 7.1185 7.1185 7.2339 7.2339 9.2394 9.2394 9.3305 9.3305 9.4180 9.4180 9.4640 9.4640 9.5632 9.5632 9.5997 9.5997 9.6236 9.6236 9.6292 9.6292 10.1215 10.1215 10.3465 10.3465 10.6360 10.6360 10.9969 10.9969 11.0118 11.0118 11.0623 11.0623 11.1282 11.1282 11.2054 11.2054 11.2372 11.2372 11.2445 11.2445 11.2727 11.2727 11.2881 11.2881 11.4066 11.4066 11.5231 11.5231 11.5805 11.5805 11.6424 11.6424 11.6915 11.6915 12.0965 12.0965 12.1688 12.1688 12.2143 12.2143 12.2659 12.2659 12.2851 12.2851 12.3145 12.3145 12.3487 12.3487 12.3700 12.3700 12.3842 12.3842 12.4346 12.4346 12.4429 12.4429 12.4618 12.4618 12.4905 12.4905 12.5487 12.5487 12.6186 12.6186 13.8074 13.8074 13.8107 13.8107 13.8494 13.8494 13.8535 13.8535 13.8734 13.8734 13.8871 13.8871 13.8997 13.8997 13.9042 13.9042 13.9164 13.9164 13.9299 13.9299 13.9629 13.9629 14.1370 14.1370 14.1551 14.1551 14.1863 14.1863 14.3490 14.3490 15.5757 15.5757 15.7759 15.7759 k = 0.3625 0.5000 0.3625 ( 6378 PWs) bands (ev): 3.0771 3.0771 3.9571 3.9571 4.2536 4.2536 4.5285 4.5285 4.5822 4.5822 7.0125 7.0125 7.1698 7.1698 7.3006 7.3006 9.1671 9.1671 9.2960 9.2960 9.3999 9.3999 9.4260 9.4260 9.5751 9.5751 9.5892 9.5892 9.6107 9.6107 9.6173 9.6173 10.1145 10.1145 10.3385 10.3385 10.6562 10.6562 10.9619 10.9619 11.0028 11.0028 11.0714 11.0714 11.1129 11.1129 11.2006 11.2006 11.2370 11.2370 11.2492 11.2492 11.2789 11.2789 11.3069 11.3069 11.3825 11.3825 11.5143 11.5143 11.5786 11.5786 11.6584 11.6584 11.7072 11.7072 12.0892 12.0892 12.1612 12.1612 12.2116 12.2116 12.2590 12.2590 12.2843 12.2843 12.3225 12.3225 12.3574 12.3574 12.3839 12.3839 12.3974 12.3974 12.4435 12.4435 12.4620 12.4620 12.4760 12.4760 12.5236 12.5236 12.5705 12.5705 12.6540 12.6540 13.7975 13.7975 13.8037 13.8037 13.8440 13.8440 13.8475 13.8475 13.8730 13.8730 13.8877 13.8877 13.9022 13.9022 13.9048 13.9048 13.9209 13.9209 13.9301 13.9301 13.9690 13.9690 14.1372 14.1372 14.1623 14.1623 14.2013 14.2013 14.3748 14.3748 15.4882 15.4882 15.6858 15.6858 k = 0.3500 0.5000 0.3500 ( 6374 PWs) bands (ev): 3.0249 3.0249 3.9202 3.9202 4.2751 4.2751 4.5363 4.5363 4.6392 4.6392 7.0423 7.0423 7.2242 7.2242 7.3694 7.3694 9.0901 9.0901 9.2590 9.2590 9.3766 9.3766 9.3825 9.3825 9.5579 9.5579 9.5893 9.5893 9.6115 9.6115 9.6227 9.6227 10.1112 10.1112 10.3288 10.3288 10.6732 10.6732 10.9243 10.9243 10.9811 10.9811 11.0873 11.0873 11.0986 11.0986 11.1958 11.1958 11.2296 11.2296 11.2593 11.2593 11.2856 11.2856 11.3277 11.3277 11.3620 11.3620 11.5063 11.5063 11.5752 11.5752 11.6753 11.6753 11.7221 11.7221 12.0827 12.0827 12.1526 12.1526 12.2063 12.2063 12.2496 12.2496 12.2844 12.2844 12.3316 12.3316 12.3669 12.3669 12.3970 12.3970 12.4126 12.4126 12.4518 12.4518 12.4822 12.4822 12.4934 12.4934 12.5583 12.5583 12.5935 12.5935 12.6904 12.6904 13.7851 13.7851 13.7959 13.7959 13.8341 13.8341 13.8425 13.8425 13.8728 13.8728 13.8870 13.8870 13.9039 13.9039 13.9095 13.9095 13.9258 13.9258 13.9308 13.9308 13.9761 13.9761 14.1371 14.1371 14.1706 14.1706 14.2183 14.2183 14.4033 14.4033 15.4025 15.4025 15.5952 15.5952 k = 0.3375 0.5000 0.3375 ( 6370 PWs) bands (ev): 2.9731 2.9731 3.8813 3.8813 4.2982 4.2982 4.5466 4.5466 4.6971 4.6971 7.0744 7.0744 7.2813 7.2813 7.4396 7.4396 9.0099 9.0099 9.2201 9.2201 9.3186 9.3186 9.3662 9.3662 9.5327 9.5327 9.6032 9.6032 9.6078 9.6078 9.6355 9.6355 10.1116 10.1116 10.3176 10.3176 10.6872 10.6872 10.8855 10.8855 10.9566 10.9566 11.0805 11.0805 11.1039 11.1039 11.1913 11.1913 11.2167 11.2167 11.2715 11.2715 11.2927 11.2927 11.3466 11.3466 11.3501 11.3501 11.4996 11.4996 11.5705 11.5705 11.6931 11.6931 11.7358 11.7358 12.0773 12.0773 12.1429 12.1429 12.1988 12.1988 12.2388 12.2388 12.2856 12.2856 12.3413 12.3413 12.3770 12.3770 12.4096 12.4096 12.4293 12.4293 12.4602 12.4602 12.5017 12.5017 12.5141 12.5141 12.5923 12.5923 12.6191 12.6191 12.7274 12.7274 13.7712 13.7712 13.7871 13.7871 13.8226 13.8226 13.8361 13.8361 13.8723 13.8723 13.8860 13.8860 13.9079 13.9079 13.9143 13.9143 13.9304 13.9304 13.9319 13.9319 13.9841 13.9841 14.1369 14.1369 14.1798 14.1798 14.2373 14.2373 14.4346 14.4346 15.3193 15.3193 15.5053 15.5053 k = 0.3250 0.5000 0.3250 ( 6376 PWs) bands (ev): 2.9221 2.9221 3.8407 3.8407 4.3229 4.3229 4.5593 4.5593 4.7557 4.7557 7.1089 7.1089 7.3406 7.3406 7.5102 7.5102 8.9274 8.9274 9.1792 9.1792 9.2551 9.2551 9.3515 9.3515 9.5102 9.5102 9.6054 9.6054 9.6180 9.6180 9.6491 9.6491 10.1153 10.1153 10.3047 10.3047 10.6987 10.6987 10.8458 10.8458 10.9314 10.9314 11.0653 11.0653 11.1130 11.1130 11.1871 11.1871 11.1981 11.1981 11.2848 11.2848 11.3000 11.3000 11.3367 11.3367 11.3734 11.3734 11.4944 11.4944 11.5644 11.5644 11.7117 11.7117 11.7485 11.7485 12.0732 12.0732 12.1324 12.1324 12.1895 12.1895 12.2271 12.2271 12.2880 12.2880 12.3516 12.3516 12.3874 12.3874 12.4219 12.4219 12.4462 12.4462 12.4697 12.4697 12.5207 12.5207 12.5366 12.5366 12.6214 12.6214 12.6507 12.6507 12.7645 12.7645 13.7563 13.7563 13.7774 13.7774 13.8101 13.8101 13.8283 13.8283 13.8705 13.8705 13.8863 13.8863 13.9131 13.9131 13.9191 13.9191 13.9332 13.9332 13.9349 13.9349 13.9926 13.9926 14.1371 14.1371 14.1898 14.1898 14.2581 14.2581 14.4683 14.4683 15.2389 15.2389 15.4173 15.4173 k = 0.3125 0.5000 0.3125 ( 6368 PWs) bands (ev): 2.8720 2.8720 3.7992 3.7992 4.3493 4.3493 4.5740 4.5740 4.8151 4.8151 7.1457 7.1457 7.4013 7.4013 7.5805 7.5805 8.8432 8.8432 9.1368 9.1368 9.1881 9.1881 9.3391 9.3391 9.4890 9.4890 9.6041 9.6041 9.6334 9.6334 9.6632 9.6632 10.1222 10.1222 10.2905 10.2905 10.7079 10.7079 10.8054 10.8054 10.9063 10.9063 11.0498 11.0498 11.1181 11.1181 11.1749 11.1749 11.1832 11.1832 11.2979 11.2979 11.3076 11.3076 11.3319 11.3319 11.3973 11.3973 11.4910 11.4910 11.5575 11.5575 11.7307 11.7307 11.7604 11.7604 12.0704 12.0704 12.1212 12.1212 12.1789 12.1789 12.2151 12.2151 12.2912 12.2912 12.3625 12.3625 12.3982 12.3982 12.4341 12.4341 12.4608 12.4608 12.4823 12.4823 12.5400 12.5400 12.5595 12.5595 12.6453 12.6453 12.6881 12.6881 12.8013 12.8013 13.7409 13.7409 13.7670 13.7670 13.7969 13.7969 13.8195 13.8195 13.8674 13.8674 13.8884 13.8884 13.9185 13.9185 13.9240 13.9240 13.9353 13.9353 13.9385 13.9385 14.0017 14.0017 14.1377 14.1377 14.2005 14.2005 14.2807 14.2807 14.5044 14.5044 15.1617 15.1617 15.3319 15.3319 k = 0.3000 0.5000 0.3000 ( 6378 PWs) bands (ev): 2.8229 2.8229 3.7570 3.7570 4.3771 4.3771 4.5906 4.5906 4.8752 4.8752 7.1848 7.1848 7.4630 7.4630 7.6497 7.6497 8.7579 8.7579 9.0929 9.0929 9.1191 9.1191 9.3293 9.3293 9.4686 9.4686 9.6034 9.6034 9.6491 9.6491 9.6779 9.6779 10.1320 10.1320 10.2748 10.2748 10.7153 10.7153 10.7645 10.7645 10.8815 10.8815 11.0343 11.0343 11.1196 11.1196 11.1484 11.1484 11.1796 11.1796 11.3099 11.3099 11.3154 11.3154 11.3308 11.3308 11.4209 11.4209 11.4895 11.4895 11.5498 11.5498 11.7483 11.7483 11.7733 11.7733 12.0689 12.0689 12.1095 12.1095 12.1677 12.1677 12.2033 12.2033 12.2953 12.2953 12.3738 12.3738 12.4092 12.4092 12.4465 12.4465 12.4715 12.4715 12.4995 12.4995 12.5592 12.5592 12.5820 12.5820 12.6666 12.6666 12.7277 12.7277 12.8373 12.8373 13.7252 13.7252 13.7561 13.7561 13.7831 13.7831 13.8097 13.8097 13.8633 13.8633 13.8917 13.8917 13.9233 13.9233 13.9290 13.9290 13.9382 13.9382 13.9414 13.9414 14.0108 14.0108 14.1390 14.1390 14.2119 14.2119 14.3049 14.3049 14.5427 14.5427 15.0879 15.0879 15.2500 15.2500 k = 0.2875 0.5000 0.2875 ( 6370 PWs) bands (ev): 2.7750 2.7750 3.7147 3.7147 4.4064 4.4064 4.6088 4.6088 4.9361 4.9361 7.2260 7.2260 7.5247 7.5247 7.7170 7.7170 8.6720 8.6720 9.0480 9.0480 9.0492 9.0492 9.3229 9.3229 9.4487 9.4487 9.6033 9.6033 9.6651 9.6651 9.6931 9.6931 10.1446 10.1446 10.2581 10.2581 10.7211 10.7211 10.7235 10.7235 10.8570 10.8570 11.0188 11.0188 11.1167 11.1167 11.1213 11.1213 11.1763 11.1763 11.3198 11.3198 11.3232 11.3232 11.3325 11.3325 11.4439 11.4439 11.4903 11.4903 11.5419 11.5419 11.7609 11.7609 11.7907 11.7907 12.0682 12.0682 12.0977 12.0977 12.1562 12.1562 12.1918 12.1918 12.3000 12.3000 12.3855 12.3855 12.4205 12.4205 12.4591 12.4591 12.4799 12.4799 12.5194 12.5194 12.5783 12.5783 12.6037 12.6037 12.6863 12.6863 12.7681 12.7681 12.8721 12.8721 13.7094 13.7094 13.7450 13.7450 13.7691 13.7691 13.7991 13.7991 13.8589 13.8589 13.8957 13.8957 13.9270 13.9270 13.9339 13.9339 13.9413 13.9413 13.9447 13.9447 14.0200 14.0200 14.1409 14.1409 14.2238 14.2238 14.3306 14.3306 14.5830 14.5830 15.0179 15.0179 15.1723 15.1723 k = 0.2750 0.5000 0.2750 ( 6360 PWs) bands (ev): 2.7285 2.7285 3.6726 3.6726 4.4370 4.4370 4.6284 4.6284 4.9976 4.9976 7.2693 7.2693 7.5857 7.5857 7.7815 7.7815 8.5858 8.5858 8.9790 8.9790 9.0022 9.0022 9.3203 9.3203 9.4296 9.4296 9.6034 9.6034 9.6809 9.6809 9.7087 9.7087 10.1598 10.1598 10.2403 10.2403 10.6826 10.6826 10.7258 10.7258 10.8331 10.8331 11.0034 11.0034 11.0896 11.0896 11.1146 11.1146 11.1734 11.1734 11.3276 11.3276 11.3298 11.3298 11.3367 11.3367 11.4655 11.4655 11.4931 11.4931 11.5343 11.5343 11.7675 11.7675 11.8133 11.8133 12.0676 12.0676 12.0865 12.0865 12.1447 12.1447 12.1810 12.1810 12.3052 12.3052 12.3974 12.3974 12.4321 12.4321 12.4717 12.4717 12.4878 12.4878 12.5401 12.5401 12.5971 12.5971 12.6242 12.6242 12.7050 12.7050 12.8083 12.8083 12.9053 12.9053 13.6937 13.6937 13.7339 13.7339 13.7549 13.7549 13.7878 13.7878 13.8542 13.8542 13.9003 13.9003 13.9299 13.9299 13.9376 13.9376 13.9439 13.9439 13.9497 13.9497 14.0291 14.0291 14.1437 14.1437 14.2361 14.2361 14.3575 14.3575 14.6249 14.6249 14.9521 14.9521 15.0995 15.0995 k = 0.2625 0.5000 0.2625 ( 6356 PWs) bands (ev): 2.6834 2.6834 3.6310 3.6310 4.4689 4.4689 4.6492 4.6492 5.0599 5.0599 7.3145 7.3145 7.6448 7.6448 7.8423 7.8423 8.4995 8.4995 8.9092 8.9092 8.9558 8.9558 9.3221 9.3221 9.4117 9.4117 9.6038 9.6038 9.6958 9.6958 9.7248 9.7248 10.1773 10.1773 10.2219 10.2219 10.6421 10.6421 10.7295 10.7295 10.8097 10.8097 10.9878 10.9878 11.0592 11.0592 11.1085 11.1085 11.1708 11.1708 11.3336 11.3336 11.3354 11.3354 11.3420 11.3420 11.4854 11.4854 11.4980 11.4980 11.5276 11.5276 11.7701 11.7701 11.8390 11.8390 12.0644 12.0644 12.0784 12.0784 12.1335 12.1335 12.1711 12.1711 12.3111 12.3111 12.4096 12.4096 12.4437 12.4437 12.4840 12.4840 12.4962 12.4962 12.5607 12.5607 12.6152 12.6152 12.6434 12.6434 12.7227 12.7227 12.8479 12.8479 12.9367 12.9367 13.6783 13.6783 13.7228 13.7228 13.7408 13.7408 13.7759 13.7759 13.8494 13.8494 13.9053 13.9053 13.9323 13.9323 13.9383 13.9383 13.9478 13.9478 13.9560 13.9560 14.0378 14.0378 14.1471 14.1471 14.2486 14.2486 14.3852 14.3852 14.6679 14.6679 14.8910 14.8910 15.0322 15.0322 k = 0.2500 0.5000 0.2500 ( 6364 PWs) bands (ev): 2.6399 2.6399 3.5901 3.5901 4.5019 4.5019 4.6710 4.6710 5.1230 5.1230 7.3617 7.3617 7.7009 7.7009 7.8989 7.8989 8.4136 8.4136 8.8408 8.8408 8.9090 8.9090 9.3287 9.3287 9.3953 9.3953 9.6043 9.6043 9.7093 9.7093 9.7417 9.7417 10.1968 10.1968 10.2030 10.2030 10.6027 10.6027 10.7324 10.7324 10.7867 10.7867 10.9721 10.9721 11.0285 11.0285 11.1007 11.1007 11.1685 11.1685 11.3377 11.3377 11.3412 11.3412 11.3467 11.3467 11.5027 11.5027 11.5037 11.5037 11.5239 11.5239 11.7694 11.7694 11.8663 11.8663 12.0559 12.0559 12.0759 12.0759 12.1229 12.1229 12.1624 12.1624 12.3175 12.3175 12.4218 12.4218 12.4553 12.4553 12.4951 12.4951 12.5064 12.5064 12.5806 12.5806 12.6326 12.6326 12.6611 12.6611 12.7394 12.7394 12.8865 12.8865 12.9660 12.9660 13.6632 13.6632 13.7120 13.7120 13.7268 13.7268 13.7636 13.7636 13.8446 13.8446 13.9104 13.9104 13.9341 13.9341 13.9372 13.9372 13.9527 13.9527 13.9625 13.9625 14.0462 14.0462 14.1511 14.1511 14.2612 14.2612 14.4131 14.4131 14.7091 14.7091 14.8375 14.8375 14.9716 14.9716 k = 0.2375 0.5000 0.2375 ( 6354 PWs) bands (ev): 2.5981 2.5981 3.5503 3.5503 4.5360 4.5360 4.6937 4.6937 5.1867 5.1867 7.4107 7.4107 7.7526 7.7526 7.9505 7.9505 8.3284 8.3284 8.7746 8.7746 8.8620 8.8620 9.3406 9.3406 9.3811 9.3811 9.6050 9.6050 9.7204 9.7204 9.7596 9.7596 10.1839 10.1839 10.2183 10.2183 10.5649 10.5649 10.7348 10.7348 10.7644 10.7644 10.9561 10.9561 10.9978 10.9978 11.0914 11.0914 11.1665 11.1665 11.3400 11.3400 11.3469 11.3469 11.3508 11.3508 11.5063 11.5063 11.5171 11.5171 11.5281 11.5281 11.7660 11.7660 11.8941 11.8941 12.0451 12.0451 12.0759 12.0759 12.1130 12.1130 12.1553 12.1553 12.3246 12.3246 12.4342 12.4342 12.4669 12.4669 12.5052 12.5052 12.5186 12.5186 12.5995 12.5995 12.6491 12.6491 12.6773 12.6773 12.7552 12.7552 12.9238 12.9238 12.9929 12.9929 13.6486 13.6486 13.7014 13.7014 13.7131 13.7131 13.7512 13.7512 13.8399 13.8399 13.9158 13.9158 13.9328 13.9328 13.9382 13.9382 13.9580 13.9580 13.9690 13.9690 14.0542 14.0542 14.1557 14.1557 14.2739 14.2739 14.4401 14.4401 14.7321 14.7321 14.8079 14.8079 14.9187 14.9187 k = 0.2250 0.5000 0.2250 ( 6366 PWs) bands (ev): 2.5580 2.5580 3.5116 3.5116 4.5710 4.5710 4.7169 4.7169 5.2512 5.2512 7.4613 7.4613 7.7979 7.7979 7.9966 7.9966 8.2440 8.2440 8.7120 8.7120 8.8151 8.8151 9.3579 9.3579 9.3696 9.3696 9.6057 9.6057 9.7282 9.7282 9.7785 9.7785 10.1647 10.1647 10.2413 10.2413 10.5292 10.5292 10.7352 10.7352 10.7440 10.7440 10.9393 10.9393 10.9677 10.9677 11.0808 11.0808 11.1648 11.1648 11.3394 11.3394 11.3524 11.3524 11.3549 11.3549 11.5058 11.5058 11.5294 11.5294 11.5392 11.5392 11.7599 11.7599 11.9207 11.9207 12.0341 12.0341 12.0765 12.0765 12.1039 12.1039 12.1505 12.1505 12.3323 12.3323 12.4463 12.4463 12.4781 12.4781 12.5151 12.5151 12.5322 12.5322 12.6169 12.6169 12.6646 12.6646 12.6916 12.6916 12.7701 12.7701 12.9594 12.9594 13.0173 13.0173 13.6345 13.6345 13.6908 13.6908 13.6999 13.6999 13.7387 13.7387 13.8352 13.8352 13.9206 13.9206 13.9298 13.9298 13.9408 13.9408 13.9633 13.9633 13.9752 13.9752 14.0615 14.0615 14.1605 14.1605 14.2865 14.2865 14.4646 14.4646 14.7055 14.7055 14.8332 14.8332 14.8753 14.8753 k = 0.2125 0.5000 0.2125 ( 6370 PWs) bands (ev): 2.5197 2.5197 3.4743 3.4743 4.6067 4.6067 4.7405 4.7405 5.3163 5.3163 7.5135 7.5135 7.8348 7.8348 8.0370 8.0370 8.1609 8.1609 8.6545 8.6545 8.7686 8.7686 9.3610 9.3610 9.3809 9.3809 9.6064 9.6064 9.7322 9.7322 9.7984 9.7984 10.1458 10.1458 10.2656 10.2656 10.4967 10.4967 10.7193 10.7193 10.7401 10.7401 10.9205 10.9205 10.9395 10.9395 11.0692 11.0692 11.1633 11.1633 11.3356 11.3356 11.3578 11.3578 11.3595 11.3595 11.5058 11.5058 11.5423 11.5423 11.5511 11.5511 11.7516 11.7516 11.9441 11.9441 12.0236 12.0236 12.0775 12.0775 12.0955 12.0955 12.1493 12.1493 12.3406 12.3406 12.4582 12.4582 12.4890 12.4890 12.5255 12.5255 12.5464 12.5464 12.6326 12.6326 12.6791 12.6791 12.7044 12.7044 12.7843 12.7843 12.9932 12.9932 13.0390 13.0390 13.6210 13.6210 13.6802 13.6802 13.6876 13.6876 13.7266 13.7266 13.8308 13.8308 13.9217 13.9217 13.9297 13.9297 13.9439 13.9439 13.9686 13.9686 13.9808 13.9808 14.0682 14.0682 14.1654 14.1654 14.2988 14.2988 14.4846 14.4846 14.6632 14.6632 14.8426 14.8426 14.8789 14.8789 k = 0.2000 0.5000 0.2000 ( 6370 PWs) bands (ev): 2.4832 2.4832 3.4385 3.4385 4.6431 4.6431 4.7644 4.7644 5.3821 5.3821 7.5670 7.5670 7.8609 7.8609 8.0715 8.0715 8.0794 8.0794 8.6040 8.6040 8.7228 8.7228 9.3564 9.3564 9.4088 9.4088 9.6071 9.6071 9.7314 9.7314 9.8190 9.8190 10.1275 10.1275 10.2912 10.2912 10.4679 10.4679 10.6983 10.6983 10.7415 10.7415 10.8968 10.8968 10.9162 10.9162 11.0571 11.0571 11.1623 11.1623 11.3288 11.3288 11.3629 11.3629 11.3647 11.3647 11.5076 11.5076 11.5556 11.5556 11.5626 11.5626 11.7411 11.7411 11.9618 11.9618 12.0137 12.0137 12.0783 12.0783 12.0877 12.0877 12.1542 12.1542 12.3496 12.3496 12.4698 12.4698 12.4996 12.4996 12.5367 12.5367 12.5610 12.5610 12.6465 12.6465 12.6927 12.6927 12.7155 12.7155 12.7976 12.7976 13.0248 13.0248 13.0581 13.0581 13.6083 13.6083 13.6692 13.6692 13.6761 13.6761 13.7152 13.7152 13.8265 13.8265 13.9176 13.9176 13.9342 13.9342 13.9475 13.9475 13.9739 13.9739 13.9855 13.9855 14.0741 14.0741 14.1703 14.1703 14.3109 14.3109 14.4972 14.4972 14.6212 14.6212 14.8152 14.8152 14.8282 14.8282 k = 0.1875 0.5000 0.1875 ( 6378 PWs) bands (ev): 2.4488 2.4488 3.4044 3.4044 4.6797 4.6797 4.7883 4.7883 5.4483 5.4483 7.6217 7.6217 7.8737 7.8737 7.9996 7.9996 8.1005 8.1005 8.5624 8.5624 8.6778 8.6778 9.3559 9.3559 9.4414 9.4414 9.6079 9.6079 9.7254 9.7254 9.8403 9.8403 10.1099 10.1099 10.3176 10.3176 10.4436 10.4436 10.6773 10.6773 10.7431 10.7431 10.8687 10.8687 10.8974 10.8974 11.0445 11.0445 11.1613 11.1613 11.3196 11.3196 11.3675 11.3675 11.3704 11.3704 11.5113 11.5113 11.5672 11.5672 11.5752 11.5752 11.7289 11.7289 11.9721 11.9721 12.0044 12.0044 12.0773 12.0773 12.0802 12.0802 12.1678 12.1678 12.3589 12.3589 12.4808 12.4808 12.5101 12.5101 12.5487 12.5487 12.5757 12.5757 12.6584 12.6584 12.7053 12.7053 12.7249 12.7249 12.8101 12.8101 13.0539 13.0539 13.0750 13.0750 13.5963 13.5963 13.6578 13.6578 13.6652 13.6652 13.7049 13.7049 13.8225 13.8225 13.9123 13.9123 13.9394 13.9394 13.9517 13.9517 13.9791 13.9791 13.9891 13.9891 14.0792 14.0792 14.1752 14.1752 14.3225 14.3225 14.5007 14.5007 14.5815 14.5815 14.7465 14.7465 14.8241 14.8241 k = 0.1750 0.5000 0.1750 ( 6382 PWs) bands (ev): 2.4163 2.4163 3.3720 3.3720 4.7166 4.7166 4.8120 4.8120 5.5150 5.5150 7.6774 7.6774 7.8715 7.8715 7.9221 7.9221 8.1241 8.1241 8.5312 8.5312 8.6340 8.6340 9.3600 9.3600 9.4778 9.4778 9.6086 9.6086 9.7136 9.7136 9.8621 9.8621 10.0935 10.0935 10.3446 10.3446 10.4244 10.4244 10.6566 10.6566 10.7447 10.7447 10.8393 10.8393 10.8800 10.8800 11.0318 11.0318 11.1606 11.1606 11.3085 11.3085 11.3720 11.3720 11.3762 11.3762 11.5167 11.5167 11.5758 11.5758 11.5900 11.5900 11.7153 11.7153 11.9760 11.9760 11.9960 11.9960 12.0723 12.0723 12.0738 12.0738 12.1907 12.1907 12.3685 12.3685 12.4912 12.4912 12.5207 12.5207 12.5612 12.5612 12.5904 12.5904 12.6684 12.6684 12.7169 12.7169 12.7329 12.7329 12.8218 12.8218 13.0787 13.0787 13.0913 13.0913 13.5850 13.5850 13.6466 13.6466 13.6541 13.6541 13.6962 13.6962 13.8187 13.8187 13.9069 13.9069 13.9446 13.9446 13.9563 13.9563 13.9840 13.9840 13.9913 13.9913 14.0836 14.0836 14.1799 14.1799 14.3336 14.3336 14.4956 14.4956 14.5448 14.5448 14.6785 14.6785 14.8368 14.8368 k = 0.1625 0.5000 0.1625 ( 6392 PWs) bands (ev): 2.3858 2.3858 3.3415 3.3415 4.7534 4.7534 4.8354 4.8354 5.5820 5.5820 7.7339 7.7339 7.8465 7.8465 7.8545 7.8545 8.1429 8.1429 8.5103 8.5103 8.5916 8.5916 9.3686 9.3686 9.5173 9.5173 9.6093 9.6093 9.6958 9.6958 9.8842 9.8842 10.0783 10.0783 10.3721 10.3721 10.4106 10.4106 10.6362 10.6362 10.7462 10.7462 10.8099 10.8099 10.8627 10.8627 11.0193 11.0193 11.1601 11.1601 11.2961 11.2961 11.3764 11.3764 11.3820 11.3820 11.5235 11.5235 11.5825 11.5825 11.6057 11.6057 11.7007 11.7007 11.9751 11.9751 11.9883 11.9883 12.0647 12.0647 12.0669 12.0669 12.2206 12.2206 12.3780 12.3780 12.5011 12.5011 12.5315 12.5315 12.5740 12.5740 12.6050 12.6050 12.6767 12.6767 12.7277 12.7277 12.7396 12.7396 12.8326 12.8326 13.0946 13.0946 13.1116 13.1116 13.5746 13.5746 13.6358 13.6358 13.6426 13.6426 13.6891 13.6891 13.8152 13.8152 13.9014 13.9014 13.9497 13.9497 13.9613 13.9613 13.9880 13.9880 13.9922 13.9922 14.0870 14.0870 14.1843 14.1843 14.3440 14.3440 14.4844 14.4844 14.5110 14.5110 14.6137 14.6137 14.8612 14.8612 k = 0.1500 0.5000 0.1500 ( 6372 PWs) bands (ev): 2.3574 2.3574 3.3130 3.3130 4.7899 4.7899 4.8583 4.8583 5.6491 5.6491 7.7742 7.7742 7.7911 7.7911 7.8227 7.8227 8.1575 8.1575 8.4984 8.4984 8.5509 8.5509 9.3818 9.3818 9.5585 9.5585 9.6099 9.6099 9.6723 9.6723 9.9065 9.9065 10.0650 10.0650 10.3997 10.3997 10.4021 10.4021 10.6161 10.6161 10.7476 10.7476 10.7808 10.7808 10.8455 10.8455 11.0072 11.0072 11.1598 11.1598 11.2827 11.2827 11.3808 11.3808 11.3876 11.3876 11.5315 11.5315 11.5880 11.5880 11.6213 11.6213 11.6856 11.6856 11.9715 11.9715 11.9815 11.9815 12.0567 12.0567 12.0586 12.0586 12.2547 12.2547 12.3873 12.3873 12.5107 12.5107 12.5426 12.5426 12.5870 12.5870 12.6196 12.6196 12.6837 12.6837 12.7378 12.7378 12.7451 12.7451 12.8423 12.8423 13.1044 13.1044 13.1335 13.1335 13.5651 13.5651 13.6257 13.6257 13.6307 13.6307 13.6837 13.6837 13.8119 13.8119 13.8962 13.8962 13.9549 13.9549 13.9665 13.9665 13.9877 13.9877 13.9950 13.9950 14.0896 14.0896 14.1885 14.1885 14.3537 14.3537 14.4697 14.4697 14.4805 14.4805 14.5533 14.5533 14.8730 14.8730 k = 0.1375 0.5000 0.1375 ( 6382 PWs) bands (ev): 2.3312 2.3312 3.2865 3.2865 4.8256 4.8256 4.8803 4.8803 5.7160 5.7160 7.7056 7.7056 7.7800 7.7800 7.8480 7.8480 8.1684 8.1684 8.4931 8.4931 8.5123 8.5123 9.3993 9.3993 9.6003 9.6003 9.6105 9.6105 9.6433 9.6433 9.9289 9.9289 10.0537 10.0537 10.3984 10.3984 10.4270 10.4270 10.5965 10.5965 10.7478 10.7478 10.7533 10.7533 10.8281 10.8281 10.9956 10.9956 11.1596 11.1596 11.2688 11.2688 11.3852 11.3852 11.3930 11.3930 11.5402 11.5402 11.5925 11.5925 11.6365 11.6365 11.6701 11.6701 11.9661 11.9661 11.9754 11.9754 12.0474 12.0474 12.0502 12.0502 12.2909 12.2909 12.3958 12.3958 12.5199 12.5199 12.5536 12.5536 12.5997 12.5997 12.6338 12.6338 12.6895 12.6895 12.7471 12.7471 12.7496 12.7496 12.8507 12.8507 13.1112 13.1112 13.1538 13.1538 13.5564 13.5564 13.6161 13.6161 13.6185 13.6185 13.6797 13.6797 13.8089 13.8089 13.8914 13.8914 13.9600 13.9600 13.9710 13.9710 13.9832 13.9832 13.9993 13.9993 14.0912 14.0912 14.1925 14.1925 14.3622 14.3622 14.4492 14.4492 14.4569 14.4569 14.4983 14.4983 14.8179 14.8179 k = 0.1250 0.5000 0.1250 ( 6380 PWs) bands (ev): 2.3071 2.3071 3.2621 3.2621 4.8604 4.8604 4.9014 4.9014 5.7825 5.7825 7.6403 7.6403 7.7292 7.7292 7.9047 7.9047 8.1763 8.1763 8.4752 8.4752 8.4927 8.4927 9.4204 9.4204 9.6091 9.6091 9.6116 9.6116 9.6416 9.6416 9.9511 9.9511 10.0451 10.0451 10.3989 10.3989 10.4534 10.4534 10.5777 10.5777 10.7238 10.7238 10.7510 10.7510 10.8107 10.8107 10.9846 10.9846 11.1596 11.1596 11.2547 11.2547 11.3894 11.3894 11.3979 11.3979 11.5493 11.5493 11.5961 11.5961 11.6505 11.6505 11.6552 11.6552 11.9599 11.9599 11.9700 11.9700 12.0369 12.0369 12.0424 12.0424 12.3276 12.3276 12.4036 12.4036 12.5290 12.5290 12.5645 12.5645 12.6119 12.6119 12.6476 12.6476 12.6947 12.6947 12.7528 12.7528 12.7563 12.7563 12.8576 12.8576 13.1159 13.1159 13.1721 13.1721 13.5486 13.5486 13.6065 13.6065 13.6072 13.6072 13.6766 13.6766 13.8061 13.8061 13.8870 13.8870 13.9647 13.9647 13.9698 13.9698 13.9809 13.9809 14.0036 14.0036 14.0922 14.0922 14.1963 14.1963 14.3691 14.3691 14.4239 14.4239 14.4372 14.4372 14.4534 14.4534 14.7675 14.7675 k = 0.1125 0.5000 0.1125 ( 6376 PWs) bands (ev): 2.2853 2.2853 3.2398 3.2398 4.8938 4.8938 4.9212 4.9212 5.8481 5.8481 7.5791 7.5791 7.6731 7.6731 7.9607 7.9607 8.1819 8.1819 8.4414 8.4414 8.4937 8.4937 9.4443 9.4443 9.5727 9.5727 9.6115 9.6115 9.6806 9.6806 9.9730 9.9730 10.0397 10.0397 10.4027 10.4027 10.4778 10.4778 10.5607 10.5607 10.6969 10.6969 10.7524 10.7524 10.7934 10.7934 10.9747 10.9747 11.1595 11.1595 11.2406 11.2406 11.3935 11.3935 11.4023 11.4023 11.5584 11.5584 11.5991 11.5991 11.6398 11.6398 11.6646 11.6646 11.9532 11.9532 11.9652 11.9652 12.0261 12.0261 12.0348 12.0348 12.3636 12.3636 12.4106 12.4106 12.5380 12.5380 12.5753 12.5753 12.6236 12.6236 12.6611 12.6611 12.6997 12.6997 12.7557 12.7557 12.7649 12.7649 12.8628 12.8628 13.1191 13.1191 13.1885 13.1885 13.5417 13.5417 13.5948 13.5948 13.5991 13.5991 13.6743 13.6743 13.8034 13.8034 13.8831 13.8831 13.9565 13.9565 13.9708 13.9708 13.9848 13.9848 14.0076 14.0076 14.0924 14.0924 14.2000 14.2000 14.3726 14.3726 14.4000 14.4000 14.4042 14.4042 14.4328 14.4328 14.7229 14.7229 k = 0.1000 0.5000 0.1000 ( 6388 PWs) bands (ev): 2.2656 2.2656 3.2198 3.2198 4.9254 4.9254 4.9397 4.9397 5.9122 5.9122 7.5224 7.5224 7.6142 7.6142 8.0154 8.0154 8.1855 8.1855 8.4102 8.4102 8.4957 8.4957 9.4700 9.4700 9.5335 9.5335 9.6119 9.6119 9.7159 9.7159 9.9943 9.9943 10.0380 10.0380 10.4090 10.4090 10.4968 10.4968 10.5486 10.5486 10.6710 10.6710 10.7537 10.7537 10.7761 10.7761 10.9656 10.9656 11.1596 11.1596 11.2268 11.2268 11.3975 11.3975 11.4061 11.4061 11.5671 11.5671 11.6014 11.6014 11.6259 11.6259 11.6768 11.6768 11.9465 11.9465 11.9608 11.9608 12.0157 12.0157 12.0276 12.0276 12.3963 12.3963 12.4181 12.4181 12.5467 12.5467 12.5854 12.5854 12.6341 12.6341 12.6740 12.6740 12.7047 12.7047 12.7580 12.7580 12.7735 12.7735 12.8663 12.8663 13.1208 13.1208 13.2027 13.2027 13.5356 13.5356 13.5835 13.5835 13.5918 13.5918 13.6726 13.6726 13.8010 13.8010 13.8797 13.8797 13.9388 13.9388 13.9759 13.9759 13.9895 13.9895 14.0113 14.0113 14.0919 14.0919 14.2037 14.2037 14.3588 14.3588 14.3782 14.3782 14.3872 14.3872 14.4208 14.4208 14.6841 14.6841 k = 0.0875 0.5000 0.0875 ( 6388 PWs) bands (ev): 2.2482 2.2482 3.2021 3.2021 4.9547 4.9547 4.9567 4.9567 5.9742 5.9742 7.4708 7.4708 7.5547 7.5547 8.0680 8.0680 8.1877 8.1877 8.3819 8.3819 8.4977 8.4977 9.4931 9.4931 9.4967 9.4967 9.6123 9.6123 9.7463 9.7463 10.0144 10.0144 10.0408 10.0408 10.4168 10.4168 10.5012 10.5012 10.5506 10.5506 10.6465 10.6465 10.7546 10.7546 10.7595 10.7595 10.9574 10.9574 11.1597 11.1597 11.2137 11.2137 11.4011 11.4011 11.4092 11.4092 11.5751 11.5751 11.6032 11.6032 11.6132 11.6132 11.6877 11.6877 11.9399 11.9399 11.9569 11.9569 12.0060 12.0060 12.0210 12.0210 12.4149 12.4149 12.4363 12.4363 12.5551 12.5551 12.5950 12.5950 12.6435 12.6435 12.6860 12.6860 12.7104 12.7104 12.7599 12.7599 12.7823 12.7823 12.8680 12.8680 13.1216 13.1216 13.2149 13.2149 13.5306 13.5306 13.5732 13.5732 13.5853 13.5853 13.6713 13.6713 13.7988 13.7988 13.8768 13.8768 13.9170 13.9170 13.9810 13.9810 13.9941 13.9941 14.0147 14.0147 14.0909 14.0909 14.2076 14.2076 14.3329 14.3329 14.3580 14.3580 14.3869 14.3869 14.4117 14.4117 14.6512 14.6512 k = 0.0750 0.5000 0.0750 ( 6388 PWs) bands (ev): 2.2331 2.2331 3.1866 3.1866 4.9715 4.9715 4.9817 4.9817 6.0331 6.0331 7.4247 7.4247 7.4965 7.4965 8.1177 8.1177 8.1889 8.1889 8.3569 8.3569 8.4994 8.4994 9.4534 9.4534 9.5227 9.5227 9.6126 9.6126 9.7709 9.7709 10.0328 10.0328 10.0484 10.0484 10.4254 10.4254 10.4917 10.4917 10.5657 10.5657 10.6237 10.6237 10.7426 10.7426 10.7564 10.7564 10.9504 10.9504 11.1598 11.1598 11.2015 11.2015 11.4044 11.4044 11.4116 11.4116 11.5820 11.5820 11.6012 11.6012 11.6059 11.6059 11.6972 11.6972 11.9337 11.9337 11.9533 11.9533 11.9974 11.9974 12.0151 12.0151 12.4202 12.4202 12.4636 12.4636 12.5631 12.5631 12.6038 12.6038 12.6516 12.6516 12.6966 12.6966 12.7172 12.7172 12.7616 12.7616 12.7912 12.7912 12.8678 12.8678 13.1217 13.1217 13.2251 13.2251 13.5264 13.5264 13.5638 13.5638 13.5796 13.5796 13.6701 13.6701 13.7968 13.7968 13.8745 13.8745 13.8926 13.8926 13.9858 13.9858 13.9983 13.9983 14.0178 14.0178 14.0895 14.0895 14.2119 14.2119 14.3113 14.3113 14.3395 14.3395 14.3862 14.3862 14.4055 14.4055 14.6241 14.6241 k = 0.0625 0.5000 0.0625 ( 6406 PWs) bands (ev): 2.2203 2.2203 3.1735 3.1735 4.9846 4.9846 5.0053 5.0053 6.0877 6.0877 7.3846 7.3846 7.4415 7.4415 8.1633 8.1633 8.1893 8.1893 8.3353 8.3353 8.5006 8.5006 9.4155 9.4155 9.5472 9.5472 9.6129 9.6129 9.7894 9.7894 10.0488 10.0488 10.0604 10.0604 10.4339 10.4339 10.4788 10.4788 10.5834 10.5834 10.6030 10.6030 10.7275 10.7275 10.7574 10.7574 10.9445 10.9445 11.1597 11.1597 11.1904 11.1904 11.4074 11.4074 11.4132 11.4132 11.5860 11.5860 11.5940 11.5940 11.6068 11.6068 11.7052 11.7052 11.9280 11.9280 11.9500 11.9500 11.9900 11.9900 12.0100 12.0100 12.4230 12.4230 12.4886 12.4886 12.5702 12.5702 12.6116 12.6116 12.6582 12.6582 12.7053 12.7053 12.7255 12.7255 12.7631 12.7631 12.8001 12.8001 12.8659 12.8659 13.1213 13.1213 13.2335 13.2335 13.5232 13.5232 13.5555 13.5555 13.5747 13.5747 13.6691 13.6691 13.7951 13.7951 13.8671 13.8671 13.8728 13.8728 13.9902 13.9902 14.0019 14.0019 14.0204 14.0204 14.0878 14.0878 14.2166 14.2166 14.2948 14.2948 14.3225 14.3225 14.3834 14.3834 14.4017 14.4017 14.6026 14.6026 k = 0.0500 0.5000 0.0500 ( 6408 PWs) bands (ev): 2.2098 2.2098 3.1627 3.1627 4.9955 4.9955 5.0254 5.0254 6.1366 6.1366 7.3510 7.3510 7.3918 7.3918 8.1894 8.1894 8.2036 8.2036 8.3175 8.3175 8.5015 8.5015 9.3809 9.3809 9.5691 9.5691 9.6132 9.6132 9.8025 9.8025 10.0629 10.0629 10.0742 10.0742 10.4418 10.4418 10.4665 10.4665 10.5850 10.5850 10.5998 10.5998 10.7139 10.7139 10.7582 10.7582 10.9396 10.9396 11.1595 11.1595 11.1809 11.1809 11.4099 11.4099 11.4141 11.4141 11.5818 11.5818 11.5952 11.5952 11.6082 11.6082 11.7117 11.7117 11.9231 11.9231 11.9470 11.9470 11.9840 11.9840 12.0059 12.0059 12.4247 12.4247 12.5096 12.5096 12.5764 12.5764 12.6183 12.6183 12.6634 12.6634 12.7118 12.7118 12.7347 12.7347 12.7647 12.7647 12.8088 12.8088 12.8625 12.8625 13.1208 13.1208 13.2402 13.2402 13.5208 13.5208 13.5485 13.5485 13.5706 13.5706 13.6681 13.6681 13.7936 13.7936 13.8430 13.8430 13.8712 13.8712 13.9941 13.9941 14.0049 14.0049 14.0227 14.0227 14.0863 14.0863 14.2219 14.2219 14.2829 14.2829 14.3072 14.3072 14.3796 14.3796 14.3994 14.3994 14.5864 14.5864 k = 0.0375 0.5000 0.0375 ( 6424 PWs) bands (ev): 2.2016 2.2016 3.1543 3.1543 5.0041 5.0041 5.0415 5.0415 6.1779 6.1779 7.3244 7.3244 7.3496 7.3496 8.1892 8.1892 8.2371 8.2371 8.3036 8.3036 8.5019 8.5019 9.3516 9.3516 9.5872 9.5872 9.6137 9.6137 9.8111 9.8111 10.0755 10.0755 10.0870 10.0870 10.4484 10.4484 10.4559 10.4559 10.5701 10.5701 10.6135 10.6135 10.7022 10.7022 10.7589 10.7589 10.9358 10.9358 11.1590 11.1590 11.1734 11.1734 11.4119 11.4119 11.4146 11.4146 11.5761 11.5761 11.5981 11.5981 11.6095 11.6095 11.7168 11.7168 11.9191 11.9191 11.9443 11.9443 11.9793 11.9793 12.0026 12.0026 12.4258 12.4258 12.5260 12.5260 12.5815 12.5815 12.6237 12.6237 12.6674 12.6674 12.7165 12.7165 12.7437 12.7437 12.7667 12.7667 12.8168 12.8168 12.8580 12.8580 13.1202 13.1202 13.2453 13.2453 13.5192 13.5192 13.5429 13.5429 13.5672 13.5672 13.6672 13.6672 13.7923 13.7923 13.8219 13.8219 13.8701 13.8701 13.9973 13.9973 14.0071 14.0071 14.0246 14.0246 14.0848 14.0848 14.2277 14.2277 14.2744 14.2744 14.2936 14.2936 14.3758 14.3758 14.3975 14.3975 14.5747 14.5747 k = 0.0250 0.5000 0.0250 ( 6412 PWs) bands (ev): 2.1957 2.1957 3.1483 3.1483 5.0104 5.0104 5.0533 5.0533 6.2095 6.2095 7.3051 7.3051 7.3171 7.3171 8.1890 8.1890 8.2620 8.2620 8.2941 8.2941 8.5022 8.5022 9.3290 9.3290 9.6003 9.6003 9.6145 9.6145 9.8164 9.8164 10.0858 10.0858 10.0972 10.0972 10.4479 10.4479 10.4535 10.4535 10.5589 10.5589 10.6237 10.6237 10.6934 10.6934 10.7594 10.7594 10.9332 10.9332 11.1582 11.1582 11.1685 11.1685 11.4134 11.4134 11.4147 11.4147 11.5721 11.5721 11.6002 11.6002 11.6108 11.6108 11.7204 11.7204 11.9163 11.9163 11.9424 11.9424 11.9761 11.9761 12.0004 12.0004 12.4266 12.4266 12.5378 12.5378 12.5852 12.5852 12.6276 12.6276 12.6701 12.6701 12.7198 12.7198 12.7506 12.7506 12.7694 12.7694 12.8235 12.8235 12.8535 12.8535 13.1198 13.1198 13.2489 13.2489 13.5183 13.5183 13.5388 13.5388 13.5649 13.5649 13.6663 13.6663 13.7913 13.7913 13.8057 13.8057 13.8693 13.8693 13.9998 13.9998 14.0087 14.0087 14.0260 14.0260 14.0836 14.0836 14.2341 14.2341 14.2685 14.2685 14.2821 14.2821 14.3729 14.3729 14.3961 14.3961 14.5671 14.5671 k = 0.0125 0.5000 0.0125 ( 6416 PWs) bands (ev): 2.1922 2.1922 3.1446 3.1446 5.0142 5.0142 5.0605 5.0605 6.2295 6.2295 7.2934 7.2934 7.2965 7.2965 8.1888 8.1888 8.2757 8.2757 8.2902 8.2902 8.5023 8.5023 9.3148 9.3148 9.6073 9.6073 9.6161 9.6161 9.8191 9.8191 10.0924 10.0924 10.1037 10.1037 10.4429 10.4429 10.4567 10.4567 10.5520 10.5520 10.6301 10.6301 10.6878 10.6878 10.7597 10.7597 10.9316 10.9316 11.1570 11.1570 11.1660 11.1660 11.4142 11.4142 11.4147 11.4147 11.5696 11.5696 11.6013 11.6013 11.6116 11.6116 11.7226 11.7226 11.9146 11.9146 11.9412 11.9412 11.9742 11.9742 11.9991 11.9991 12.4269 12.4269 12.5448 12.5448 12.5875 12.5875 12.6301 12.6301 12.6717 12.6717 12.7218 12.7218 12.7545 12.7545 12.7721 12.7721 12.8278 12.8278 12.8499 12.8499 13.1194 13.1194 13.2511 13.2511 13.5179 13.5179 13.5363 13.5363 13.5635 13.5635 13.6657 13.6657 13.7899 13.7899 13.7962 13.7962 13.8689 13.8689 14.0013 14.0013 14.0095 14.0095 14.0269 14.0269 14.0829 14.0829 14.2404 14.2404 14.2640 14.2640 14.2740 14.2740 14.3710 14.3710 14.3951 14.3951 14.5628 14.5628 k = 0.0000 0.5000-0.0000 ( 6432 PWs) bands (ev): 2.1910 2.1910 3.1434 3.1434 5.0155 5.0155 5.0629 5.0629 6.2363 6.2363 7.2892 7.2892 7.2897 7.2897 8.1886 8.1886 8.2784 8.2784 8.2908 8.2908 8.5023 8.5023 9.3099 9.3099 9.6089 9.6089 9.6173 9.6173 9.8200 9.8200 10.0946 10.0946 10.1059 10.1059 10.4411 10.4411 10.4578 10.4578 10.5496 10.5496 10.6322 10.6322 10.6858 10.6858 10.7598 10.7598 10.9310 10.9310 11.1564 11.1564 11.1653 11.1653 11.4144 11.4144 11.4148 11.4148 11.5687 11.5687 11.6016 11.6016 11.6119 11.6119 11.7233 11.7233 11.9140 11.9140 11.9407 11.9407 11.9735 11.9735 11.9987 11.9987 12.4270 12.4270 12.5471 12.5471 12.5883 12.5883 12.6309 12.6309 12.6723 12.6723 12.7224 12.7224 12.7557 12.7557 12.7734 12.7734 12.8293 12.8293 12.8484 12.8484 13.1193 13.1193 13.2518 13.2518 13.5177 13.5177 13.5354 13.5354 13.5630 13.5630 13.6655 13.6655 13.7886 13.7886 13.7938 13.7938 13.8687 13.8687 14.0017 14.0017 14.0095 14.0095 14.0270 14.0270 14.0825 14.0825 14.2437 14.2437 14.2613 14.2613 14.2712 14.2712 14.3703 14.3703 14.3947 14.3947 14.5615 14.5615 k = 0.5000 0.5000-0.0000 ( 6304 PWs) bands (ev): 2.7891 2.7891 3.8457 3.8457 3.8493 3.8493 4.2278 4.2278 5.9136 5.9136 7.6611 7.6611 7.9327 7.9327 7.9330 7.9330 7.9452 7.9452 9.0944 9.0944 9.1008 9.1008 9.1010 9.1010 9.4907 9.4907 9.5155 9.5155 9.5158 9.5158 9.9131 9.9131 10.0246 10.0246 10.0331 10.0331 10.1349 10.1349 10.6651 10.6651 10.8006 10.8006 10.8083 10.8083 11.1838 11.1838 11.1942 11.1942 11.2421 11.2421 11.2729 11.2729 11.2930 11.2930 11.3341 11.3341 11.4904 11.4904 11.5047 11.5047 11.7742 11.7742 11.7896 11.7896 11.7900 11.7900 12.1050 12.1050 12.1336 12.1336 12.1483 12.1483 12.1562 12.1562 12.1743 12.1743 12.2116 12.2116 12.4274 12.4274 12.4516 12.4516 12.4926 12.4926 12.6433 12.6433 12.6768 12.6768 12.7745 12.7745 12.7842 12.7842 12.7993 12.7993 13.3022 13.3022 13.5288 13.5288 13.5345 13.5345 13.7474 13.7474 13.8281 13.8281 13.8427 13.8427 13.8496 13.8496 13.9817 13.9817 14.0092 14.0092 14.0898 14.0898 14.0992 14.0992 14.2381 14.2381 14.2657 14.2657 14.5629 14.5629 14.6669 14.6669 14.6813 14.6813 14.8630 14.8630 14.8676 14.8676 k = 0.5000 0.5000 0.0179 ( 6352 PWs) bands (ev): 2.7903 2.7903 3.8464 3.8464 3.8501 3.8501 4.2287 4.2287 5.9057 5.9057 7.6700 7.6700 7.9279 7.9279 7.9283 7.9283 7.9404 7.9404 9.0972 9.0972 9.1027 9.1027 9.1030 9.1030 9.4907 9.4907 9.5155 9.5155 9.5158 9.5158 9.9131 9.9131 10.0267 10.0267 10.0352 10.0352 10.1353 10.1353 10.6669 10.6669 10.8009 10.8009 10.8087 10.8087 11.1831 11.1831 11.1942 11.1942 11.2420 11.2420 11.2725 11.2725 11.2926 11.2926 11.3339 11.3339 11.4906 11.4906 11.5050 11.5050 11.7742 11.7742 11.7891 11.7891 11.7900 11.7900 12.1053 12.1053 12.1333 12.1333 12.1479 12.1479 12.1569 12.1569 12.1737 12.1737 12.2119 12.2119 12.4272 12.4272 12.4512 12.4512 12.4921 12.4921 12.6419 12.6419 12.6755 12.6755 12.7731 12.7731 12.7825 12.7825 12.7982 12.7982 13.2984 13.2984 13.5298 13.5298 13.5355 13.5355 13.7475 13.7475 13.8281 13.8281 13.8429 13.8429 13.8496 13.8496 13.9807 13.9807 14.0111 14.0111 14.0882 14.0882 14.0980 14.0980 14.2361 14.2361 14.2641 14.2641 14.5606 14.5606 14.6582 14.6582 14.6716 14.6716 14.8736 14.8736 14.8790 14.8790 k = 0.5000 0.5000 0.0357 ( 6352 PWs) bands (ev): 2.7940 2.7940 3.8488 3.8488 3.8524 3.8524 4.2312 4.2312 5.8825 5.8825 7.6961 7.6961 7.9139 7.9139 7.9143 7.9143 7.9263 7.9263 9.1052 9.1052 9.1086 9.1086 9.1088 9.1088 9.4908 9.4908 9.5158 9.5158 9.5161 9.5161 9.9133 9.9133 10.0334 10.0334 10.0420 10.0420 10.1370 10.1370 10.6731 10.6731 10.8025 10.8025 10.8103 10.8103 11.1811 11.1811 11.1943 11.1943 11.2419 11.2419 11.2716 11.2716 11.2914 11.2914 11.3334 11.3334 11.4911 11.4911 11.5059 11.5059 11.7741 11.7741 11.7876 11.7876 11.7902 11.7902 12.1062 12.1062 12.1329 12.1329 12.1471 12.1471 12.1593 12.1593 12.1722 12.1722 12.2126 12.2126 12.4274 12.4274 12.4503 12.4503 12.4913 12.4913 12.6383 12.6383 12.6721 12.6721 12.7700 12.7700 12.7785 12.7785 12.7959 12.7959 13.2871 13.2871 13.5332 13.5332 13.5389 13.5389 13.7479 13.7479 13.8284 13.8284 13.8438 13.8438 13.8500 13.8500 13.9780 13.9780 14.0166 14.0166 14.0839 14.0839 14.0949 14.0949 14.2308 14.2308 14.2599 14.2599 14.5538 14.5538 14.6361 14.6361 14.6475 14.6475 14.9013 14.9013 14.9086 14.9086 k = 0.5000 0.5000 0.0536 ( 6356 PWs) bands (ev): 2.8003 2.8003 3.8526 3.8526 3.8562 3.8562 4.2355 4.2355 5.8453 5.8453 7.7382 7.7382 7.8912 7.8912 7.8916 7.8916 7.9034 7.9034 9.1178 9.1178 9.1181 9.1181 9.1182 9.1182 9.4909 9.4909 9.5164 9.5164 9.5165 9.5165 9.9136 9.9136 10.0443 10.0443 10.0531 10.0531 10.1399 10.1399 10.6834 10.6834 10.8052 10.8052 10.8131 10.8131 11.1779 11.1779 11.1945 11.1945 11.2417 11.2417 11.2701 11.2701 11.2896 11.2896 11.3327 11.3327 11.4922 11.4922 11.5075 11.5075 11.7739 11.7739 11.7849 11.7849 11.7904 11.7904 12.1072 12.1072 12.1333 12.1333 12.1457 12.1457 12.1628 12.1628 12.1701 12.1701 12.2138 12.2138 12.4276 12.4276 12.4489 12.4489 12.4898 12.4898 12.6323 12.6323 12.6665 12.6665 12.7648 12.7648 12.7717 12.7717 12.7919 12.7919 13.2687 13.2687 13.5386 13.5386 13.5443 13.5443 13.7491 13.7491 13.8288 13.8288 13.8452 13.8452 13.8507 13.8507 13.9734 13.9734 14.0244 14.0244 14.0768 14.0768 14.0904 14.0904 14.2222 14.2222 14.2531 14.2531 14.5433 14.5433 14.6072 14.6072 14.6164 14.6164 14.9390 14.9390 14.9487 14.9487 k = 0.5000 0.5000 0.0714 ( 6356 PWs) bands (ev): 2.8090 2.8090 3.8579 3.8579 3.8615 3.8615 4.2414 4.2414 5.7960 5.7960 7.7940 7.7940 7.8605 7.8605 7.8612 7.8612 7.8725 7.8725 9.1301 9.1301 9.1304 9.1304 9.1352 9.1352 9.4911 9.4911 9.5170 9.5170 9.5171 9.5171 9.9139 9.9139 10.0590 10.0590 10.0681 10.0681 10.1439 10.1439 10.6975 10.6975 10.8089 10.8089 10.8170 10.8170 11.1734 11.1734 11.1948 11.1948 11.2415 11.2415 11.2680 11.2680 11.2871 11.2871 11.3318 11.3318 11.4935 11.4935 11.5097 11.5097 11.7730 11.7730 11.7807 11.7807 11.7905 11.7905 12.1074 12.1074 12.1354 12.1354 12.1441 12.1441 12.1672 12.1672 12.1678 12.1678 12.2156 12.2156 12.4275 12.4275 12.4468 12.4468 12.4877 12.4877 12.6241 12.6241 12.6588 12.6588 12.7574 12.7574 12.7626 12.7626 12.7864 12.7864 13.2440 13.2440 13.5463 13.5463 13.5520 13.5520 13.7514 13.7514 13.8294 13.8294 13.8468 13.8468 13.8516 13.8516 13.9675 13.9675 14.0324 14.0324 14.0676 14.0676 14.0862 14.0862 14.2105 14.2105 14.2437 14.2437 14.5298 14.5298 14.5757 14.5757 14.5826 14.5826 14.9784 14.9784 14.9925 14.9925 k = 0.5000 0.5000 0.0893 ( 6368 PWs) bands (ev): 2.8202 2.8202 3.8647 3.8647 3.8683 3.8683 4.2490 4.2490 5.7367 5.7367 7.8224 7.8224 7.8229 7.8229 7.8348 7.8348 7.8632 7.8632 9.1449 9.1449 9.1452 9.1452 9.1555 9.1555 9.4914 9.4914 9.5177 9.5177 9.5178 9.5178 9.9143 9.9143 10.0771 10.0771 10.0864 10.0864 10.1489 10.1489 10.7154 10.7154 10.8138 10.8138 10.8221 10.8221 11.1679 11.1679 11.1951 11.1951 11.2412 11.2412 11.2655 11.2655 11.2839 11.2839 11.3307 11.3307 11.4952 11.4952 11.5123 11.5123 11.7694 11.7694 11.7765 11.7765 11.7903 11.7903 12.1064 12.1064 12.1399 12.1399 12.1422 12.1422 12.1658 12.1658 12.1722 12.1722 12.2177 12.2177 12.4269 12.4269 12.4442 12.4442 12.4850 12.4850 12.6138 12.6138 12.6488 12.6488 12.7477 12.7477 12.7516 12.7516 12.7793 12.7793 13.2137 13.2137 13.5562 13.5562 13.5619 13.5619 13.7550 13.7550 13.8300 13.8300 13.8486 13.8486 13.8526 13.8526 13.9602 13.9602 14.0370 14.0370 14.0565 14.0565 14.0849 14.0849 14.1961 14.1961 14.2320 14.2320 14.5137 14.5137 14.5438 14.5438 14.5481 14.5481 15.0109 15.0109 15.0392 15.0392 k = 0.5000 0.5000 0.1071 ( 6360 PWs) bands (ev): 2.8338 2.8338 3.8729 3.8729 3.8765 3.8765 4.2581 4.2581 5.6695 5.6695 7.7794 7.7794 7.7795 7.7795 7.7913 7.7913 7.9404 7.9404 9.1615 9.1615 9.1620 9.1620 9.1783 9.1783 9.4917 9.4917 9.5185 9.5185 9.5188 9.5188 9.9148 9.9148 10.0980 10.0980 10.1077 10.1077 10.1550 10.1550 10.7367 10.7367 10.8201 10.8201 10.8286 10.8286 11.1616 11.1616 11.1955 11.1955 11.2409 11.2409 11.2626 11.2626 11.2805 11.2805 11.3298 11.3298 11.4973 11.4973 11.5155 11.5155 11.7603 11.7603 11.7742 11.7742 11.7897 11.7897 12.1046 12.1046 12.1407 12.1407 12.1465 12.1465 12.1648 12.1648 12.1779 12.1779 12.2203 12.2203 12.4257 12.4257 12.4411 12.4411 12.4817 12.4817 12.6017 12.6017 12.6368 12.6368 12.7348 12.7348 12.7397 12.7397 12.7705 12.7705 13.1787 13.1787 13.5683 13.5683 13.5740 13.5740 13.7600 13.7600 13.8308 13.8308 13.8506 13.8506 13.8538 13.8538 13.9520 13.9520 14.0351 14.0351 14.0441 14.0441 14.0893 14.0893 14.1795 14.1795 14.2183 14.2183 14.4943 14.4943 14.5136 14.5136 14.5139 14.5139 15.0446 15.0446 15.0928 15.0928 k = 0.5000 0.5000 0.1250 ( 6360 PWs) bands (ev): 2.8499 2.8499 3.8824 3.8824 3.8860 3.8860 4.2687 4.2687 5.5961 5.5961 7.7311 7.7311 7.7312 7.7312 7.7429 7.7429 8.0261 8.0261 9.1797 9.1797 9.1802 9.1802 9.2028 9.2028 9.4921 9.4921 9.5194 9.5194 9.5198 9.5198 9.9154 9.9154 10.1211 10.1211 10.1311 10.1311 10.1620 10.1620 10.7612 10.7612 10.8277 10.8277 10.8364 10.8364 11.1545 11.1545 11.1959 11.1959 11.2407 11.2407 11.2596 11.2596 11.2767 11.2767 11.3292 11.3292 11.4996 11.4996 11.5192 11.5192 11.7466 11.7466 11.7722 11.7722 11.7884 11.7884 12.1022 12.1022 12.1395 12.1395 12.1547 12.1547 12.1649 12.1649 12.1842 12.1842 12.2234 12.2234 12.4236 12.4236 12.4375 12.4375 12.4777 12.4777 12.5877 12.5877 12.6227 12.6227 12.7189 12.7189 12.7269 12.7269 12.7602 12.7602 13.1399 13.1399 13.5823 13.5823 13.5880 13.5880 13.7661 13.7661 13.8317 13.8317 13.8527 13.8527 13.8552 13.8552 13.9431 13.9431 14.0277 14.0277 14.0308 14.0308 14.0979 14.0979 14.1612 14.1612 14.2028 14.2028 14.4690 14.4690 14.4797 14.4797 14.4898 14.4898 15.0813 15.0813 15.1500 15.1500 k = 0.5000 0.5000 0.1429 ( 6360 PWs) bands (ev): 2.8684 2.8684 3.8932 3.8932 3.8968 3.8968 4.2808 4.2808 5.5181 5.5181 7.6789 7.6789 7.6791 7.6791 7.6908 7.6908 8.1182 8.1182 9.1988 9.1988 9.1994 9.1994 9.2283 9.2283 9.4925 9.4925 9.5204 9.5204 9.5210 9.5210 9.9161 9.9161 10.1455 10.1455 10.1558 10.1558 10.1700 10.1700 10.7885 10.7885 10.8368 10.8368 10.8458 10.8458 11.1468 11.1468 11.1965 11.1965 11.2404 11.2404 11.2564 11.2564 11.2727 11.2727 11.3289 11.3289 11.5022 11.5022 11.5233 11.5233 11.7286 11.7286 11.7697 11.7697 11.7863 11.7863 12.0998 12.0998 12.1388 12.1388 12.1642 12.1642 12.1668 12.1668 12.1912 12.1912 12.2268 12.2268 12.4203 12.4203 12.4335 12.4335 12.4730 12.4730 12.5723 12.5723 12.6068 12.6068 12.7009 12.7009 12.7128 12.7128 12.7482 12.7482 13.0979 13.0979 13.5983 13.5983 13.6040 13.6040 13.7733 13.7733 13.8325 13.8325 13.8548 13.8548 13.8565 13.8565 13.9339 13.9339 14.0170 14.0170 14.0175 14.0175 14.1075 14.1075 14.1417 14.1417 14.1860 14.1860 14.4395 14.4395 14.4467 14.4467 14.4702 14.4702 15.1211 15.1211 15.2104 15.2104 k = 0.5000 0.5000 0.1607 ( 6352 PWs) bands (ev): 2.8893 2.8893 3.9051 3.9051 3.9088 3.9088 4.2942 4.2942 5.4366 5.4366 7.6237 7.6237 7.6240 7.6240 7.6358 7.6358 8.2154 8.2154 9.2187 9.2187 9.2194 9.2194 9.2542 9.2542 9.4930 9.4930 9.5215 9.5215 9.5222 9.5222 9.9169 9.9169 10.1707 10.1707 10.1776 10.1776 10.1824 10.1824 10.8182 10.8182 10.8476 10.8476 10.8568 10.8568 11.1387 11.1387 11.1972 11.1972 11.2402 11.2402 11.2532 11.2532 11.2687 11.2687 11.3292 11.3292 11.5051 11.5051 11.5277 11.5277 11.7062 11.7062 11.7662 11.7662 11.7831 11.7831 12.0975 12.0975 12.1385 12.1385 12.1708 12.1708 12.1744 12.1744 12.1988 12.1988 12.2306 12.2306 12.4160 12.4160 12.4291 12.4291 12.4676 12.4676 12.5558 12.5558 12.5891 12.5891 12.6809 12.6809 12.6973 12.6973 12.7346 12.7346 13.0537 13.0537 13.6160 13.6160 13.6218 13.6218 13.7812 13.7812 13.8333 13.8333 13.8570 13.8570 13.8578 13.8578 13.9248 13.9248 14.0030 14.0030 14.0064 14.0064 14.1139 14.1139 14.1242 14.1242 14.1680 14.1680 14.4094 14.4094 14.4147 14.4147 14.4520 14.4520 15.1636 15.1636 15.2733 15.2733 k = 0.5000 0.5000 0.1786 ( 6360 PWs) bands (ev): 2.9126 2.9126 3.9181 3.9181 3.9218 3.9218 4.3088 4.3088 5.3529 5.3529 7.5666 7.5666 7.5668 7.5668 7.5788 7.5788 8.3167 8.3167 9.2391 9.2391 9.2399 9.2399 9.2802 9.2802 9.4934 9.4934 9.5226 9.5226 9.5235 9.5235 9.9176 9.9176 10.1875 10.1875 10.1959 10.1959 10.2073 10.2073 10.8498 10.8498 10.8601 10.8601 10.8696 10.8696 11.1303 11.1303 11.1978 11.1978 11.2399 11.2399 11.2501 11.2501 11.2647 11.2647 11.3304 11.3304 11.5081 11.5081 11.5323 11.5323 11.6793 11.6793 11.7616 11.7616 11.7787 11.7787 12.0954 12.0954 12.1385 12.1385 12.1771 12.1771 12.1849 12.1849 12.2073 12.2073 12.2346 12.2346 12.4103 12.4103 12.4241 12.4241 12.4612 12.4612 12.5383 12.5383 12.5699 12.5699 12.6594 12.6594 12.6806 12.6806 12.7194 12.7194 13.0075 13.0075 13.6352 13.6352 13.6411 13.6411 13.7896 13.7896 13.8340 13.8340 13.8589 13.8589 13.8590 13.8590 13.9161 13.9161 13.9892 13.9892 13.9950 13.9950 14.0978 14.0978 14.1273 14.1273 14.1491 14.1491 14.3799 14.3799 14.3839 14.3839 14.4344 14.4344 15.2088 15.2088 15.3386 15.3386 k = 0.5000 0.5000 0.1964 ( 6360 PWs) bands (ev): 2.9381 2.9381 3.9321 3.9321 3.9358 3.9358 4.3246 4.3246 5.2676 5.2676 7.5082 7.5082 7.5084 7.5084 7.5204 7.5204 8.4209 8.4209 9.2597 9.2597 9.2606 9.2606 9.3057 9.3057 9.4939 9.4939 9.5237 9.5237 9.5248 9.5248 9.9185 9.9185 10.1975 10.1975 10.2204 10.2204 10.2321 10.2321 10.8744 10.8744 10.8828 10.8828 10.8844 10.8844 11.1215 11.1215 11.1987 11.1987 11.2396 11.2396 11.2473 11.2473 11.2609 11.2609 11.3327 11.3327 11.5112 11.5112 11.5372 11.5372 11.6485 11.6485 11.7557 11.7557 11.7729 11.7729 12.0938 12.0938 12.1389 12.1389 12.1855 12.1855 12.1954 12.1954 12.2167 12.2167 12.2388 12.2388 12.4032 12.4032 12.4190 12.4190 12.4541 12.4541 12.5206 12.5206 12.5495 12.5495 12.6364 12.6364 12.6626 12.6626 12.7029 12.7029 12.9602 12.9602 13.6558 13.6558 13.6619 13.6619 13.7983 13.7983 13.8345 13.8345 13.8598 13.8598 13.8611 13.8611 13.9084 13.9084 13.9759 13.9759 13.9841 13.9841 14.0765 14.0765 14.1298 14.1298 14.1339 14.1339 14.3515 14.3515 14.3543 14.3543 14.4173 14.4173 15.2564 15.2564 15.4058 15.4058 k = 0.5000 0.5000 0.2143 ( 6368 PWs) bands (ev): 2.9660 2.9660 3.9469 3.9469 3.9505 3.9505 4.3413 4.3413 5.1815 5.1815 7.4492 7.4492 7.4495 7.4495 7.4614 7.4614 8.5274 8.5274 9.2804 9.2804 9.2814 9.2814 9.3306 9.3306 9.4944 9.4944 9.5248 9.5248 9.5262 9.5262 9.9193 9.9193 10.2078 10.2078 10.2436 10.2436 10.2556 10.2556 10.8907 10.8907 10.9006 10.9006 10.9171 10.9171 11.1124 11.1124 11.1996 11.1996 11.2392 11.2392 11.2450 11.2450 11.2573 11.2573 11.3363 11.3363 11.5145 11.5145 11.5422 11.5422 11.6139 11.6139 11.7484 11.7484 11.7657 11.7657 12.0927 12.0927 12.1396 12.1396 12.1958 12.1958 12.2055 12.2055 12.2270 12.2270 12.2429 12.2429 12.3948 12.3948 12.4137 12.4137 12.4462 12.4462 12.5027 12.5027 12.5281 12.5281 12.6123 12.6123 12.6436 12.6436 12.6850 12.6850 12.9122 12.9122 13.6774 13.6774 13.6837 13.6837 13.8067 13.8067 13.8348 13.8348 13.8603 13.8603 13.8630 13.8630 13.9018 13.9018 13.9633 13.9633 13.9739 13.9739 14.0550 14.0550 14.1101 14.1101 14.1391 14.1391 14.3243 14.3243 14.3262 14.3262 14.4006 14.4006 15.3065 15.3065 15.4745 15.4745 k = 0.5000 0.5000 0.2321 ( 6368 PWs) bands (ev): 2.9960 2.9960 3.9623 3.9623 3.9660 3.9660 4.3588 4.3588 5.0952 5.0952 7.3904 7.3904 7.3906 7.3906 7.4024 7.4024 8.6355 8.6355 9.3012 9.3012 9.3023 9.3023 9.3547 9.3547 9.4950 9.4950 9.5260 9.5260 9.5276 9.5276 9.9202 9.9202 10.2184 10.2184 10.2651 10.2651 10.2773 10.2773 10.9090 10.9090 10.9190 10.9190 10.9517 10.9517 11.1027 11.1027 11.2006 11.2006 11.2385 11.2385 11.2433 11.2433 11.2541 11.2541 11.3415 11.3415 11.5178 11.5178 11.5468 11.5468 11.5765 11.5765 11.7397 11.7397 11.7570 11.7570 12.0923 12.0923 12.1409 12.1409 12.2074 12.2074 12.2151 12.2151 12.2382 12.2382 12.2469 12.2469 12.3851 12.3851 12.4082 12.4082 12.4375 12.4375 12.4855 12.4855 12.5061 12.5061 12.5871 12.5871 12.6237 12.6237 12.6660 12.6660 12.8639 12.8639 13.6998 13.6998 13.7063 13.7063 13.8148 13.8148 13.8347 13.8347 13.8604 13.8604 13.8650 13.8650 13.8966 13.8966 13.9516 13.9516 13.9648 13.9648 14.0339 14.0339 14.0907 14.0907 14.1429 14.1429 14.2986 14.2986 14.2996 14.2996 14.3843 14.3843 15.3590 15.3590 15.5445 15.5445 k = 0.5000 0.5000 0.2500 ( 6360 PWs) bands (ev): 3.0282 3.0282 3.9782 3.9782 3.9819 3.9819 4.3770 4.3770 5.0091 5.0091 7.3322 7.3322 7.3325 7.3325 7.3440 7.3440 8.7445 8.7445 9.3217 9.3217 9.3230 9.3230 9.3777 9.3777 9.4955 9.4955 9.5272 9.5272 9.5290 9.5290 9.9211 9.9211 10.2293 10.2293 10.2845 10.2845 10.2969 10.2969 10.9292 10.9292 10.9393 10.9393 10.9860 10.9860 11.0927 11.0927 11.2017 11.2017 11.2375 11.2375 11.2425 11.2425 11.2513 11.2513 11.3487 11.3487 11.5212 11.5212 11.5335 11.5335 11.5543 11.5543 11.7296 11.7296 11.7469 11.7469 12.0927 12.0927 12.1428 12.1428 12.2199 12.2199 12.2241 12.2241 12.2500 12.2500 12.2506 12.2506 12.3742 12.3742 12.4026 12.4026 12.4281 12.4281 12.4694 12.4694 12.4837 12.4837 12.5612 12.5612 12.6031 12.6031 12.6460 12.6460 12.8159 12.8159 13.7224 13.7224 13.7293 13.7293 13.8220 13.8220 13.8344 13.8344 13.8600 13.8600 13.8671 13.8671 13.8929 13.8929 13.9409 13.9409 13.9570 13.9570 14.0134 14.0134 14.0716 14.0716 14.1452 14.1452 14.2745 14.2745 14.2745 14.2745 14.3685 14.3685 15.4140 15.4140 15.6142 15.6142 k = 0.5000 0.5000 0.2679 ( 6376 PWs) bands (ev): 3.0624 3.0624 3.9944 3.9944 3.9981 3.9981 4.3956 4.3956 4.9238 4.9238 7.2754 7.2754 7.2756 7.2756 7.2867 7.2867 8.8539 8.8539 9.3419 9.3419 9.3434 9.3434 9.3995 9.3995 9.4961 9.4961 9.5284 9.5284 9.5304 9.5304 9.9220 9.9220 10.2403 10.2403 10.3015 10.3015 10.3140 10.3140 10.9512 10.9512 10.9614 10.9614 11.0195 11.0195 11.0815 11.0815 11.2027 11.2027 11.2363 11.2363 11.2421 11.2421 11.2489 11.2489 11.3582 11.3582 11.4919 11.4919 11.5245 11.5245 11.5583 11.5583 11.7180 11.7180 11.7352 11.7352 12.0938 12.0938 12.1454 12.1454 12.2320 12.2320 12.2325 12.2325 12.2539 12.2539 12.2618 12.2618 12.3625 12.3625 12.3969 12.3969 12.4178 12.4178 12.4548 12.4548 12.4611 12.4611 12.5344 12.5344 12.5819 12.5819 12.6250 12.6250 12.7686 12.7686 13.7449 13.7449 13.7522 13.7522 13.8280 13.8280 13.8338 13.8338 13.8592 13.8592 13.8694 13.8694 13.8902 13.8902 13.9313 13.9313 13.9506 13.9506 13.9937 13.9937 14.0531 14.0531 14.1462 14.1462 14.2511 14.2511 14.2521 14.2521 14.3533 14.3533 15.4713 15.4713 15.6829 15.6829 k = 0.5000 0.5000 0.2857 ( 6384 PWs) bands (ev): 3.0985 3.0985 4.0108 4.0108 4.0145 4.0145 4.4145 4.4145 4.8395 4.8395 7.2203 7.2203 7.2206 7.2206 7.2310 7.2310 8.9632 8.9632 9.3617 9.3617 9.3633 9.3633 9.4200 9.4200 9.4966 9.4966 9.5296 9.5296 9.5319 9.5319 9.9229 9.9229 10.2512 10.2512 10.3161 10.3161 10.3286 10.3286 10.9747 10.9747 10.9849 10.9849 11.0514 11.0514 11.0687 11.0687 11.2038 11.2038 11.2354 11.2354 11.2422 11.2422 11.2470 11.2470 11.3704 11.3704 11.4485 11.4485 11.5277 11.5277 11.5631 11.5631 11.7051 11.7051 11.7223 11.7223 12.0957 12.0957 12.1488 12.1488 12.2401 12.2401 12.2417 12.2417 12.2580 12.2580 12.2734 12.2734 12.3506 12.3506 12.3914 12.3914 12.4070 12.4070 12.4389 12.4389 12.4424 12.4424 12.5073 12.5073 12.5604 12.5604 12.6035 12.6035 12.7226 12.7226 13.7667 13.7667 13.7745 13.7745 13.8326 13.8326 13.8333 13.8333 13.8582 13.8582 13.8723 13.8723 13.8884 13.8884 13.9230 13.9230 13.9455 13.9455 13.9751 13.9751 14.0355 14.0355 14.1460 14.1460 14.2295 14.2295 14.2315 14.2315 14.3387 14.3387 15.5312 15.5312 15.7512 15.7512 k = 0.5000 0.5000 0.3036 ( 6376 PWs) bands (ev): 3.1364 3.1364 4.0271 4.0271 4.0307 4.0307 4.4333 4.4333 4.7567 4.7567 7.1675 7.1675 7.1678 7.1678 7.1775 7.1775 9.0719 9.0719 9.3808 9.3808 9.3827 9.3827 9.4392 9.4392 9.4971 9.4971 9.5307 9.5307 9.5334 9.5334 9.9237 9.9237 10.2619 10.2619 10.3282 10.3282 10.3408 10.3408 10.9993 10.9993 11.0098 11.0098 11.0536 11.0536 11.0812 11.0812 11.2051 11.2051 11.2348 11.2348 11.2425 11.2425 11.2456 11.2456 11.3854 11.3854 11.4054 11.4054 11.5308 11.5308 11.5677 11.5677 11.6911 11.6911 11.7081 11.7081 12.0984 12.0984 12.1530 12.1530 12.2448 12.2448 12.2470 12.2470 12.2660 12.2660 12.2842 12.2842 12.3391 12.3391 12.3859 12.3859 12.3964 12.3964 12.4175 12.4175 12.4321 12.4321 12.4801 12.4801 12.5389 12.5389 12.5817 12.5817 12.6784 12.6784 13.7870 13.7870 13.7956 13.7956 13.8335 13.8335 13.8359 13.8359 13.8571 13.8571 13.8759 13.8759 13.8869 13.8869 13.9162 13.9162 13.9419 13.9419 13.9578 13.9578 14.0190 14.0190 14.1449 14.1449 14.2097 14.2097 14.2128 14.2128 14.3249 14.3249 15.5936 15.5936 15.8184 15.8184 k = 0.5000 0.5000 0.3214 ( 6372 PWs) bands (ev): 3.1759 3.1759 4.0430 4.0430 4.0467 4.0467 4.4519 4.4519 4.6757 4.6757 7.1175 7.1175 7.1178 7.1178 7.1266 7.1266 9.1793 9.1793 9.3992 9.3992 9.4013 9.4013 9.4569 9.4569 9.4977 9.4977 9.5319 9.5319 9.5349 9.5349 9.9246 9.9246 10.2725 10.2725 10.3380 10.3380 10.3505 10.3505 11.0216 11.0216 11.0356 11.0356 11.0378 11.0378 11.1083 11.1083 11.2064 11.2064 11.2345 11.2345 11.2428 11.2428 11.2446 11.2446 11.3642 11.3642 11.4034 11.4034 11.5339 11.5339 11.5721 11.5721 11.6761 11.6761 11.6930 11.6930 12.1017 12.1017 12.1579 12.1579 12.2420 12.2420 12.2527 12.2527 12.2762 12.2762 12.2939 12.2939 12.3285 12.3285 12.3801 12.3801 12.3871 12.3871 12.3975 12.3975 12.4236 12.4236 12.4531 12.4531 12.5177 12.5177 12.5598 12.5598 12.6367 12.6367 13.8044 13.8044 13.8141 13.8141 13.8356 13.8356 13.8385 13.8385 13.8560 13.8560 13.8803 13.8803 13.8853 13.8853 13.9109 13.9109 13.9392 13.9392 13.9424 13.9424 14.0037 14.0037 14.1430 14.1430 14.1920 14.1920 14.1961 14.1961 14.3120 14.3120 15.6585 15.6585 15.8840 15.8840 k = 0.5000 0.5000 0.3393 ( 6380 PWs) bands (ev): 3.2167 3.2167 4.0584 4.0584 4.0621 4.0621 4.4699 4.4699 4.5969 4.5969 7.0708 7.0708 7.0711 7.0711 7.0788 7.0788 9.2850 9.2850 9.4166 9.4166 9.4190 9.4190 9.4731 9.4731 9.4982 9.4982 9.5331 9.5331 9.5365 9.5365 9.9253 9.9253 10.2827 10.2827 10.3456 10.3456 10.3580 10.3580 11.0068 11.0068 11.0542 11.0542 11.0620 11.0620 11.1324 11.1324 11.2076 11.2076 11.2345 11.2345 11.2432 11.2432 11.2440 11.2440 11.3266 11.3266 11.4242 11.4242 11.5367 11.5367 11.5759 11.5759 11.6604 11.6604 11.6770 11.6770 12.1058 12.1058 12.1635 12.1635 12.2355 12.2355 12.2570 12.2570 12.2849 12.2849 12.3018 12.3018 12.3192 12.3192 12.3712 12.3712 12.3801 12.3801 12.3820 12.3820 12.4166 12.4166 12.4270 12.4270 12.4969 12.4969 12.5378 12.5378 12.5979 12.5979 13.8156 13.8156 13.8262 13.8262 13.8420 13.8420 13.8433 13.8433 13.8550 13.8550 13.8833 13.8833 13.8854 13.8854 13.9071 13.9071 13.9283 13.9283 13.9384 13.9384 13.9901 13.9901 14.1403 14.1403 14.1764 14.1764 14.1815 14.1815 14.2999 14.2999 15.7258 15.7258 15.9472 15.9472 k = 0.5000 0.5000 0.3571 ( 6372 PWs) bands (ev): 3.2585 3.2585 4.0731 4.0731 4.0768 4.0768 4.4871 4.4871 4.5209 4.5209 7.0276 7.0276 7.0279 7.0279 7.0345 7.0345 9.3882 9.3882 9.4328 9.4328 9.4356 9.4356 9.4878 9.4878 9.4987 9.4987 9.5343 9.5343 9.5382 9.5382 9.9261 9.9261 10.2927 10.2927 10.3513 10.3513 10.3636 10.3636 10.9755 10.9755 11.0803 11.0803 11.0884 11.0884 11.1533 11.1533 11.2090 11.2090 11.2349 11.2349 11.2437 11.2437 11.2438 11.2438 11.2946 11.2946 11.4473 11.4473 11.5395 11.5395 11.5792 11.5792 11.6444 11.6444 11.6606 11.6606 12.1104 12.1104 12.1695 12.1695 12.2269 12.2269 12.2593 12.2593 12.2883 12.2883 12.3074 12.3074 12.3141 12.3141 12.3552 12.3552 12.3740 12.3740 12.3762 12.3762 12.4041 12.4041 12.4109 12.4109 12.4770 12.4770 12.5163 12.5163 12.5629 12.5629 13.8201 13.8201 13.8297 13.8297 13.8503 13.8503 13.8521 13.8521 13.8571 13.8571 13.8809 13.8809 13.8918 13.8918 13.9046 13.9046 13.9172 13.9172 13.9379 13.9379 13.9783 13.9783 14.1369 14.1369 14.1632 14.1632 14.1690 14.1690 14.2888 14.2888 15.7956 15.7956 16.0073 16.0073 k = 0.5000 0.5000 0.3750 ( 6356 PWs) bands (ev): 3.3009 3.3009 4.0867 4.0867 4.0905 4.0905 4.4482 4.4482 4.5033 4.5033 6.9885 6.9885 6.9888 6.9888 6.9941 6.9941 9.4475 9.4475 9.4503 9.4503 9.4880 9.4880 9.4996 9.4996 9.5007 9.5007 9.5357 9.5357 9.5400 9.5400 9.9268 9.9268 10.3024 10.3024 10.3554 10.3554 10.3677 10.3677 10.9364 10.9364 11.1066 11.1066 11.1145 11.1145 11.1711 11.1711 11.2104 11.2104 11.2355 11.2355 11.2439 11.2439 11.2442 11.2442 11.2691 11.2691 11.4719 11.4719 11.5422 11.5422 11.5813 11.5813 11.6289 11.6289 11.6440 11.6440 12.1153 12.1153 12.1753 12.1753 12.2180 12.2180 12.2592 12.2592 12.2833 12.2833 12.3102 12.3102 12.3157 12.3157 12.3368 12.3368 12.3660 12.3660 12.3749 12.3749 12.3888 12.3888 12.4065 12.4065 12.4585 12.4585 12.4957 12.4957 12.5321 12.5321 13.8216 13.8216 13.8294 13.8294 13.8506 13.8506 13.8585 13.8585 13.8681 13.8681 13.8782 13.8782 13.8992 13.8992 13.9031 13.9031 13.9099 13.9099 13.9382 13.9382 13.9685 13.9685 14.1326 14.1326 14.1530 14.1530 14.1587 14.1587 14.2788 14.2788 15.8675 15.8675 16.0636 16.0636 k = 0.5000 0.5000 0.3929 ( 6352 PWs) bands (ev): 3.3431 3.3431 4.0991 4.0991 4.1029 4.1029 4.3795 4.3795 4.5180 4.5180 6.9537 6.9537 6.9540 6.9540 6.9582 6.9582 9.4606 9.4606 9.4639 9.4639 9.4997 9.4997 9.5121 9.5121 9.5362 9.5362 9.5419 9.5419 9.5845 9.5845 9.9274 9.9274 10.3120 10.3120 10.3581 10.3581 10.3704 10.3704 10.8902 10.8902 11.1319 11.1319 11.1393 11.1393 11.1859 11.1859 11.2119 11.2119 11.2362 11.2362 11.2442 11.2442 11.2444 11.2444 11.2504 11.2504 11.4965 11.4965 11.5451 11.5451 11.5809 11.5809 11.6154 11.6154 11.6276 11.6276 12.1202 12.1202 12.1793 12.1793 12.2112 12.2112 12.2563 12.2563 12.2739 12.2739 12.3100 12.3100 12.3167 12.3167 12.3200 12.3200 12.3559 12.3559 12.3754 12.3754 12.3829 12.3829 12.4033 12.4033 12.4419 12.4419 12.4761 12.4761 12.5058 12.5058 13.8220 13.8220 13.8280 13.8280 13.8496 13.8496 13.8602 13.8602 13.8754 13.8754 13.8793 13.8793 13.9015 13.9015 13.9022 13.9022 13.9122 13.9122 13.9388 13.9388 13.9606 13.9606 14.1273 14.1273 14.1457 14.1457 14.1505 14.1505 14.2700 14.2700 15.9411 15.9411 16.1150 16.1150 k = 0.5000 0.5000 0.4107 ( 6344 PWs) bands (ev): 3.3842 3.3842 4.1101 4.1101 4.1138 4.1138 4.3158 4.3158 4.5310 4.5310 6.9237 6.9237 6.9240 6.9240 6.9270 6.9270 9.4718 9.4718 9.4754 9.4754 9.5003 9.5003 9.5216 9.5216 9.5376 9.5376 9.5440 9.5440 9.6737 9.6737 9.9279 9.9279 10.3215 10.3215 10.3598 10.3598 10.3721 10.3721 10.8390 10.8390 11.1554 11.1554 11.1622 11.1622 11.1979 11.1979 11.2138 11.2138 11.2344 11.2344 11.2393 11.2393 11.2446 11.2446 11.2454 11.2454 11.5185 11.5185 11.5496 11.5496 11.5758 11.5758 11.6066 11.6066 11.6121 11.6121 12.1247 12.1247 12.1789 12.1789 12.2097 12.2097 12.2509 12.2509 12.2639 12.2639 12.2954 12.2954 12.3089 12.3089 12.3239 12.3239 12.3473 12.3473 12.3768 12.3768 12.3816 12.3816 12.4016 12.4016 12.4279 12.4279 12.4581 12.4581 12.4843 12.4843 13.8220 13.8220 13.8263 13.8263 13.8486 13.8486 13.8583 13.8583 13.8728 13.8728 13.8885 13.8885 13.9003 13.9003 13.9017 13.9017 13.9209 13.9209 13.9398 13.9398 13.9548 13.9548 14.1217 14.1217 14.1409 14.1409 14.1442 14.1442 14.2625 14.2625 16.0153 16.0153 16.1607 16.1607 k = 0.5000 0.5000 0.4286 ( 6356 PWs) bands (ev): 3.4229 3.4229 4.1193 4.1193 4.1230 4.1230 4.2586 4.2586 4.5421 4.5421 6.8987 6.8987 6.8990 6.8990 6.9010 6.9010 9.4809 9.4809 9.4845 9.4845 9.5011 9.5011 9.5292 9.5292 9.5388 9.5388 9.5462 9.5462 9.7551 9.7551 9.9283 9.9283 10.3313 10.3313 10.3607 10.3607 10.3732 10.3732 10.7854 10.7854 11.1761 11.1761 11.1817 11.1817 11.2072 11.2072 11.2169 11.2169 11.2267 11.2267 11.2396 11.2396 11.2451 11.2451 11.2457 11.2457 11.5323 11.5323 11.5599 11.5599 11.5657 11.5657 11.5981 11.5981 11.6034 11.6034 12.1281 12.1281 12.1740 12.1740 12.2138 12.2138 12.2440 12.2440 12.2546 12.2546 12.2763 12.2763 12.3065 12.3065 12.3262 12.3262 12.3404 12.3404 12.3779 12.3779 12.3813 12.3813 12.4011 12.4011 12.4169 12.4169 12.4423 12.4423 12.4675 12.4675 13.8217 13.8217 13.8245 13.8245 13.8477 13.8477 13.8549 13.8549 13.8702 13.8702 13.8953 13.8953 13.8999 13.8999 13.9014 13.9014 13.9287 13.9287 13.9410 13.9410 13.9509 13.9509 14.1167 14.1167 14.1377 14.1377 14.1396 14.1396 14.2562 14.2562 16.0887 16.0887 16.1998 16.1998 k = 0.5000 0.5000 0.4464 ( 6356 PWs) bands (ev): 3.4574 3.4574 4.1267 4.1267 4.1304 4.1304 4.2097 4.2097 4.5511 4.5511 6.8789 6.8789 6.8792 6.8792 6.8804 6.8804 9.4879 9.4879 9.4910 9.4910 9.5024 9.5024 9.5350 9.5350 9.5400 9.5400 9.5484 9.5484 9.8255 9.8255 9.9287 9.9287 10.3415 10.3415 10.3612 10.3612 10.3741 10.3741 10.7331 10.7331 11.1927 11.1927 11.1959 11.1959 11.2138 11.2138 11.2218 11.2218 11.2223 11.2223 11.2412 11.2412 11.2456 11.2456 11.2460 11.2460 11.5366 11.5366 11.5543 11.5543 11.5754 11.5754 11.5868 11.5868 11.6029 11.6029 12.1299 12.1299 12.1681 12.1681 12.2201 12.2201 12.2372 12.2372 12.2469 12.2469 12.2606 12.2606 12.3041 12.3041 12.3270 12.3270 12.3346 12.3346 12.3786 12.3786 12.3810 12.3810 12.4015 12.4015 12.4093 12.4093 12.4295 12.4295 12.4553 12.4553 13.8213 13.8213 13.8229 13.8229 13.8471 13.8471 13.8515 13.8515 13.8681 13.8681 13.8998 13.8998 13.9001 13.9001 13.9013 13.9013 13.9346 13.9346 13.9425 13.9425 13.9487 13.9487 14.1126 14.1126 14.1355 14.1355 14.1364 14.1364 14.2513 14.2513 16.1584 16.1584 16.2314 16.2314 k = 0.5000 0.5000 0.4643 ( 6348 PWs) bands (ev): 3.4852 3.4852 4.1322 4.1322 4.1357 4.1357 4.1717 4.1717 4.5576 4.5576 6.8647 6.8647 6.8650 6.8650 6.8655 6.8655 9.4928 9.4928 9.4947 9.4947 9.5042 9.5042 9.5390 9.5390 9.5410 9.5410 9.5504 9.5504 9.8808 9.8808 9.9289 9.9289 10.3514 10.3514 10.3613 10.3613 10.3754 10.3754 10.6869 10.6869 11.2029 11.2029 11.2033 11.2033 11.2190 11.2190 11.2207 11.2207 11.2295 11.2295 11.2434 11.2434 11.2461 11.2461 11.2462 11.2462 11.5369 11.5369 11.5444 11.5444 11.5777 11.5777 11.5908 11.5908 11.6032 11.6032 12.1302 12.1302 12.1633 12.1633 12.2262 12.2262 12.2325 12.2325 12.2411 12.2411 12.2488 12.2488 12.3022 12.3022 12.3267 12.3267 12.3299 12.3299 12.3789 12.3789 12.3802 12.3802 12.4021 12.4021 12.4049 12.4049 12.4204 12.4204 12.4473 12.4473 13.8209 13.8209 13.8216 13.8216 13.8468 13.8468 13.8488 13.8488 13.8664 13.8664 13.9004 13.9004 13.9009 13.9009 13.9030 13.9030 13.9380 13.9380 13.9445 13.9445 13.9476 13.9476 14.1099 14.1099 14.1341 14.1341 14.1345 14.1345 14.2478 14.2478 16.2187 16.2187 16.2547 16.2548 k = 0.5000 0.5000 0.4821 ( 6300 PWs) bands (ev): 3.5035 3.5035 4.1355 4.1355 4.1384 4.1384 4.1478 4.1478 4.5616 4.5616 6.8560 6.8560 6.8564 6.8564 6.8565 6.8565 9.4958 9.4958 9.4963 9.4963 9.5059 9.5059 9.5413 9.5413 9.5418 9.5418 9.5518 9.5518 9.9167 9.9167 9.9291 9.9291 10.3589 10.3589 10.3615 10.3615 10.3774 10.3774 10.6537 10.6537 11.2064 11.2064 11.2066 11.2066 11.2226 11.2226 11.2226 11.2226 11.2355 11.2355 11.2458 11.2458 11.2468 11.2468 11.2469 11.2469 11.5361 11.5361 11.5379 11.5379 11.5732 11.5732 11.6003 11.6003 11.6036 11.6036 12.1296 12.1296 12.1602 12.1602 12.2306 12.2306 12.2312 12.2312 12.2377 12.2377 12.2406 12.2406 12.3009 12.3009 12.3260 12.3260 12.3268 12.3268 12.3792 12.3792 12.3795 12.3795 12.4023 12.4023 12.4027 12.4027 12.4154 12.4154 12.4428 12.4428 13.8208 13.8208 13.8209 13.8209 13.8466 13.8466 13.8472 13.8472 13.8655 13.8655 13.9008 13.9008 13.9010 13.9010 13.9045 13.9045 13.9396 13.9396 13.9463 13.9463 13.9471 13.9471 14.1084 14.1084 14.1335 14.1335 14.1336 14.1336 14.2459 14.2459 16.2601 16.2601 16.2689 16.2690 k = 0.5000 0.5000 0.5000 ( 6272 PWs) bands (ev): 3.5100 3.5100 4.1366 4.1366 4.1366 4.1366 4.1422 4.1422 4.5629 4.5629 6.8531 6.8531 6.8535 6.8535 6.8535 6.8535 9.4967 9.4967 9.4967 9.4967 9.5065 9.5065 9.5421 9.5421 9.5421 9.5421 9.5523 9.5523 9.9292 9.9292 9.9292 9.9292 10.3615 10.3615 10.3615 10.3615 10.3788 10.3788 10.6413 10.6413 11.2072 11.2072 11.2072 11.2072 11.2237 11.2237 11.2237 11.2237 11.2377 11.2377 11.2466 11.2466 11.2473 11.2473 11.2473 11.2473 11.5356 11.5356 11.5356 11.5356 11.5718 11.5718 11.6038 11.6038 11.6038 11.6038 12.1293 12.1293 12.1592 12.1592 12.2321 12.2321 12.2321 12.2321 12.2368 12.2368 12.2368 12.2368 12.3005 12.3005 12.3257 12.3257 12.3257 12.3257 12.3792 12.3792 12.3792 12.3792 12.4022 12.4022 12.4022 12.4022 12.4139 12.4139 12.4415 12.4415 13.8208 13.8208 13.8208 13.8208 13.8466 13.8466 13.8466 13.8466 13.8652 13.8652 13.9011 13.9011 13.9011 13.9011 13.9049 13.9049 13.9401 13.9401 13.9470 13.9470 13.9470 13.9470 14.1080 14.1080 14.1333 14.1333 14.1333 14.1333 14.2453 14.2453 16.2738 16.2738 16.2738 16.2749 Writing output data file Fe11Si5.save init_run : 0.40s CPU 0.53s WALL ( 1 calls) electrons : 757.75s CPU 765.25s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 757.73s CPU 765.23s 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 : 0.18s CPU 0.20s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.12s CPU 0.21s WALL ( 219 calls) cegterg : 691.57s CPU 697.88s WALL ( 361 calls) Called by sum_band: Called by *egterg: h_psi : 317.54s CPU 321.18s WALL ( 6463 calls) s_psi : 87.69s CPU 87.62s WALL ( 6463 calls) g_psi : 0.74s CPU 0.80s WALL ( 5883 calls) cdiaghg : 250.52s CPU 253.67s WALL ( 6102 calls) cegterg:over : 35.26s CPU 35.44s WALL ( 5883 calls) cegterg:upda : 27.40s CPU 27.48s WALL ( 5883 calls) cegterg:last : 17.89s CPU 17.93s WALL ( 1053 calls) cdiaghg:chol : 16.14s CPU 16.32s WALL ( 6102 calls) cdiaghg:inve : 12.44s CPU 12.60s WALL ( 6102 calls) cdiaghg:para : 22.62s CPU 22.68s WALL ( 12204 calls) Called by h_psi: h_psi:vloc : 199.94s CPU 203.08s WALL ( 6463 calls) h_psi:vnl : 116.61s CPU 117.18s WALL ( 6463 calls) add_vuspsi : 65.44s CPU 65.61s WALL ( 6463 calls) General routines calbec : 51.14s CPU 51.55s WALL ( 6463 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 188.16s CPU 191.29s WALL ( 1762512 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.45s WALL ( 438 calls) Parallel routines fft_scatter : 66.74s CPU 67.68s WALL ( 1762535 calls) PWSCF : 13m 9.22s CPU 13m32.04s WALL This run was terminated on: 18:19:49 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=