Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:51:22 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: ./SiF4.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S 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 72 45 13 2820 1406 221 Max 73 46 14 2829 1426 226 Sum 2617 1653 489 101673 50883 8025 bravais-lattice index = 14 lattice parameter (alat) = 10.2234 a.u. unit-cell volume = 1068.5339 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 317.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.223418 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 F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 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 F 7.00 18.99840 F( 1.00) Si 4.00 28.08550 Si( 1.00) 48 Sym. Ops., with inversion, found (36 have fractional translation) 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 ) f =( -0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) 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 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 9 180 deg rotation - cart. axis [1,0,1] cryst. s( 9) = ( 0 0 1 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) cart. s( 9) = ( 0.0000000 -0.0000000 1.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) 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 ) f =( -0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) cart. s(11) = ( -0.0000000 0.0000000 1.0000000 ) f =( -0.5000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) isym = 12 90 deg rotation - cart. axis [0,-1,0] cryst. s(12) = ( 0 0 1 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) cart. s(12) = ( 0.0000000 0.0000000 -1.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) isym = 13 180 deg rotation - cart. axis [0,1,1] cryst. s(13) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) 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 ) f =( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) isym = 16 90 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) cart. s(16) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) 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 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) cart. s(18) = ( -0.0000000 -1.0000000 0.0000000 ) f =( -0.5000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) isym = 19 120 deg rotation - cart. axis [1,1,-1] cryst. s(19) = ( 0 0 -1 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) cart. s(19) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) isym = 20 120 deg rotation - cart. axis [1,-1,1] cryst. s(20) = ( 0 0 1 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) cart. s(20) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.5000000 ) ( 1.0000000 -0.0000000 -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 ) f =( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) cart. s(22) = ( -0.0000000 -0.0000000 1.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) isym = 23 120 deg rotation - cart. axis [1,-1,-1] cryst. s(23) = ( 0 -1 0 ) f =( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) cart. s(23) = ( -0.0000000 0.0000000 -1.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) isym = 24 120 deg rotation - cart. axis [-1,-1,1] cryst. s(24) = ( 0 1 0 ) f =( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) cart. s(24) = ( 0.0000000 -0.0000000 -1.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) 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 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(26) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 27 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(27) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(27) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 28 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(28) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(28) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) isym = 29 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(29) = ( 0 -1 0 ) f =( -0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(29) = ( -0.0000000 -1.0000000 0.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) 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 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(31) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) isym = 32 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(32) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(32) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) isym = 33 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(33) = ( 0 0 -1 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) cart. s(33) = ( -0.0000000 0.0000000 -1.0000000 ) f =( -0.5000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) 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 ) f =( -0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) cart. s(35) = ( 0.0000000 -0.0000000 -1.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) isym = 36 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(36) = ( 0 0 -1 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) cart. s(36) = ( -0.0000000 -0.0000000 1.0000000 ) f =( 0.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) isym = 37 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(37) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) cart. s(37) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) 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 ) f =( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) cart. s(39) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) isym = 40 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(40) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) cart. s(40) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) 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 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) cart. s(42) = ( 0.0000000 1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) isym = 43 inv. 120 deg rotation - cart. axis [1,1,-1] cryst. s(43) = ( 0 0 1 ) f =( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) cart. s(43) = ( 0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) isym = 44 inv. 120 deg rotation - cart. axis [1,-1,1] cryst. s(44) = ( 0 0 -1 ) f =( -0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) cart. s(44) = ( -0.0000000 1.0000000 0.0000000 ) f =( -0.5000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -0.5000000 ) ( -1.0000000 0.0000000 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 ) f =( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) cart. s(46) = ( 0.0000000 0.0000000 -1.0000000 ) f =( 0.0000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) isym = 47 inv. 120 deg rotation - cart. axis [1,-1,-1] cryst. s(47) = ( 0 1 0 ) f =( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) cart. s(47) = ( 0.0000000 -0.0000000 1.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) isym = 48 inv. 120 deg rotation - cart. axis [-1,-1,1] cryst. s(48) = ( 0 -1 0 ) f =( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) cart. s(48) = ( -0.0000000 0.0000000 1.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) 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= 231 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 2) = ( 0.0000000 0.0166667 -0.0000000), wk = 0.0043290 k( 3) = ( 0.0000000 0.0333333 -0.0000000), wk = 0.0043290 k( 4) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0043290 k( 5) = ( 0.0000000 0.0666667 -0.0000000), wk = 0.0043290 k( 6) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0043290 k( 7) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0043290 k( 8) = ( 0.0000000 0.1166667 -0.0000000), wk = 0.0043290 k( 9) = ( 0.0000000 0.1333333 -0.0000000), wk = 0.0043290 k( 10) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0043290 k( 11) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0043290 k( 12) = ( 0.0000000 0.1833333 -0.0000000), wk = 0.0043290 k( 13) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0043290 k( 14) = ( 0.0000000 0.2166667 -0.0000000), wk = 0.0043290 k( 15) = ( 0.0000000 0.2333333 -0.0000000), wk = 0.0043290 k( 16) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0043290 k( 17) = ( 0.0000000 0.2666667 -0.0000000), wk = 0.0043290 k( 18) = ( 0.0000000 0.2833333 -0.0000000), wk = 0.0043290 k( 19) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0043290 k( 20) = ( 0.0000000 0.3166667 -0.0000000), wk = 0.0043290 k( 21) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0043290 k( 22) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0043290 k( 23) = ( 0.0000000 0.3666667 -0.0000000), wk = 0.0043290 k( 24) = ( 0.0000000 0.3833333 -0.0000000), wk = 0.0043290 k( 25) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0043290 k( 26) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0043290 k( 27) = ( 0.0000000 0.4333333 -0.0000000), wk = 0.0043290 k( 28) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0043290 k( 29) = ( 0.0000000 0.4666667 -0.0000000), wk = 0.0043290 k( 30) = ( 0.0000000 0.4833333 -0.0000000), wk = 0.0043290 k( 31) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043290 k( 32) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043290 k( 33) = ( 0.0166667 0.5000000 -0.0000000), wk = 0.0043290 k( 34) = ( 0.0333333 0.5000000 -0.0000000), wk = 0.0043290 k( 35) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0043290 k( 36) = ( 0.0666667 0.5000000 -0.0000000), wk = 0.0043290 k( 37) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0043290 k( 38) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0043290 k( 39) = ( 0.1166667 0.5000000 -0.0000000), wk = 0.0043290 k( 40) = ( 0.1333333 0.5000000 -0.0000000), wk = 0.0043290 k( 41) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0043290 k( 42) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0043290 k( 43) = ( 0.1833333 0.5000000 -0.0000000), wk = 0.0043290 k( 44) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0043290 k( 45) = ( 0.2166667 0.5000000 -0.0000000), wk = 0.0043290 k( 46) = ( 0.2333333 0.5000000 -0.0000000), wk = 0.0043290 k( 47) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0043290 k( 48) = ( 0.2666667 0.5000000 -0.0000000), wk = 0.0043290 k( 49) = ( 0.2833333 0.5000000 -0.0000000), wk = 0.0043290 k( 50) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0043290 k( 51) = ( 0.3166667 0.5000000 -0.0000000), wk = 0.0043290 k( 52) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0043290 k( 53) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0043290 k( 54) = ( 0.3666667 0.5000000 -0.0000000), wk = 0.0043290 k( 55) = ( 0.3833333 0.5000000 -0.0000000), wk = 0.0043290 k( 56) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0043290 k( 57) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0043290 k( 58) = ( 0.4333333 0.5000000 -0.0000000), wk = 0.0043290 k( 59) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0043290 k( 60) = ( 0.4666667 0.5000000 -0.0000000), wk = 0.0043290 k( 61) = ( 0.4833333 0.5000000 -0.0000000), wk = 0.0043290 k( 62) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043290 k( 63) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043290 k( 64) = ( 0.4880952 0.4880952 -0.0000000), wk = 0.0043290 k( 65) = ( 0.4761905 0.4761905 -0.0000000), wk = 0.0043290 k( 66) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0043290 k( 67) = ( 0.4523810 0.4523809 -0.0000000), wk = 0.0043290 k( 68) = ( 0.4404762 0.4404762 -0.0000000), wk = 0.0043290 k( 69) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0043290 k( 70) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0043290 k( 71) = ( 0.4047619 0.4047619 -0.0000000), wk = 0.0043290 k( 72) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0043290 k( 73) = ( 0.3809524 0.3809524 -0.0000000), wk = 0.0043290 k( 74) = ( 0.3690476 0.3690476 -0.0000000), wk = 0.0043290 k( 75) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0043290 k( 76) = ( 0.3452381 0.3452381 -0.0000000), wk = 0.0043290 k( 77) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0043290 k( 78) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0043290 k( 79) = ( 0.3095238 0.3095238 -0.0000000), wk = 0.0043290 k( 80) = ( 0.2976190 0.2976190 -0.0000000), wk = 0.0043290 k( 81) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0043290 k( 82) = ( 0.2738095 0.2738095 -0.0000000), wk = 0.0043290 k( 83) = ( 0.2619048 0.2619048 -0.0000000), wk = 0.0043290 k( 84) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0043290 k( 85) = ( 0.2380952 0.2380952 -0.0000000), wk = 0.0043290 k( 86) = ( 0.2261905 0.2261905 -0.0000000), wk = 0.0043290 k( 87) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0043290 k( 88) = ( 0.2023810 0.2023809 -0.0000000), wk = 0.0043290 k( 89) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0043290 k( 90) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0043290 k( 91) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0043290 k( 92) = ( 0.1547619 0.1547619 -0.0000000), wk = 0.0043290 k( 93) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0043290 k( 94) = ( 0.1309524 0.1309524 -0.0000000), wk = 0.0043290 k( 95) = ( 0.1190476 0.1190476 -0.0000000), wk = 0.0043290 k( 96) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0043290 k( 97) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0043290 k( 98) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0043290 k( 99) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0043290 k( 100) = ( 0.0595238 0.0595238 -0.0000000), wk = 0.0043290 k( 101) = ( 0.0476191 0.0476190 -0.0000000), wk = 0.0043290 k( 102) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0043290 k( 103) = ( 0.0238095 0.0238095 -0.0000000), wk = 0.0043290 k( 104) = ( 0.0119048 0.0119048 -0.0000000), wk = 0.0043290 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 107) = ( 0.0098039 0.0098039 0.0098039), wk = 0.0043290 k( 108) = ( 0.0196078 0.0196078 0.0196078), wk = 0.0043290 k( 109) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0043290 k( 110) = ( 0.0392157 0.0392157 0.0392157), wk = 0.0043290 k( 111) = ( 0.0490196 0.0490196 0.0490196), wk = 0.0043290 k( 112) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0043290 k( 113) = ( 0.0686275 0.0686275 0.0686274), wk = 0.0043290 k( 114) = ( 0.0784314 0.0784314 0.0784314), wk = 0.0043290 k( 115) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0043290 k( 116) = ( 0.0980392 0.0980392 0.0980392), wk = 0.0043290 k( 117) = ( 0.1078431 0.1078431 0.1078431), wk = 0.0043290 k( 118) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0043290 k( 119) = ( 0.1274510 0.1274510 0.1274510), wk = 0.0043290 k( 120) = ( 0.1372549 0.1372549 0.1372549), wk = 0.0043290 k( 121) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0043290 k( 122) = ( 0.1568627 0.1568627 0.1568627), wk = 0.0043290 k( 123) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0043290 k( 124) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0043290 k( 125) = ( 0.1862745 0.1862745 0.1862745), wk = 0.0043290 k( 126) = ( 0.1960784 0.1960784 0.1960784), wk = 0.0043290 k( 127) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0043290 k( 128) = ( 0.2156863 0.2156863 0.2156863), wk = 0.0043290 k( 129) = ( 0.2254902 0.2254902 0.2254902), wk = 0.0043290 k( 130) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0043290 k( 131) = ( 0.2450980 0.2450980 0.2450980), wk = 0.0043290 k( 132) = ( 0.2549020 0.2549020 0.2549020), wk = 0.0043290 k( 133) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0043290 k( 134) = ( 0.2745098 0.2745098 0.2745098), wk = 0.0043290 k( 135) = ( 0.2843137 0.2843137 0.2843137), wk = 0.0043290 k( 136) = ( 0.2941177 0.2941176 0.2941176), wk = 0.0043290 k( 137) = ( 0.3039216 0.3039216 0.3039216), wk = 0.0043290 k( 138) = ( 0.3137255 0.3137255 0.3137255), wk = 0.0043290 k( 139) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0043290 k( 140) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0043290 k( 141) = ( 0.3431373 0.3431372 0.3431372), wk = 0.0043290 k( 142) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0043290 k( 143) = ( 0.3627451 0.3627451 0.3627451), wk = 0.0043290 k( 144) = ( 0.3725490 0.3725490 0.3725490), wk = 0.0043290 k( 145) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0043290 k( 146) = ( 0.3921569 0.3921569 0.3921569), wk = 0.0043290 k( 147) = ( 0.4019608 0.4019608 0.4019608), wk = 0.0043290 k( 148) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0043290 k( 149) = ( 0.4215686 0.4215686 0.4215686), wk = 0.0043290 k( 150) = ( 0.4313726 0.4313725 0.4313725), wk = 0.0043290 k( 151) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0043290 k( 152) = ( 0.4509804 0.4509804 0.4509804), wk = 0.0043290 k( 153) = ( 0.4607843 0.4607843 0.4607843), wk = 0.0043290 k( 154) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0043290 k( 155) = ( 0.4803922 0.4803922 0.4803922), wk = 0.0043290 k( 156) = ( 0.4901961 0.4901961 0.4901961), wk = 0.0043290 k( 157) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 158) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 159) = ( 0.4880952 0.5000000 0.4880952), wk = 0.0043290 k( 160) = ( 0.4761905 0.5000000 0.4761905), wk = 0.0043290 k( 161) = ( 0.4642857 0.5000000 0.4642857), wk = 0.0043290 k( 162) = ( 0.4523810 0.5000000 0.4523809), wk = 0.0043290 k( 163) = ( 0.4404762 0.5000000 0.4404762), wk = 0.0043290 k( 164) = ( 0.4285714 0.5000000 0.4285714), wk = 0.0043290 k( 165) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0043290 k( 166) = ( 0.4047619 0.5000000 0.4047619), wk = 0.0043290 k( 167) = ( 0.3928571 0.5000000 0.3928571), wk = 0.0043290 k( 168) = ( 0.3809524 0.5000000 0.3809524), wk = 0.0043290 k( 169) = ( 0.3690476 0.5000000 0.3690476), wk = 0.0043290 k( 170) = ( 0.3571429 0.5000000 0.3571429), wk = 0.0043290 k( 171) = ( 0.3452381 0.5000000 0.3452381), wk = 0.0043290 k( 172) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0043290 k( 173) = ( 0.3214286 0.5000000 0.3214286), wk = 0.0043290 k( 174) = ( 0.3095238 0.5000000 0.3095238), wk = 0.0043290 k( 175) = ( 0.2976190 0.5000000 0.2976190), wk = 0.0043290 k( 176) = ( 0.2857143 0.5000000 0.2857143), wk = 0.0043290 k( 177) = ( 0.2738095 0.5000000 0.2738095), wk = 0.0043290 k( 178) = ( 0.2619048 0.5000000 0.2619048), wk = 0.0043290 k( 179) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0043290 k( 180) = ( 0.2380952 0.5000000 0.2380952), wk = 0.0043290 k( 181) = ( 0.2261905 0.5000000 0.2261905), wk = 0.0043290 k( 182) = ( 0.2142857 0.5000000 0.2142857), wk = 0.0043290 k( 183) = ( 0.2023810 0.5000000 0.2023809), wk = 0.0043290 k( 184) = ( 0.1904762 0.5000000 0.1904762), wk = 0.0043290 k( 185) = ( 0.1785714 0.5000000 0.1785714), wk = 0.0043290 k( 186) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0043290 k( 187) = ( 0.1547619 0.5000000 0.1547619), wk = 0.0043290 k( 188) = ( 0.1428571 0.5000000 0.1428571), wk = 0.0043290 k( 189) = ( 0.1309524 0.5000000 0.1309524), wk = 0.0043290 k( 190) = ( 0.1190476 0.5000000 0.1190476), wk = 0.0043290 k( 191) = ( 0.1071429 0.5000000 0.1071429), wk = 0.0043290 k( 192) = ( 0.0952381 0.5000000 0.0952381), wk = 0.0043290 k( 193) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0043290 k( 194) = ( 0.0714286 0.5000000 0.0714286), wk = 0.0043290 k( 195) = ( 0.0595238 0.5000000 0.0595238), wk = 0.0043290 k( 196) = ( 0.0476191 0.5000000 0.0476190), wk = 0.0043290 k( 197) = ( 0.0357143 0.5000000 0.0357143), wk = 0.0043290 k( 198) = ( 0.0238095 0.5000000 0.0238095), wk = 0.0043290 k( 199) = ( 0.0119048 0.5000000 0.0119048), wk = 0.0043290 k( 200) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043290 k( 201) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0043290 k( 202) = ( 0.5000000 0.5000000 0.0166667), wk = 0.0043290 k( 203) = ( 0.5000000 0.5000000 0.0333333), wk = 0.0043290 k( 204) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0043290 k( 205) = ( 0.5000000 0.5000000 0.0666667), wk = 0.0043290 k( 206) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0043290 k( 207) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0043290 k( 208) = ( 0.5000000 0.5000000 0.1166667), wk = 0.0043290 k( 209) = ( 0.5000000 0.5000000 0.1333333), wk = 0.0043290 k( 210) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0043290 k( 211) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0043290 k( 212) = ( 0.5000000 0.5000000 0.1833333), wk = 0.0043290 k( 213) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0043290 k( 214) = ( 0.5000000 0.5000000 0.2166667), wk = 0.0043290 k( 215) = ( 0.5000000 0.5000000 0.2333333), wk = 0.0043290 k( 216) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0043290 k( 217) = ( 0.5000000 0.5000000 0.2666667), wk = 0.0043290 k( 218) = ( 0.5000000 0.5000000 0.2833333), wk = 0.0043290 k( 219) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0043290 k( 220) = ( 0.5000000 0.5000000 0.3166667), wk = 0.0043290 k( 221) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0043290 k( 222) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0043290 k( 223) = ( 0.5000000 0.5000000 0.3666667), wk = 0.0043290 k( 224) = ( 0.5000000 0.5000000 0.3833333), wk = 0.0043290 k( 225) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0043290 k( 226) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0043290 k( 227) = ( 0.5000000 0.5000000 0.4333333), wk = 0.0043290 k( 228) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0043290 k( 229) = ( 0.5000000 0.5000000 0.4666667), wk = 0.0043290 k( 230) = ( 0.5000000 0.5000000 0.4833333), wk = 0.0043290 k( 231) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 2) = ( 0.0000000 0.0166667 0.0000000), wk = 0.0043290 k( 3) = ( 0.0000000 0.0333333 0.0000000), wk = 0.0043290 k( 4) = ( 0.0000000 0.0500000 0.0000000), wk = 0.0043290 k( 5) = ( 0.0000000 0.0666667 0.0000000), wk = 0.0043290 k( 6) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0043290 k( 7) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0043290 k( 8) = ( 0.0000000 0.1166667 0.0000000), wk = 0.0043290 k( 9) = ( 0.0000000 0.1333333 0.0000000), wk = 0.0043290 k( 10) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0043290 k( 11) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0043290 k( 12) = ( 0.0000000 0.1833333 0.0000000), wk = 0.0043290 k( 13) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0043290 k( 14) = ( 0.0000000 0.2166667 0.0000000), wk = 0.0043290 k( 15) = ( 0.0000000 0.2333333 0.0000000), wk = 0.0043290 k( 16) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0043290 k( 17) = ( 0.0000000 0.2666667 0.0000000), wk = 0.0043290 k( 18) = ( 0.0000000 0.2833333 0.0000000), wk = 0.0043290 k( 19) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0043290 k( 20) = ( 0.0000000 0.3166667 0.0000000), wk = 0.0043290 k( 21) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0043290 k( 22) = ( 0.0000000 0.3500000 0.0000000), wk = 0.0043290 k( 23) = ( 0.0000000 0.3666667 0.0000000), wk = 0.0043290 k( 24) = ( 0.0000000 0.3833333 0.0000000), wk = 0.0043290 k( 25) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0043290 k( 26) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0043290 k( 27) = ( 0.0000000 0.4333333 0.0000000), wk = 0.0043290 k( 28) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0043290 k( 29) = ( 0.0000000 0.4666667 0.0000000), wk = 0.0043290 k( 30) = ( 0.0000000 0.4833333 0.0000000), wk = 0.0043290 k( 31) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043290 k( 32) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043290 k( 33) = ( 0.0166667 0.5000000 0.0000000), wk = 0.0043290 k( 34) = ( 0.0333333 0.5000000 0.0000000), wk = 0.0043290 k( 35) = ( 0.0500000 0.5000000 0.0000000), wk = 0.0043290 k( 36) = ( 0.0666667 0.5000000 0.0000000), wk = 0.0043290 k( 37) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0043290 k( 38) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0043290 k( 39) = ( 0.1166667 0.5000000 0.0000000), wk = 0.0043290 k( 40) = ( 0.1333333 0.5000000 0.0000000), wk = 0.0043290 k( 41) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0043290 k( 42) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0043290 k( 43) = ( 0.1833333 0.5000000 0.0000000), wk = 0.0043290 k( 44) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0043290 k( 45) = ( 0.2166667 0.5000000 0.0000000), wk = 0.0043290 k( 46) = ( 0.2333333 0.5000000 0.0000000), wk = 0.0043290 k( 47) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0043290 k( 48) = ( 0.2666667 0.5000000 0.0000000), wk = 0.0043290 k( 49) = ( 0.2833333 0.5000000 0.0000000), wk = 0.0043290 k( 50) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0043290 k( 51) = ( 0.3166667 0.5000000 0.0000000), wk = 0.0043290 k( 52) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0043290 k( 53) = ( 0.3500000 0.5000000 0.0000000), wk = 0.0043290 k( 54) = ( 0.3666667 0.5000000 -0.0000000), wk = 0.0043290 k( 55) = ( 0.3833333 0.5000000 0.0000000), wk = 0.0043290 k( 56) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0043290 k( 57) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0043290 k( 58) = ( 0.4333333 0.5000000 0.0000000), wk = 0.0043290 k( 59) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0043290 k( 60) = ( 0.4666667 0.5000000 0.0000000), wk = 0.0043290 k( 61) = ( 0.4833333 0.5000000 0.0000000), wk = 0.0043290 k( 62) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043290 k( 63) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043290 k( 64) = ( 0.4880952 0.4880952 0.0000000), wk = 0.0043290 k( 65) = ( 0.4761905 0.4761905 0.0000000), wk = 0.0043290 k( 66) = ( 0.4642857 0.4642857 0.0000000), wk = 0.0043290 k( 67) = ( 0.4523810 0.4523810 -0.0000000), wk = 0.0043290 k( 68) = ( 0.4404762 0.4404762 0.0000000), wk = 0.0043290 k( 69) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0043290 k( 70) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0043290 k( 71) = ( 0.4047619 0.4047619 -0.0000000), wk = 0.0043290 k( 72) = ( 0.3928571 0.3928571 0.0000000), wk = 0.0043290 k( 73) = ( 0.3809524 0.3809524 0.0000000), wk = 0.0043290 k( 74) = ( 0.3690476 0.3690476 0.0000000), wk = 0.0043290 k( 75) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0043290 k( 76) = ( 0.3452381 0.3452381 0.0000000), wk = 0.0043290 k( 77) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0043290 k( 78) = ( 0.3214286 0.3214286 0.0000000), wk = 0.0043290 k( 79) = ( 0.3095238 0.3095238 0.0000000), wk = 0.0043290 k( 80) = ( 0.2976190 0.2976190 0.0000000), wk = 0.0043290 k( 81) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0043290 k( 82) = ( 0.2738095 0.2738095 0.0000000), wk = 0.0043290 k( 83) = ( 0.2619048 0.2619048 0.0000000), wk = 0.0043290 k( 84) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0043290 k( 85) = ( 0.2380952 0.2380952 0.0000000), wk = 0.0043290 k( 86) = ( 0.2261905 0.2261905 0.0000000), wk = 0.0043290 k( 87) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0043290 k( 88) = ( 0.2023810 0.2023810 -0.0000000), wk = 0.0043290 k( 89) = ( 0.1904762 0.1904762 0.0000000), wk = 0.0043290 k( 90) = ( 0.1785714 0.1785714 0.0000000), wk = 0.0043290 k( 91) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0043290 k( 92) = ( 0.1547619 0.1547619 -0.0000000), wk = 0.0043290 k( 93) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0043290 k( 94) = ( 0.1309524 0.1309524 0.0000000), wk = 0.0043290 k( 95) = ( 0.1190476 0.1190476 0.0000000), wk = 0.0043290 k( 96) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0043290 k( 97) = ( 0.0952381 0.0952381 0.0000000), wk = 0.0043290 k( 98) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0043290 k( 99) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0043290 k( 100) = ( 0.0595238 0.0595238 0.0000000), wk = 0.0043290 k( 101) = ( 0.0476191 0.0476191 0.0000000), wk = 0.0043290 k( 102) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0043290 k( 103) = ( 0.0238095 0.0238095 0.0000000), wk = 0.0043290 k( 104) = ( 0.0119048 0.0119048 0.0000000), wk = 0.0043290 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 107) = ( 0.0098039 0.0098039 0.0098039), wk = 0.0043290 k( 108) = ( 0.0196078 0.0196078 0.0196078), wk = 0.0043290 k( 109) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0043290 k( 110) = ( 0.0392157 0.0392157 0.0392157), wk = 0.0043290 k( 111) = ( 0.0490196 0.0490196 0.0490196), wk = 0.0043290 k( 112) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0043290 k( 113) = ( 0.0686275 0.0686275 0.0686275), wk = 0.0043290 k( 114) = ( 0.0784314 0.0784314 0.0784314), wk = 0.0043290 k( 115) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0043290 k( 116) = ( 0.0980392 0.0980392 0.0980392), wk = 0.0043290 k( 117) = ( 0.1078431 0.1078431 0.1078431), wk = 0.0043290 k( 118) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0043290 k( 119) = ( 0.1274510 0.1274510 0.1274510), wk = 0.0043290 k( 120) = ( 0.1372549 0.1372549 0.1372549), wk = 0.0043290 k( 121) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0043290 k( 122) = ( 0.1568627 0.1568627 0.1568627), wk = 0.0043290 k( 123) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0043290 k( 124) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0043290 k( 125) = ( 0.1862745 0.1862745 0.1862745), wk = 0.0043290 k( 126) = ( 0.1960784 0.1960784 0.1960784), wk = 0.0043290 k( 127) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0043290 k( 128) = ( 0.2156863 0.2156863 0.2156863), wk = 0.0043290 k( 129) = ( 0.2254902 0.2254902 0.2254902), wk = 0.0043290 k( 130) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0043290 k( 131) = ( 0.2450980 0.2450980 0.2450980), wk = 0.0043290 k( 132) = ( 0.2549020 0.2549020 0.2549020), wk = 0.0043290 k( 133) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0043290 k( 134) = ( 0.2745098 0.2745098 0.2745098), wk = 0.0043290 k( 135) = ( 0.2843137 0.2843137 0.2843137), wk = 0.0043290 k( 136) = ( 0.2941177 0.2941177 0.2941177), wk = 0.0043290 k( 137) = ( 0.3039216 0.3039216 0.3039216), wk = 0.0043290 k( 138) = ( 0.3137255 0.3137255 0.3137255), wk = 0.0043290 k( 139) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0043290 k( 140) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0043290 k( 141) = ( 0.3431373 0.3431373 0.3431373), wk = 0.0043290 k( 142) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0043290 k( 143) = ( 0.3627451 0.3627451 0.3627451), wk = 0.0043290 k( 144) = ( 0.3725490 0.3725490 0.3725490), wk = 0.0043290 k( 145) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0043290 k( 146) = ( 0.3921569 0.3921569 0.3921569), wk = 0.0043290 k( 147) = ( 0.4019608 0.4019608 0.4019608), wk = 0.0043290 k( 148) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0043290 k( 149) = ( 0.4215686 0.4215686 0.4215686), wk = 0.0043290 k( 150) = ( 0.4313726 0.4313726 0.4313726), wk = 0.0043290 k( 151) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0043290 k( 152) = ( 0.4509804 0.4509804 0.4509804), wk = 0.0043290 k( 153) = ( 0.4607843 0.4607843 0.4607843), wk = 0.0043290 k( 154) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0043290 k( 155) = ( 0.4803922 0.4803922 0.4803922), wk = 0.0043290 k( 156) = ( 0.4901961 0.4901961 0.4901961), wk = 0.0043290 k( 157) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 158) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 k( 159) = ( 0.4880952 0.5000000 0.4880952), wk = 0.0043290 k( 160) = ( 0.4761905 0.5000000 0.4761905), wk = 0.0043290 k( 161) = ( 0.4642857 0.5000000 0.4642857), wk = 0.0043290 k( 162) = ( 0.4523810 0.5000000 0.4523810), wk = 0.0043290 k( 163) = ( 0.4404762 0.5000000 0.4404762), wk = 0.0043290 k( 164) = ( 0.4285714 0.5000000 0.4285714), wk = 0.0043290 k( 165) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0043290 k( 166) = ( 0.4047619 0.5000000 0.4047619), wk = 0.0043290 k( 167) = ( 0.3928571 0.5000000 0.3928571), wk = 0.0043290 k( 168) = ( 0.3809524 0.5000000 0.3809524), wk = 0.0043290 k( 169) = ( 0.3690476 0.5000000 0.3690476), wk = 0.0043290 k( 170) = ( 0.3571429 0.5000000 0.3571429), wk = 0.0043290 k( 171) = ( 0.3452381 0.5000000 0.3452381), wk = 0.0043290 k( 172) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0043290 k( 173) = ( 0.3214286 0.5000000 0.3214286), wk = 0.0043290 k( 174) = ( 0.3095238 0.5000000 0.3095238), wk = 0.0043290 k( 175) = ( 0.2976190 0.5000000 0.2976190), wk = 0.0043290 k( 176) = ( 0.2857143 0.5000000 0.2857143), wk = 0.0043290 k( 177) = ( 0.2738095 0.5000000 0.2738095), wk = 0.0043290 k( 178) = ( 0.2619048 0.5000000 0.2619048), wk = 0.0043290 k( 179) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0043290 k( 180) = ( 0.2380952 0.5000000 0.2380952), wk = 0.0043290 k( 181) = ( 0.2261905 0.5000000 0.2261905), wk = 0.0043290 k( 182) = ( 0.2142857 0.5000000 0.2142857), wk = 0.0043290 k( 183) = ( 0.2023810 0.5000000 0.2023810), wk = 0.0043290 k( 184) = ( 0.1904762 0.5000000 0.1904762), wk = 0.0043290 k( 185) = ( 0.1785714 0.5000000 0.1785714), wk = 0.0043290 k( 186) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0043290 k( 187) = ( 0.1547619 0.5000000 0.1547619), wk = 0.0043290 k( 188) = ( 0.1428571 0.5000000 0.1428571), wk = 0.0043290 k( 189) = ( 0.1309524 0.5000000 0.1309524), wk = 0.0043290 k( 190) = ( 0.1190476 0.5000000 0.1190476), wk = 0.0043290 k( 191) = ( 0.1071429 0.5000000 0.1071429), wk = 0.0043290 k( 192) = ( 0.0952381 0.5000000 0.0952381), wk = 0.0043290 k( 193) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0043290 k( 194) = ( 0.0714286 0.5000000 0.0714286), wk = 0.0043290 k( 195) = ( 0.0595238 0.5000000 0.0595238), wk = 0.0043290 k( 196) = ( 0.0476191 0.5000000 0.0476191), wk = 0.0043290 k( 197) = ( 0.0357143 0.5000000 0.0357143), wk = 0.0043290 k( 198) = ( 0.0238095 0.5000000 0.0238095), wk = 0.0043290 k( 199) = ( 0.0119048 0.5000000 0.0119048), wk = 0.0043290 k( 200) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0043290 k( 201) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043290 k( 202) = ( 0.5000000 0.5000000 0.0166667), wk = 0.0043290 k( 203) = ( 0.5000000 0.5000000 0.0333333), wk = 0.0043290 k( 204) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0043290 k( 205) = ( 0.5000000 0.5000000 0.0666667), wk = 0.0043290 k( 206) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0043290 k( 207) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0043290 k( 208) = ( 0.5000000 0.5000000 0.1166667), wk = 0.0043290 k( 209) = ( 0.5000000 0.5000000 0.1333333), wk = 0.0043290 k( 210) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0043290 k( 211) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0043290 k( 212) = ( 0.5000000 0.5000000 0.1833333), wk = 0.0043290 k( 213) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0043290 k( 214) = ( 0.5000000 0.5000000 0.2166667), wk = 0.0043290 k( 215) = ( 0.5000000 0.5000000 0.2333333), wk = 0.0043290 k( 216) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0043290 k( 217) = ( 0.5000000 0.5000000 0.2666667), wk = 0.0043290 k( 218) = ( 0.5000000 0.5000000 0.2833333), wk = 0.0043290 k( 219) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0043290 k( 220) = ( 0.5000000 0.5000000 0.3166667), wk = 0.0043290 k( 221) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0043290 k( 222) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0043290 k( 223) = ( 0.5000000 0.5000000 0.3666667), wk = 0.0043290 k( 224) = ( 0.5000000 0.5000000 0.3833333), wk = 0.0043290 k( 225) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0043290 k( 226) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0043290 k( 227) = ( 0.5000000 0.5000000 0.4333333), wk = 0.0043290 k( 228) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0043290 k( 229) = ( 0.5000000 0.5000000 0.4666667), wk = 0.0043290 k( 230) = ( 0.5000000 0.5000000 0.4833333), wk = 0.0043290 k( 231) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043290 Dense grid: 101673 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 50883 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.43 Mb ( 372, 76) NL pseudopotentials 0.51 Mb ( 186, 180) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2822) G-vector shells 0.00 Mb ( 558) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.73 Mb ( 372, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.42 Mb ( 180, 2, 76) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./SiF4.save/charge-density.dat Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.6 secs Computing kpt #: 2 total cpu time spent up to now is 3.4 secs Computing kpt #: 3 total cpu time spent up to now is 4.1 secs Computing kpt #: 4 total cpu time spent up to now is 4.9 secs Computing kpt #: 5 total cpu time spent up to now is 5.6 secs Computing kpt #: 6 total cpu time spent up to now is 6.4 secs Computing kpt #: 7 total cpu time spent up to now is 7.1 secs Computing kpt #: 8 total cpu time spent up to now is 7.9 secs Computing kpt #: 9 total cpu time spent up to now is 8.6 secs Computing kpt #: 10 total cpu time spent up to now is 9.4 secs Computing kpt #: 11 total cpu time spent up to now is 10.2 secs Computing kpt #: 12 total cpu time spent up to now is 10.9 secs Computing kpt #: 13 total cpu time spent up to now is 11.7 secs Computing kpt #: 14 total cpu time spent up to now is 12.5 secs Computing kpt #: 15 total cpu time spent up to now is 13.3 secs Computing kpt #: 16 total cpu time spent up to now is 14.1 secs Computing kpt #: 17 total cpu time spent up to now is 14.8 secs Computing kpt #: 18 total cpu time spent up to now is 15.6 secs Computing kpt #: 19 total cpu time spent up to now is 16.4 secs Computing kpt #: 20 total cpu time spent up to now is 17.2 secs Computing kpt #: 21 total cpu time spent up to now is 18.0 secs Computing kpt #: 22 total cpu time spent up to now is 18.7 secs Computing kpt #: 23 total cpu time spent up to now is 19.5 secs Computing kpt #: 24 total cpu time spent up to now is 20.3 secs Computing kpt #: 25 total cpu time spent up to now is 21.1 secs Computing kpt #: 26 total cpu time spent up to now is 21.9 secs Computing kpt #: 27 total cpu time spent up to now is 22.7 secs Computing kpt #: 28 total cpu time spent up to now is 23.4 secs Computing kpt #: 29 total cpu time spent up to now is 24.2 secs Computing kpt #: 30 total cpu time spent up to now is 25.0 secs Computing kpt #: 31 total cpu time spent up to now is 25.8 secs Computing kpt #: 32 total cpu time spent up to now is 26.7 secs Computing kpt #: 33 total cpu time spent up to now is 27.5 secs Computing kpt #: 34 total cpu time spent up to now is 28.3 secs Computing kpt #: 35 total cpu time spent up to now is 29.1 secs Computing kpt #: 36 total cpu time spent up to now is 29.9 secs Computing kpt #: 37 total cpu time spent up to now is 30.7 secs Computing kpt #: 38 total cpu time spent up to now is 31.6 secs Computing kpt #: 39 total cpu time spent up to now is 32.4 secs Computing kpt #: 40 total cpu time spent up to now is 33.2 secs Computing kpt #: 41 total cpu time spent up to now is 34.0 secs Computing kpt #: 42 total cpu time spent up to now is 34.8 secs Computing kpt #: 43 total cpu time spent up to now is 35.6 secs Computing kpt #: 44 total cpu time spent up to now is 36.4 secs Computing kpt #: 45 total cpu time spent up to now is 37.2 secs Computing kpt #: 46 total cpu time spent up to now is 38.0 secs Computing kpt #: 47 total cpu time spent up to now is 38.7 secs Computing kpt #: 48 total cpu time spent up to now is 39.5 secs Computing kpt #: 49 total cpu time spent up to now is 40.3 secs Computing kpt #: 50 total cpu time spent up to now is 41.1 secs Computing kpt #: 51 total cpu time spent up to now is 41.9 secs Computing kpt #: 52 total cpu time spent up to now is 42.6 secs Computing kpt #: 53 total cpu time spent up to now is 43.4 secs Computing kpt #: 54 total cpu time spent up to now is 44.2 secs Computing kpt #: 55 total cpu time spent up to now is 45.0 secs Computing kpt #: 56 total cpu time spent up to now is 45.8 secs Computing kpt #: 57 total cpu time spent up to now is 46.6 secs Computing kpt #: 58 total cpu time spent up to now is 47.3 secs Computing kpt #: 59 total cpu time spent up to now is 48.1 secs Computing kpt #: 60 total cpu time spent up to now is 48.9 secs Computing kpt #: 61 total cpu time spent up to now is 49.6 secs Computing kpt #: 62 total cpu time spent up to now is 50.4 secs Computing kpt #: 63 total cpu time spent up to now is 51.1 secs Computing kpt #: 64 total cpu time spent up to now is 51.9 secs Computing kpt #: 65 total cpu time spent up to now is 52.7 secs Computing kpt #: 66 total cpu time spent up to now is 53.5 secs Computing kpt #: 67 total cpu time spent up to now is 54.4 secs Computing kpt #: 68 total cpu time spent up to now is 55.3 secs Computing kpt #: 69 total cpu time spent up to now is 56.1 secs Computing kpt #: 70 total cpu time spent up to now is 56.8 secs Computing kpt #: 71 total cpu time spent up to now is 57.6 secs Computing kpt #: 72 total cpu time spent up to now is 58.4 secs Computing kpt #: 73 total cpu time spent up to now is 59.2 secs Computing kpt #: 74 total cpu time spent up to now is 60.0 secs Computing kpt #: 75 total cpu time spent up to now is 60.7 secs Computing kpt #: 76 total cpu time spent up to now is 61.5 secs Computing kpt #: 77 total cpu time spent up to now is 62.3 secs Computing kpt #: 78 total cpu time spent up to now is 63.1 secs Computing kpt #: 79 total cpu time spent up to now is 63.9 secs Computing kpt #: 80 total cpu time spent up to now is 64.7 secs Computing kpt #: 81 total cpu time spent up to now is 65.6 secs Computing kpt #: 82 total cpu time spent up to now is 66.4 secs Computing kpt #: 83 total cpu time spent up to now is 67.2 secs Computing kpt #: 84 total cpu time spent up to now is 68.0 secs Computing kpt #: 85 total cpu time spent up to now is 68.9 secs Computing kpt #: 86 total cpu time spent up to now is 69.7 secs Computing kpt #: 87 total cpu time spent up to now is 70.8 secs Computing kpt #: 88 total cpu time spent up to now is 71.6 secs Computing kpt #: 89 total cpu time spent up to now is 72.4 secs Computing kpt #: 90 total cpu time spent up to now is 73.2 secs Computing kpt #: 91 total cpu time spent up to now is 74.0 secs Computing kpt #: 92 total cpu time spent up to now is 74.8 secs Computing kpt #: 93 total cpu time spent up to now is 75.6 secs Computing kpt #: 94 total cpu time spent up to now is 76.4 secs Computing kpt #: 95 total cpu time spent up to now is 77.2 secs Computing kpt #: 96 total cpu time spent up to now is 78.0 secs Computing kpt #: 97 total cpu time spent up to now is 78.7 secs Computing kpt #: 98 total cpu time spent up to now is 79.5 secs Computing kpt #: 99 total cpu time spent up to now is 80.2 secs Computing kpt #: 100 total cpu time spent up to now is 80.9 secs Computing kpt #: 101 total cpu time spent up to now is 81.7 secs Computing kpt #: 102 total cpu time spent up to now is 82.4 secs Computing kpt #: 103 total cpu time spent up to now is 83.2 secs Computing kpt #: 104 total cpu time spent up to now is 83.9 secs Computing kpt #: 105 total cpu time spent up to now is 84.6 secs Computing kpt #: 106 total cpu time spent up to now is 85.4 secs Computing kpt #: 107 total cpu time spent up to now is 86.1 secs Computing kpt #: 108 total cpu time spent up to now is 86.8 secs Computing kpt #: 109 total cpu time spent up to now is 87.6 secs Computing kpt #: 110 total cpu time spent up to now is 88.3 secs Computing kpt #: 111 total cpu time spent up to now is 89.1 secs Computing kpt #: 112 total cpu time spent up to now is 89.8 secs Computing kpt #: 113 total cpu time spent up to now is 90.5 secs Computing kpt #: 114 total cpu time spent up to now is 91.3 secs Computing kpt #: 115 total cpu time spent up to now is 92.0 secs Computing kpt #: 116 total cpu time spent up to now is 92.8 secs Computing kpt #: 117 total cpu time spent up to now is 93.5 secs Computing kpt #: 118 total cpu time spent up to now is 94.3 secs Computing kpt #: 119 total cpu time spent up to now is 95.1 secs Computing kpt #: 120 total cpu time spent up to now is 95.9 secs Computing kpt #: 121 total cpu time spent up to now is 96.7 secs Computing kpt #: 122 total cpu time spent up to now is 97.5 secs Computing kpt #: 123 total cpu time spent up to now is 98.3 secs Computing kpt #: 124 total cpu time spent up to now is 99.1 secs Computing kpt #: 125 total cpu time spent up to now is 99.9 secs Computing kpt #: 126 total cpu time spent up to now is 100.7 secs Computing kpt #: 127 total cpu time spent up to now is 101.6 secs Computing kpt #: 128 total cpu time spent up to now is 102.5 secs Computing kpt #: 129 total cpu time spent up to now is 103.6 secs Computing kpt #: 130 total cpu time spent up to now is 104.6 secs Computing kpt #: 131 total cpu time spent up to now is 105.6 secs Computing kpt #: 132 total cpu time spent up to now is 106.6 secs Computing kpt #: 133 total cpu time spent up to now is 107.6 secs Computing kpt #: 134 total cpu time spent up to now is 108.5 secs Computing kpt #: 135 total cpu time spent up to now is 109.5 secs Computing kpt #: 136 total cpu time spent up to now is 110.5 secs Computing kpt #: 137 total cpu time spent up to now is 111.5 secs Computing kpt #: 138 total cpu time spent up to now is 112.3 secs Computing kpt #: 139 total cpu time spent up to now is 113.2 secs Computing kpt #: 140 total cpu time spent up to now is 114.1 secs Computing kpt #: 141 total cpu time spent up to now is 115.1 secs Computing kpt #: 142 total cpu time spent up to now is 116.1 secs Computing kpt #: 143 total cpu time spent up to now is 117.0 secs Computing kpt #: 144 total cpu time spent up to now is 118.0 secs Computing kpt #: 145 total cpu time spent up to now is 118.9 secs Computing kpt #: 146 total cpu time spent up to now is 119.8 secs Computing kpt #: 147 total cpu time spent up to now is 120.8 secs Computing kpt #: 148 total cpu time spent up to now is 121.7 secs Computing kpt #: 149 total cpu time spent up to now is 122.7 secs Computing kpt #: 150 total cpu time spent up to now is 123.5 secs Computing kpt #: 151 total cpu time spent up to now is 124.4 secs Computing kpt #: 152 total cpu time spent up to now is 125.3 secs Computing kpt #: 153 total cpu time spent up to now is 126.2 secs Computing kpt #: 154 total cpu time spent up to now is 127.1 secs Computing kpt #: 155 total cpu time spent up to now is 127.9 secs Computing kpt #: 156 total cpu time spent up to now is 128.7 secs Computing kpt #: 157 total cpu time spent up to now is 129.7 secs Computing kpt #: 158 total cpu time spent up to now is 130.5 secs Computing kpt #: 159 total cpu time spent up to now is 131.3 secs Computing kpt #: 160 total cpu time spent up to now is 132.1 secs Computing kpt #: 161 total cpu time spent up to now is 133.0 secs Computing kpt #: 162 total cpu time spent up to now is 133.8 secs Computing kpt #: 163 total cpu time spent up to now is 134.6 secs Computing kpt #: 164 total cpu time spent up to now is 135.4 secs Computing kpt #: 165 total cpu time spent up to now is 136.1 secs Computing kpt #: 166 total cpu time spent up to now is 136.9 secs Computing kpt #: 167 total cpu time spent up to now is 137.7 secs Computing kpt #: 168 total cpu time spent up to now is 138.5 secs Computing kpt #: 169 total cpu time spent up to now is 139.2 secs Computing kpt #: 170 total cpu time spent up to now is 140.0 secs Computing kpt #: 171 total cpu time spent up to now is 140.8 secs Computing kpt #: 172 total cpu time spent up to now is 141.6 secs Computing kpt #: 173 total cpu time spent up to now is 142.3 secs Computing kpt #: 174 total cpu time spent up to now is 143.1 secs Computing kpt #: 175 total cpu time spent up to now is 143.8 secs Computing kpt #: 176 total cpu time spent up to now is 144.6 secs Computing kpt #: 177 total cpu time spent up to now is 145.3 secs Computing kpt #: 178 total cpu time spent up to now is 146.0 secs Computing kpt #: 179 total cpu time spent up to now is 146.8 secs Computing kpt #: 180 total cpu time spent up to now is 147.5 secs Computing kpt #: 181 total cpu time spent up to now is 148.3 secs Computing kpt #: 182 total cpu time spent up to now is 149.0 secs Computing kpt #: 183 total cpu time spent up to now is 149.8 secs Computing kpt #: 184 total cpu time spent up to now is 150.6 secs Computing kpt #: 185 total cpu time spent up to now is 151.4 secs Computing kpt #: 186 total cpu time spent up to now is 152.2 secs Computing kpt #: 187 total cpu time spent up to now is 153.0 secs Computing kpt #: 188 total cpu time spent up to now is 153.8 secs Computing kpt #: 189 total cpu time spent up to now is 154.6 secs Computing kpt #: 190 total cpu time spent up to now is 155.4 secs Computing kpt #: 191 total cpu time spent up to now is 156.3 secs Computing kpt #: 192 total cpu time spent up to now is 157.1 secs Computing kpt #: 193 total cpu time spent up to now is 158.0 secs Computing kpt #: 194 total cpu time spent up to now is 158.9 secs Computing kpt #: 195 total cpu time spent up to now is 159.7 secs Computing kpt #: 196 total cpu time spent up to now is 160.5 secs Computing kpt #: 197 total cpu time spent up to now is 161.3 secs Computing kpt #: 198 total cpu time spent up to now is 162.1 secs Computing kpt #: 199 total cpu time spent up to now is 163.0 secs Computing kpt #: 200 total cpu time spent up to now is 163.8 secs Computing kpt #: 201 total cpu time spent up to now is 164.5 secs Computing kpt #: 202 total cpu time spent up to now is 165.3 secs Computing kpt #: 203 total cpu time spent up to now is 166.1 secs Computing kpt #: 204 total cpu time spent up to now is 166.8 secs Computing kpt #: 205 total cpu time spent up to now is 167.6 secs Computing kpt #: 206 total cpu time spent up to now is 168.3 secs Computing kpt #: 207 total cpu time spent up to now is 169.1 secs Computing kpt #: 208 total cpu time spent up to now is 169.9 secs Computing kpt #: 209 total cpu time spent up to now is 170.7 secs Computing kpt #: 210 total cpu time spent up to now is 171.5 secs Computing kpt #: 211 total cpu time spent up to now is 172.3 secs Computing kpt #: 212 total cpu time spent up to now is 173.1 secs Computing kpt #: 213 total cpu time spent up to now is 174.0 secs Computing kpt #: 214 total cpu time spent up to now is 174.9 secs Computing kpt #: 215 total cpu time spent up to now is 175.9 secs Computing kpt #: 216 total cpu time spent up to now is 176.8 secs Computing kpt #: 217 total cpu time spent up to now is 177.8 secs Computing kpt #: 218 total cpu time spent up to now is 178.8 secs Computing kpt #: 219 total cpu time spent up to now is 179.8 secs Computing kpt #: 220 total cpu time spent up to now is 180.8 secs Computing kpt #: 221 total cpu time spent up to now is 181.8 secs Computing kpt #: 222 total cpu time spent up to now is 182.8 secs Computing kpt #: 223 total cpu time spent up to now is 183.7 secs Computing kpt #: 224 total cpu time spent up to now is 184.7 secs Computing kpt #: 225 total cpu time spent up to now is 185.7 secs Computing kpt #: 226 total cpu time spent up to now is 186.6 secs Computing kpt #: 227 total cpu time spent up to now is 187.6 secs Computing kpt #: 228 total cpu time spent up to now is 188.5 secs Computing kpt #: 229 total cpu time spent up to now is 189.5 secs Computing kpt #: 230 total cpu time spent up to now is 190.3 secs Computing kpt #: 231 total cpu time spent up to now is 191.1 secs ethr = 1.56E-08, avg # of iterations = 17.7 total cpu time spent up to now is 191.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6403 PWs) bands (ev): -25.4111 -25.4111 -24.9054 -24.9054 -24.9011 -24.9011 -24.9011 -24.9011 -22.4231 -22.4231 -21.4506 -21.4506 -21.4428 -21.4428 -21.4428 -21.4428 -10.9269 -10.9269 -8.8927 -8.8927 -8.8870 -8.8870 -8.8870 -8.8870 -5.3575 -5.3575 -5.3575 -5.3575 -5.2665 -5.2665 -5.2424 -5.2424 -5.2424 -5.2424 -4.3980 -4.3980 -4.3693 -4.3693 -4.3693 -4.3693 -3.0228 -3.0228 -2.9815 -2.9815 -2.9815 -2.9815 -2.6964 -2.6964 -2.6820 -2.6820 -2.6820 -2.6820 -1.5477 -1.5477 -1.5135 -1.5135 -1.5135 -1.5135 0.8093 0.8093 0.8391 0.8391 0.8391 0.8391 4.5986 4.5986 8.5871 8.5871 8.5992 8.5992 8.5992 8.5992 9.4413 9.4413 9.7406 9.7406 k = 0.0000 0.0167-0.0000 ( 6403 PWs) bands (ev): -25.4109 -25.4109 -24.9056 -24.9056 -24.9014 -24.9014 -24.9011 -24.9011 -22.4224 -22.4224 -21.4508 -21.4508 -21.4432 -21.4432 -21.4428 -21.4428 -10.9257 -10.9257 -8.8935 -8.8935 -8.8880 -8.8880 -8.8870 -8.8870 -5.3574 -5.3574 -5.3571 -5.3571 -5.2662 -5.2662 -5.2423 -5.2423 -5.2419 -5.2419 -4.3990 -4.3990 -4.3703 -4.3703 -4.3702 -4.3702 -3.0228 -3.0228 -2.9825 -2.9825 -2.9806 -2.9806 -2.6919 -2.6919 -2.6822 -2.6822 -2.6807 -2.6807 -1.5484 -1.5484 -1.5142 -1.5142 -1.5141 -1.5141 0.8086 0.8086 0.8374 0.8374 0.8394 0.8394 4.6011 4.6011 8.5847 8.5847 8.5965 8.5965 8.6000 8.6000 9.4425 9.4425 9.7427 9.7427 k = 0.0000 0.0333-0.0000 ( 6391 PWs) bands (ev): -25.4100 -25.4100 -24.9062 -24.9062 -24.9022 -24.9022 -24.9011 -24.9011 -22.4201 -22.4201 -21.4516 -21.4516 -21.4443 -21.4443 -21.4428 -21.4428 -10.9222 -10.9222 -8.8973 -8.8973 -8.8898 -8.8898 -8.8871 -8.8871 -5.3571 -5.3571 -5.3557 -5.3557 -5.2654 -5.2654 -5.2420 -5.2420 -5.2405 -5.2405 -4.4018 -4.4018 -4.3734 -4.3734 -4.3727 -4.3727 -3.0233 -3.0233 -2.9847 -2.9847 -2.9781 -2.9781 -2.6831 -2.6831 -2.6791 -2.6791 -2.6764 -2.6764 -1.5504 -1.5504 -1.5163 -1.5163 -1.5160 -1.5160 0.8055 0.8055 0.8335 0.8335 0.8404 0.8404 4.6085 4.6085 8.5705 8.5705 8.5955 8.5955 8.6023 8.6023 9.4459 9.4459 9.7488 9.7488 k = 0.0000 0.0500-0.0000 ( 6391 PWs) bands (ev): -25.4086 -25.4086 -24.9077 -24.9077 -24.9029 -24.9029 -24.9012 -24.9012 -22.4164 -22.4164 -21.4535 -21.4535 -21.4456 -21.4456 -21.4429 -21.4429 -10.9163 -10.9163 -8.9056 -8.9056 -8.8906 -8.8906 -8.8873 -8.8873 -5.3566 -5.3566 -5.3533 -5.3533 -5.2643 -5.2643 -5.2414 -5.2414 -5.2382 -5.2382 -4.4064 -4.4064 -4.3784 -4.3784 -4.3769 -4.3769 -3.0252 -3.0252 -2.9862 -2.9862 -2.9739 -2.9739 -2.6846 -2.6846 -2.6714 -2.6714 -2.6569 -2.6569 -1.5537 -1.5537 -1.5198 -1.5198 -1.5192 -1.5192 0.7972 0.7972 0.8302 0.8302 0.8421 0.8421 4.6208 4.6208 8.5430 8.5430 8.5986 8.5986 8.6061 8.6061 9.4516 9.4516 9.7584 9.7584 k = 0.0000 0.0667-0.0000 ( 6391 PWs) bands (ev): -25.4067 -25.4067 -24.9104 -24.9104 -24.9033 -24.9033 -24.9012 -24.9012 -22.4113 -22.4113 -21.4570 -21.4570 -21.4465 -21.4465 -21.4429 -21.4429 -10.9082 -10.9082 -8.9179 -8.9179 -8.8911 -8.8911 -8.8876 -8.8876 -5.3558 -5.3558 -5.3500 -5.3500 -5.2630 -5.2630 -5.2402 -5.2402 -5.2349 -5.2349 -4.4128 -4.4128 -4.3853 -4.3853 -4.3827 -4.3827 -3.0295 -3.0295 -2.9851 -2.9851 -2.9681 -2.9681 -2.6867 -2.6867 -2.6630 -2.6630 -2.6290 -2.6290 -1.5583 -1.5583 -1.5246 -1.5246 -1.5237 -1.5237 0.7816 0.7816 0.8295 0.8295 0.8445 0.8445 4.6379 4.6379 8.5050 8.5050 8.6036 8.6036 8.6113 8.6113 9.4594 9.4594 9.7706 9.7706 k = 0.0000 0.0833-0.0000 ( 6403 PWs) bands (ev): -25.4042 -25.4042 -24.9142 -24.9142 -24.9035 -24.9035 -24.9012 -24.9012 -22.4046 -22.4046 -21.4622 -21.4622 -21.4470 -21.4470 -21.4429 -21.4429 -10.8977 -10.8977 -8.9338 -8.9338 -8.8915 -8.8915 -8.8880 -8.8880 -5.3549 -5.3549 -5.3458 -5.3458 -5.2619 -5.2619 -5.2382 -5.2382 -5.2308 -5.2308 -4.4211 -4.4211 -4.3940 -4.3940 -4.3902 -4.3902 -3.0358 -3.0358 -2.9807 -2.9807 -2.9608 -2.9608 -2.6893 -2.6893 -2.6525 -2.6525 -2.5953 -2.5953 -1.5642 -1.5642 -1.5307 -1.5307 -1.5293 -1.5293 0.7594 0.7594 0.8311 0.8311 0.8475 0.8475 4.6597 4.6597 8.4579 8.4579 8.6103 8.6103 8.6181 8.6181 9.4693 9.4693 9.7846 9.7846 k = 0.0000 0.1000-0.0000 ( 6399 PWs) bands (ev): -25.4011 -25.4011 -24.9190 -24.9190 -24.9036 -24.9036 -24.9012 -24.9012 -22.3966 -22.3966 -21.4688 -21.4688 -21.4473 -21.4473 -21.4430 -21.4430 -10.8849 -10.8849 -8.9531 -8.9531 -8.8919 -8.8919 -8.8884 -8.8884 -5.3538 -5.3538 -5.3406 -5.3406 -5.2612 -5.2612 -5.2350 -5.2350 -5.2257 -5.2257 -4.4311 -4.4311 -4.4043 -4.4043 -4.3991 -4.3991 -3.0431 -3.0431 -2.9737 -2.9737 -2.9521 -2.9521 -2.6925 -2.6925 -2.6398 -2.6398 -2.5568 -2.5568 -1.5713 -1.5713 -1.5381 -1.5381 -1.5362 -1.5362 0.7314 0.7314 0.8341 0.8341 0.8510 0.8510 4.6861 4.6861 8.4030 8.4030 8.6185 8.6185 8.6263 8.6263 9.4813 9.4813 9.7995 9.7995 k = 0.0000 0.1167-0.0000 ( 6395 PWs) bands (ev): -25.3976 -25.3976 -24.9246 -24.9246 -24.9037 -24.9037 -24.9012 -24.9012 -22.3872 -22.3872 -21.4767 -21.4767 -21.4475 -21.4475 -21.4431 -21.4431 -10.8698 -10.8698 -8.9757 -8.9757 -8.8924 -8.8924 -8.8889 -8.8889 -5.3526 -5.3526 -5.3346 -5.3346 -5.2610 -5.2610 -5.2306 -5.2306 -5.2198 -5.2198 -4.4428 -4.4428 -4.4161 -4.4161 -4.4094 -4.4094 -3.0503 -3.0503 -2.9644 -2.9644 -2.9420 -2.9420 -2.6963 -2.6963 -2.6252 -2.6252 -2.5140 -2.5140 -1.5797 -1.5797 -1.5467 -1.5467 -1.5443 -1.5443 0.6983 0.6983 0.8380 0.8380 0.8551 0.8551 4.7170 4.7170 8.3413 8.3413 8.6280 8.6280 8.6358 8.6358 9.4950 9.4950 9.8146 9.8146 k = 0.0000 0.1333-0.0000 ( 6407 PWs) bands (ev): -25.3934 -25.3934 -24.9310 -24.9310 -24.9037 -24.9037 -24.9012 -24.9012 -22.3764 -22.3764 -21.4859 -21.4859 -21.4476 -21.4476 -21.4431 -21.4431 -10.8525 -10.8525 -9.0013 -9.0013 -8.8929 -8.8929 -8.8894 -8.8894 -5.3513 -5.3513 -5.3276 -5.3276 -5.2614 -5.2614 -5.2249 -5.2249 -5.2130 -5.2130 -4.4563 -4.4563 -4.4293 -4.4293 -4.4211 -4.4211 -3.0568 -3.0568 -2.9535 -2.9535 -2.9306 -2.9306 -2.7007 -2.7007 -2.6086 -2.6086 -2.4674 -2.4674 -1.5891 -1.5891 -1.5565 -1.5565 -1.5535 -1.5535 0.6604 0.6604 0.8427 0.8427 0.8597 0.8597 4.7521 4.7521 8.2738 8.2738 8.6390 8.6390 8.6467 8.6467 9.5105 9.5105 9.8293 9.8293 k = 0.0000 0.1500-0.0000 ( 6403 PWs) bands (ev): -25.3888 -25.3888 -24.9383 -24.9383 -24.9037 -24.9037 -24.9012 -24.9012 -22.3644 -22.3644 -21.4964 -21.4964 -21.4476 -21.4476 -21.4432 -21.4432 -10.8330 -10.8330 -9.0300 -9.0300 -8.8934 -8.8934 -8.8900 -8.8900 -5.3499 -5.3499 -5.3198 -5.3198 -5.2622 -5.2622 -5.2181 -5.2181 -5.2053 -5.2053 -4.4713 -4.4713 -4.4436 -4.4436 -4.4340 -4.4340 -3.0622 -3.0622 -2.9412 -2.9412 -2.9181 -2.9181 -2.7056 -2.7056 -2.5903 -2.5903 -2.4173 -2.4173 -1.5997 -1.5997 -1.5673 -1.5673 -1.5639 -1.5639 0.6180 0.6180 0.8480 0.8480 0.8647 0.8647 4.7913 4.7913 8.2014 8.2014 8.6512 8.6512 8.6588 8.6588 9.5276 9.5276 9.8433 9.8433 k = 0.0000 0.1667-0.0000 ( 6407 PWs) bands (ev): -25.3836 -25.3836 -24.9462 -24.9462 -24.9036 -24.9036 -24.9013 -24.9013 -22.3511 -22.3511 -21.5079 -21.5079 -21.4476 -21.4476 -21.4433 -21.4433 -10.8114 -10.8114 -9.0614 -9.0614 -8.8940 -8.8940 -8.8907 -8.8907 -5.3484 -5.3484 -5.3113 -5.3113 -5.2633 -5.2633 -5.2101 -5.2101 -5.1968 -5.1968 -4.4879 -4.4879 -4.4589 -4.4589 -4.4480 -4.4480 -3.0662 -3.0662 -2.9277 -2.9277 -2.9047 -2.9047 -2.7111 -2.7111 -2.5703 -2.5703 -2.3640 -2.3640 -1.6112 -1.6112 -1.5791 -1.5791 -1.5753 -1.5753 0.5715 0.5715 0.8537 0.8537 0.8701 0.8701 4.8345 4.8345 8.1247 8.1247 8.6646 8.6646 8.6721 8.6721 9.5459 9.5459 9.8563 9.8563 k = 0.0000 0.1833-0.0000 ( 6399 PWs) bands (ev): -25.3779 -25.3779 -24.9548 -24.9548 -24.9036 -24.9036 -24.9013 -24.9013 -22.3366 -22.3366 -21.5206 -21.5206 -21.4476 -21.4476 -21.4434 -21.4434 -10.7876 -10.7876 -9.0955 -9.0955 -8.8946 -8.8946 -8.8914 -8.8914 -5.3469 -5.3469 -5.3020 -5.3020 -5.2644 -5.2644 -5.2013 -5.2013 -5.1875 -5.1875 -4.5060 -4.5060 -4.4751 -4.4751 -4.4631 -4.4631 -3.0689 -3.0689 -2.9131 -2.9131 -2.8903 -2.8903 -2.7171 -2.7171 -2.5489 -2.5489 -2.3078 -2.3078 -1.6237 -1.6237 -1.5917 -1.5917 -1.5878 -1.5878 0.5209 0.5209 0.8598 0.8598 0.8758 0.8758 4.8815 4.8815 8.0445 8.0445 8.6791 8.6791 8.6865 8.6865 9.5655 9.5655 9.8681 9.8681 k = 0.0000 0.2000-0.0000 ( 6399 PWs) bands (ev): -25.3716 -25.3716 -24.9640 -24.9640 -24.9035 -24.9035 -24.9013 -24.9013 -22.3209 -22.3209 -21.5344 -21.5344 -21.4476 -21.4476 -21.4435 -21.4435 -10.7617 -10.7617 -9.1321 -9.1321 -8.8952 -8.8952 -8.8921 -8.8921 -5.3453 -5.3453 -5.2926 -5.2926 -5.2651 -5.2651 -5.1915 -5.1915 -5.1773 -5.1773 -4.5254 -4.5254 -4.4920 -4.4920 -4.4791 -4.4791 -3.0701 -3.0701 -2.8976 -2.8976 -2.8753 -2.8753 -2.7236 -2.7236 -2.5261 -2.5261 -2.2488 -2.2488 -1.6370 -1.6370 -1.6052 -1.6052 -1.6013 -1.6013 0.4667 0.4667 0.8662 0.8662 0.8817 0.8817 4.9320 4.9320 7.9611 7.9611 8.6947 8.6947 8.7020 8.7020 9.5859 9.5859 9.8788 9.8788 k = 0.0000 0.2167-0.0000 ( 6387 PWs) bands (ev): -25.3649 -25.3649 -24.9739 -24.9739 -24.9035 -24.9035 -24.9013 -24.9013 -22.3042 -22.3042 -21.5492 -21.5492 -21.4476 -21.4476 -21.4436 -21.4436 -10.7338 -10.7338 -9.1709 -9.1709 -8.8958 -8.8958 -8.8929 -8.8929 -5.3438 -5.3438 -5.2842 -5.2842 -5.2641 -5.2641 -5.1809 -5.1809 -5.1665 -5.1665 -4.5459 -4.5459 -4.5096 -4.5096 -4.4959 -4.4959 -3.0699 -3.0699 -2.8815 -2.8815 -2.8597 -2.8597 -2.7306 -2.7306 -2.5020 -2.5020 -2.1873 -2.1873 -1.6511 -1.6511 -1.6193 -1.6193 -1.6157 -1.6157 0.4091 0.4091 0.8729 0.8729 0.8877 0.8877 4.9860 4.9860 7.8752 7.8752 8.7111 8.7111 8.7183 8.7183 9.6071 9.6071 9.8882 9.8882 k = 0.0000 0.2333-0.0000 ( 6383 PWs) bands (ev): -25.3577 -25.3577 -24.9843 -24.9843 -24.9034 -24.9034 -24.9013 -24.9013 -22.2865 -22.2865 -21.5651 -21.5651 -21.4475 -21.4475 -21.4438 -21.4438 -10.7039 -10.7039 -9.2119 -9.2119 -8.8965 -8.8965 -8.8937 -8.8937 -5.3422 -5.3422 -5.2797 -5.2797 -5.2584 -5.2584 -5.1695 -5.1695 -5.1549 -5.1549 -4.5675 -4.5675 -4.5278 -4.5278 -4.5134 -4.5134 -3.0683 -3.0683 -2.8648 -2.8648 -2.8438 -2.8438 -2.7380 -2.7380 -2.4769 -2.4769 -2.1233 -2.1233 -1.6658 -1.6658 -1.6340 -1.6340 -1.6310 -1.6310 0.3483 0.3483 0.8797 0.8797 0.8939 0.8939 5.0432 5.0432 7.7871 7.7871 8.7283 8.7283 8.7353 8.7353 9.6287 9.6287 9.8965 9.8965 k = 0.0000 0.2500-0.0000 ( 6383 PWs) bands (ev): -25.3500 -25.3500 -24.9952 -24.9952 -24.9033 -24.9033 -24.9014 -24.9014 -22.2677 -22.2677 -21.5819 -21.5819 -21.4475 -21.4475 -21.4439 -21.4439 -10.6721 -10.6721 -9.2548 -9.2548 -8.8972 -8.8972 -8.8945 -8.8945 -5.3407 -5.3407 -5.2793 -5.2793 -5.2479 -5.2479 -5.1574 -5.1574 -5.1426 -5.1426 -4.5900 -4.5900 -4.5465 -4.5465 -4.5316 -4.5316 -3.0654 -3.0654 -2.8478 -2.8478 -2.8277 -2.8277 -2.7458 -2.7458 -2.4508 -2.4508 -2.0570 -2.0570 -1.6812 -1.6812 -1.6491 -1.6491 -1.6471 -1.6471 0.2846 0.2846 0.8866 0.8866 0.9001 0.9001 5.1035 5.1035 7.6971 7.6971 8.7462 8.7462 8.7530 8.7530 9.6506 9.6506 9.9036 9.9036 k = 0.0000 0.2667-0.0000 ( 6391 PWs) bands (ev): -25.3418 -25.3418 -25.0065 -25.0065 -24.9033 -24.9033 -24.9014 -24.9014 -22.2481 -22.2481 -21.5996 -21.5996 -21.4474 -21.4474 -21.4440 -21.4440 -10.6385 -10.6385 -9.2995 -9.2995 -8.8978 -8.8978 -8.8953 -8.8953 -5.3391 -5.3391 -5.2808 -5.2808 -5.2349 -5.2349 -5.1446 -5.1446 -5.1297 -5.1297 -4.6132 -4.6132 -4.5656 -4.5656 -4.5503 -4.5503 -3.0612 -3.0612 -2.8305 -2.8305 -2.8120 -2.8120 -2.7537 -2.7537 -2.4239 -2.4239 -1.9885 -1.9885 -1.6972 -1.6972 -1.6645 -1.6645 -1.6639 -1.6639 0.2181 0.2181 0.8934 0.8934 0.9062 0.9062 5.1668 5.1668 7.6056 7.6056 8.7645 8.7645 8.7711 8.7711 9.6725 9.6725 9.9097 9.9097 k = 0.0000 0.2833-0.0000 ( 6387 PWs) bands (ev): -25.3332 -25.3332 -25.0182 -25.0182 -24.9032 -24.9032 -24.9014 -24.9014 -22.2277 -22.2277 -21.6182 -21.6182 -21.4474 -21.4474 -21.4442 -21.4442 -10.6030 -10.6030 -9.3457 -9.3457 -8.8985 -8.8985 -8.8961 -8.8961 -5.3376 -5.3376 -5.2828 -5.2828 -5.2204 -5.2204 -5.1311 -5.1311 -5.1163 -5.1163 -4.6371 -4.6371 -4.5850 -4.5850 -4.5695 -4.5695 -3.0558 -3.0558 -2.8132 -2.8132 -2.7975 -2.7975 -2.7608 -2.7608 -2.3963 -2.3963 -1.9181 -1.9181 -1.7138 -1.7138 -1.6811 -1.6811 -1.6800 -1.6800 0.1492 0.1492 0.9002 0.9002 0.9122 0.9122 5.2328 5.2328 7.5129 7.5129 8.7832 8.7832 8.7895 8.7895 9.6942 9.6942 9.9148 9.9148 k = 0.0000 0.3000-0.0000 ( 6403 PWs) bands (ev): -25.3242 -25.3242 -25.0304 -25.0304 -24.9031 -24.9031 -24.9015 -24.9015 -22.2064 -22.2064 -21.6376 -21.6376 -21.4473 -21.4473 -21.4443 -21.4443 -10.5658 -10.5658 -9.3933 -9.3933 -8.8991 -8.8991 -8.8969 -8.8969 -5.3360 -5.3360 -5.2852 -5.2852 -5.2050 -5.2050 -5.1172 -5.1172 -5.1023 -5.1023 -4.6615 -4.6615 -4.6046 -4.6046 -4.5890 -4.5890 -3.0493 -3.0493 -2.7960 -2.7960 -2.7882 -2.7882 -2.7634 -2.7634 -2.3681 -2.3681 -1.8458 -1.8458 -1.7311 -1.7311 -1.6985 -1.6985 -1.6956 -1.6956 0.0780 0.0780 0.9068 0.9068 0.9180 0.9180 5.3015 5.3015 7.4191 7.4191 8.8020 8.8020 8.8080 8.8080 9.7156 9.7156 9.9189 9.9189 k = 0.0000 0.3167-0.0000 ( 6411 PWs) bands (ev): -25.3147 -25.3147 -25.0428 -25.0428 -24.9030 -24.9030 -24.9015 -24.9015 -22.1845 -22.1845 -21.6578 -21.6578 -21.4473 -21.4473 -21.4445 -21.4445 -10.5270 -10.5270 -9.4422 -9.4422 -8.8997 -8.8997 -8.8976 -8.8976 -5.3345 -5.3345 -5.2878 -5.2878 -5.1886 -5.1886 -5.1027 -5.1027 -5.0878 -5.0878 -4.6863 -4.6863 -4.6243 -4.6243 -4.6086 -4.6086 -3.0418 -3.0418 -2.7906 -2.7906 -2.7790 -2.7790 -2.7552 -2.7552 -2.3393 -2.3393 -1.7718 -1.7718 -1.7492 -1.7492 -1.7157 -1.7157 -1.7109 -1.7109 0.0047 0.0047 0.9132 0.9132 0.9236 0.9236 5.3726 5.3726 7.3246 7.3246 8.8206 8.8206 8.8264 8.8264 9.7363 9.7363 9.9221 9.9221 k = 0.0000 0.3333-0.0000 ( 6399 PWs) bands (ev): -25.3048 -25.3048 -25.0554 -25.0554 -24.9030 -24.9030 -24.9016 -24.9016 -22.1619 -22.1619 -21.6788 -21.6788 -21.4472 -21.4472 -21.4446 -21.4446 -10.4866 -10.4866 -9.4920 -9.4920 -8.9002 -8.9002 -8.8983 -8.8983 -5.3330 -5.3330 -5.2904 -5.2904 -5.1714 -5.1714 -5.0877 -5.0877 -5.0729 -5.0729 -4.7114 -4.7114 -4.6441 -4.6441 -4.6284 -4.6284 -3.0334 -3.0334 -2.7989 -2.7989 -2.7625 -2.7625 -2.7420 -2.7420 -2.3102 -2.3102 -1.7682 -1.7682 -1.7324 -1.7324 -1.7262 -1.7262 -1.6959 -1.6959 -0.0705 -0.0705 0.9193 0.9193 0.9288 0.9288 5.4462 5.4462 7.2295 7.2295 8.8390 8.8390 8.8444 8.8444 9.7563 9.7563 9.9243 9.9243 k = 0.0000 0.3500-0.0000 ( 6391 PWs) bands (ev): -25.2945 -25.2945 -25.0683 -25.0683 -24.9029 -24.9029 -24.9016 -24.9016 -22.1388 -22.1388 -21.7004 -21.7004 -21.4471 -21.4471 -21.4448 -21.4448 -10.4446 -10.4446 -9.5428 -9.5428 -8.9008 -8.9008 -8.8990 -8.8990 -5.3314 -5.3314 -5.2930 -5.2930 -5.1533 -5.1533 -5.0725 -5.0725 -5.0578 -5.0578 -4.7367 -4.7367 -4.6637 -4.6637 -4.6481 -4.6481 -3.0241 -3.0241 -2.8089 -2.8089 -2.7466 -2.7466 -2.7282 -2.7282 -2.2807 -2.2807 -1.7885 -1.7885 -1.7481 -1.7481 -1.7407 -1.7407 -1.6190 -1.6190 -0.1472 -0.1472 0.9251 0.9251 0.9337 0.9337 5.5219 5.5219 7.1341 7.1341 8.8568 8.8568 8.8618 8.8618 9.7754 9.7754 9.9257 9.9257 k = 0.0000 0.3667-0.0000 ( 6387 PWs) bands (ev): -25.2838 -25.2838 -25.0814 -25.0814 -24.9028 -24.9028 -24.9017 -24.9017 -22.1152 -22.1152 -21.7226 -21.7226 -21.4470 -21.4470 -21.4449 -21.4449 -10.4012 -10.4012 -9.5942 -9.5942 -8.9012 -8.9012 -8.8997 -8.8997 -5.3298 -5.3298 -5.2956 -5.2956 -5.1346 -5.1346 -5.0570 -5.0570 -5.0425 -5.0425 -4.7622 -4.7622 -4.6831 -4.6831 -4.6677 -4.6677 -3.0141 -3.0141 -2.8198 -2.8198 -2.7315 -2.7315 -2.7150 -2.7150 -2.2511 -2.2511 -1.8100 -1.8100 -1.7626 -1.7626 -1.7545 -1.7545 -1.5406 -1.5406 -0.2255 -0.2255 0.9304 0.9304 0.9381 0.9381 5.5998 5.5998 7.0384 7.0384 8.8738 8.8738 8.8784 8.8784 9.7935 9.7935 9.9262 9.9262 k = 0.0000 0.3833-0.0000 ( 6391 PWs) bands (ev): -25.2727 -25.2727 -25.0946 -25.0946 -24.9027 -24.9027 -24.9017 -24.9017 -22.0911 -22.0911 -21.7454 -21.7454 -21.4469 -21.4469 -21.4450 -21.4450 -10.3565 -10.3565 -9.6463 -9.6463 -8.9016 -8.9016 -8.9003 -8.9003 -5.3282 -5.3282 -5.2983 -5.2983 -5.1151 -5.1151 -5.0414 -5.0414 -5.0273 -5.0273 -4.7876 -4.7876 -4.7019 -4.7019 -4.6870 -4.6870 -3.0035 -3.0035 -2.8311 -2.8311 -2.7174 -2.7174 -2.7027 -2.7027 -2.2213 -2.2213 -1.8327 -1.8327 -1.7757 -1.7757 -1.7675 -1.7675 -1.4611 -1.4611 -0.3050 -0.3050 0.9353 0.9353 0.9421 0.9421 5.6797 5.6797 6.9428 6.9428 8.8897 8.8897 8.8938 8.8938 9.8104 9.8104 9.9258 9.9258 k = 0.0000 0.4000-0.0000 ( 6415 PWs) bands (ev): -25.2614 -25.2614 -25.1079 -25.1079 -24.9027 -24.9027 -24.9018 -24.9018 -22.0667 -22.0667 -21.7688 -21.7688 -21.4468 -21.4468 -21.4452 -21.4452 -10.3106 -10.3106 -9.6987 -9.6987 -8.9020 -8.9020 -8.9009 -8.9009 -5.3265 -5.3265 -5.3009 -5.3009 -5.0950 -5.0950 -5.0259 -5.0259 -5.0123 -5.0123 -4.8131 -4.8131 -4.7201 -4.7201 -4.7058 -4.7058 -2.9923 -2.9923 -2.8429 -2.8429 -2.7046 -2.7046 -2.6917 -2.6917 -2.1915 -2.1915 -1.8565 -1.8565 -1.7873 -1.7873 -1.7794 -1.7794 -1.3805 -1.3805 -0.3857 -0.3857 0.9398 0.9398 0.9456 0.9456 5.7615 5.7615 6.8473 6.8473 8.9042 8.9042 8.9079 8.9079 9.8263 9.8263 9.9244 9.9244 k = 0.0000 0.4167-0.0000 ( 6415 PWs) bands (ev): -25.2497 -25.2497 -25.1212 -25.1212 -24.9026 -24.9026 -24.9019 -24.9019 -22.0420 -22.0420 -21.7925 -21.7925 -21.4467 -21.4467 -21.4453 -21.4453 -10.2635 -10.2635 -9.7514 -9.7514 -8.9023 -8.9023 -8.9013 -8.9013 -5.3248 -5.3248 -5.3035 -5.3035 -5.0742 -5.0742 -5.0108 -5.0108 -4.9980 -4.9980 -4.8384 -4.8384 -4.7371 -4.7371 -4.7237 -4.7237 -2.9807 -2.9807 -2.8550 -2.8550 -2.6931 -2.6931 -2.6821 -2.6821 -2.1617 -2.1617 -1.8812 -1.8812 -1.7971 -1.7971 -1.7900 -1.7900 -1.2990 -1.2990 -0.4673 -0.4673 0.9437 0.9437 0.9486 0.9486 5.8450 5.8450 6.7520 6.7520 8.9171 8.9171 8.9203 8.9203 9.8409 9.8409 9.9221 9.9221 k = 0.0000 0.4333-0.0000 ( 6411 PWs) bands (ev): -25.2377 -25.2377 -25.1346 -25.1346 -24.9025 -24.9025 -24.9019 -24.9019 -22.0170 -22.0170 -21.8167 -21.8167 -21.4465 -21.4465 -21.4455 -21.4455 -10.2153 -10.2153 -9.8042 -9.8042 -8.9026 -8.9026 -8.9018 -8.9018 -5.3231 -5.3231 -5.3060 -5.3060 -5.0528 -5.0528 -4.9964 -4.9964 -4.9848 -4.9848 -4.8636 -4.8636 -4.7525 -4.7525 -4.7404 -4.7404 -2.9687 -2.9687 -2.8673 -2.8673 -2.6832 -2.6832 -2.6742 -2.6742 -2.1320 -2.1320 -1.9068 -1.9068 -1.8053 -1.8053 -1.7992 -1.7992 -1.2168 -1.2168 -0.5496 -0.5496 0.9470 0.9470 0.9509 0.9509 5.9302 5.9302 6.6572 6.6572 8.9282 8.9282 8.9308 8.9308 9.8543 9.8543 9.9189 9.9189 k = 0.0000 0.4500-0.0000 ( 6411 PWs) bands (ev): -25.2255 -25.2255 -25.1479 -25.1479 -24.9024 -24.9024 -24.9020 -24.9020 -21.9919 -21.9919 -21.8412 -21.8412 -21.4464 -21.4464 -21.4456 -21.4456 -10.1661 -10.1661 -9.8570 -9.8570 -8.9027 -8.9027 -8.9021 -8.9021 -5.3212 -5.3212 -5.3084 -5.3084 -5.0308 -5.0308 -4.9832 -4.9832 -4.9735 -4.9735 -4.8886 -4.8886 -4.7656 -4.7656 -4.7554 -4.7554 -2.9563 -2.9563 -2.8799 -2.8799 -2.6750 -2.6750 -2.6682 -2.6682 -2.1025 -2.1025 -1.9331 -1.9331 -1.8115 -1.8115 -1.8068 -1.8068 -1.1340 -1.1340 -0.6325 -0.6325 0.9497 0.9497 0.9527 0.9527 6.0169 6.0169 6.5630 6.5630 8.9372 8.9372 8.9391 8.9391 9.8665 9.8665 9.9147 9.9147 k = 0.0000 0.4667-0.0000 ( 6423 PWs) bands (ev): -25.2130 -25.2130 -25.1612 -25.1612 -24.9023 -24.9023 -24.9020 -24.9020 -21.9667 -21.9667 -21.8660 -21.8660 -21.4463 -21.4463 -21.4458 -21.4458 -10.1162 -10.1162 -9.9097 -9.9097 -8.9028 -8.9028 -8.9024 -8.9024 -5.3193 -5.3193 -5.3108 -5.3108 -5.0082 -5.0082 -4.9721 -4.9721 -4.9649 -4.9649 -4.9133 -4.9133 -4.7754 -4.7754 -4.7679 -4.7679 -2.9438 -2.9438 -2.8926 -2.8926 -2.6687 -2.6687 -2.6641 -2.6641 -2.0732 -2.0732 -1.9601 -1.9601 -1.8158 -1.8158 -1.8125 -1.8125 -1.0507 -1.0507 -0.7159 -0.7159 0.9518 0.9518 0.9538 0.9538 6.1051 6.1051 6.4695 6.4695 8.9438 8.9438 8.9451 8.9451 9.8774 9.8774 9.9094 9.9094 k = 0.0000 0.4833-0.0000 ( 6423 PWs) bands (ev): -25.2003 -25.2003 -25.1744 -25.1744 -24.9023 -24.9023 -24.9021 -24.9021 -21.9414 -21.9414 -21.8910 -21.8910 -21.4462 -21.4462 -21.4459 -21.4459 -10.0654 -10.0654 -9.9620 -9.9620 -8.9028 -8.9028 -8.9026 -8.9026 -5.3173 -5.3173 -5.3130 -5.3130 -4.9852 -4.9852 -4.9639 -4.9639 -4.9601 -4.9601 -4.9376 -4.9376 -4.7809 -4.7809 -4.7769 -4.7769 -2.9310 -2.9310 -2.9054 -2.9054 -2.6644 -2.6644 -2.6621 -2.6621 -2.0443 -2.0443 -1.9877 -1.9877 -1.8181 -1.8181 -1.8164 -1.8164 -0.9671 -0.9671 -0.7996 -0.7996 0.9533 0.9533 0.9543 0.9543 6.1945 6.1945 6.3769 6.3769 8.9480 8.9480 8.9487 8.9487 9.8872 9.8872 9.9031 9.9031 k = 0.0000 0.5000-0.0000 ( 6432 PWs) bands (ev): -25.1874 -25.1874 -25.1874 -25.1874 -24.9022 -24.9022 -24.9022 -24.9022 -21.9161 -21.9161 -21.9161 -21.9161 -21.4460 -21.4460 -21.4460 -21.4460 -10.0140 -10.0140 -10.0140 -10.0140 -8.9028 -8.9028 -8.9028 -8.9028 -5.3152 -5.3152 -5.3152 -5.3152 -4.9620 -4.9620 -4.9620 -4.9620 -4.9592 -4.9592 -4.9592 -4.9592 -4.7815 -4.7815 -4.7815 -4.7815 -2.9182 -2.9182 -2.9182 -2.9182 -2.6622 -2.6622 -2.6622 -2.6622 -2.0158 -2.0158 -2.0158 -2.0158 -1.8182 -1.8182 -1.8182 -1.8182 -0.8833 -0.8833 -0.8833 -0.8833 0.9541 0.9541 0.9541 0.9541 6.2851 6.2851 6.2851 6.2851 8.9496 8.9496 8.9496 8.9496 9.8957 9.8957 9.8957 9.8957 k = 0.0000 0.5000-0.0000 ( 6432 PWs) bands (ev): -25.1874 -25.1874 -25.1874 -25.1874 -24.9022 -24.9022 -24.9022 -24.9022 -21.9161 -21.9161 -21.9161 -21.9161 -21.4460 -21.4460 -21.4460 -21.4460 -10.0140 -10.0140 -10.0140 -10.0140 -8.9028 -8.9028 -8.9028 -8.9028 -5.3152 -5.3152 -5.3152 -5.3152 -4.9620 -4.9620 -4.9620 -4.9620 -4.9592 -4.9592 -4.9592 -4.9592 -4.7815 -4.7815 -4.7815 -4.7815 -2.9182 -2.9182 -2.9182 -2.9182 -2.6622 -2.6622 -2.6622 -2.6622 -2.0158 -2.0158 -2.0158 -2.0158 -1.8182 -1.8182 -1.8182 -1.8182 -0.8833 -0.8833 -0.8833 -0.8833 0.9541 0.9541 0.9541 0.9541 6.2851 6.2851 6.2851 6.2851 8.9496 8.9496 8.9496 8.9496 9.8957 9.8957 9.8957 9.8957 k = 0.0167 0.5000-0.0000 ( 6416 PWs) bands (ev): -25.1875 -25.1875 -25.1873 -25.1873 -24.9023 -24.9023 -24.9021 -24.9021 -21.9163 -21.9163 -21.9160 -21.9160 -21.4462 -21.4462 -21.4459 -21.4459 -10.0140 -10.0140 -10.0138 -10.0138 -8.9029 -8.9029 -8.9027 -8.9027 -5.3153 -5.3153 -5.3146 -5.3146 -4.9699 -4.9699 -4.9689 -4.9689 -4.9553 -4.9553 -4.9519 -4.9519 -4.7819 -4.7819 -4.7781 -4.7781 -2.9213 -2.9213 -2.9173 -2.9173 -2.6624 -2.6624 -2.6585 -2.6585 -2.0181 -2.0181 -2.0151 -2.0151 -1.8199 -1.8199 -1.8166 -1.8166 -0.8837 -0.8837 -0.8824 -0.8824 0.9536 0.9536 0.9546 0.9546 6.2865 6.2865 6.2866 6.2866 8.9479 8.9479 8.9480 8.9480 9.8902 9.8902 9.8906 9.8906 k = 0.0333 0.5000-0.0000 ( 6408 PWs) bands (ev): -25.1874 -25.1874 -25.1872 -25.1872 -24.9024 -24.9024 -24.9021 -24.9021 -21.9165 -21.9165 -21.9159 -21.9159 -21.4463 -21.4463 -21.4457 -21.4457 -10.0141 -10.0141 -10.0137 -10.0137 -8.9030 -8.9030 -8.9026 -8.9026 -5.3150 -5.3150 -5.3135 -5.3135 -4.9813 -4.9813 -4.9781 -4.9781 -4.9508 -4.9508 -4.9455 -4.9455 -4.7793 -4.7793 -4.7721 -4.7721 -2.9263 -2.9263 -2.9185 -2.9185 -2.6591 -2.6591 -2.6515 -2.6515 -2.0222 -2.0222 -2.0162 -2.0162 -1.8215 -1.8215 -1.8150 -1.8150 -0.8835 -0.8835 -0.8809 -0.8809 0.9530 0.9530 0.9549 0.9549 6.2908 6.2908 6.2910 6.2910 8.9428 8.9428 8.9430 8.9430 9.8753 9.8753 9.8760 9.8760 k = 0.0500 0.5000-0.0000 ( 6410 PWs) bands (ev): -25.1874 -25.1874 -25.1870 -25.1870 -24.9026 -24.9026 -24.9022 -24.9022 -21.9167 -21.9167 -21.9158 -21.9158 -21.4464 -21.4464 -21.4456 -21.4456 -10.0142 -10.0142 -10.0135 -10.0135 -8.9032 -8.9032 -8.9026 -8.9026 -5.3141 -5.3141 -5.3119 -5.3119 -4.9943 -4.9943 -4.9891 -4.9891 -4.9473 -4.9473 -4.9405 -4.9405 -4.7742 -4.7742 -4.7640 -4.7640 -2.9329 -2.9329 -2.9217 -2.9217 -2.6526 -2.6526 -2.6418 -2.6418 -2.0278 -2.0278 -2.0191 -2.0191 -1.8230 -1.8230 -1.8135 -1.8135 -0.8828 -0.8828 -0.8788 -0.8788 0.9524 0.9524 0.9553 0.9553 6.2979 6.2979 6.2982 6.2982 8.9342 8.9342 8.9344 8.9344 9.8533 9.8533 9.8543 9.8543 k = 0.0667 0.5000-0.0000 ( 6406 PWs) bands (ev): -25.1872 -25.1872 -25.1868 -25.1868 -24.9028 -24.9028 -24.9023 -24.9023 -21.9169 -21.9169 -21.9157 -21.9157 -21.4465 -21.4465 -21.4454 -21.4454 -10.0142 -10.0142 -10.0133 -10.0133 -8.9034 -8.9034 -8.9026 -8.9026 -5.3128 -5.3128 -5.3099 -5.3099 -5.0085 -5.0085 -5.0015 -5.0015 -4.9445 -4.9445 -4.9365 -4.9365 -4.7669 -4.7669 -4.7545 -4.7545 -2.9404 -2.9404 -2.9265 -2.9265 -2.6433 -2.6433 -2.6299 -2.6299 -2.0349 -2.0349 -2.0237 -2.0237 -1.8244 -1.8244 -1.8121 -1.8121 -0.8815 -0.8815 -0.8763 -0.8763 0.9517 0.9517 0.9555 0.9555 6.3079 6.3079 6.3083 6.3083 8.9219 8.9219 8.9222 8.9222 9.8271 9.8271 9.8281 9.8281 k = 0.0833 0.5000-0.0000 ( 6406 PWs) bands (ev): -25.1871 -25.1871 -25.1866 -25.1866 -24.9031 -24.9031 -24.9024 -24.9024 -21.9171 -21.9171 -21.9156 -21.9156 -21.4465 -21.4465 -21.4452 -21.4452 -10.0141 -10.0141 -10.0132 -10.0132 -8.9037 -8.9037 -8.9026 -8.9026 -5.3111 -5.3111 -5.3075 -5.3075 -5.0236 -5.0236 -5.0152 -5.0152 -4.9421 -4.9421 -4.9331 -4.9331 -4.7582 -4.7582 -4.7440 -4.7440 -2.9486 -2.9486 -2.9325 -2.9325 -2.6317 -2.6317 -2.6161 -2.6161 -2.0433 -2.0433 -2.0298 -2.0298 -1.8256 -1.8256 -1.8109 -1.8109 -0.8798 -0.8798 -0.8735 -0.8735 0.9511 0.9511 0.9557 0.9557 6.3207 6.3207 6.3213 6.3213 8.9057 8.9057 8.9061 8.9061 9.7987 9.7987 9.7997 9.7997 k = 0.1000 0.5000-0.0000 ( 6414 PWs) bands (ev): -25.1869 -25.1869 -25.1863 -25.1863 -24.9034 -24.9034 -24.9026 -24.9026 -21.9173 -21.9173 -21.9156 -21.9156 -21.4466 -21.4466 -21.4450 -21.4450 -10.0141 -10.0141 -10.0129 -10.0129 -8.9039 -8.9039 -8.9027 -8.9027 -5.3091 -5.3091 -5.3046 -5.3046 -5.0393 -5.0393 -5.0299 -5.0299 -4.9399 -4.9399 -4.9300 -4.9300 -4.7487 -4.7487 -4.7331 -4.7331 -2.9570 -2.9570 -2.9391 -2.9391 -2.6184 -2.6184 -2.6012 -2.6012 -2.0528 -2.0528 -2.0374 -2.0374 -1.8266 -1.8266 -1.8098 -1.8098 -0.8778 -0.8778 -0.8703 -0.8703 0.9504 0.9504 0.9559 0.9559 6.3364 6.3364 6.3370 6.3370 8.8853 8.8853 8.8857 8.8857 9.7699 9.7699 9.7709 9.7709 k = 0.1167 0.5000-0.0000 ( 6400 PWs) bands (ev): -25.1866 -25.1866 -25.1859 -25.1859 -24.9038 -24.9038 -24.9028 -24.9028 -21.9175 -21.9175 -21.9156 -21.9156 -21.4466 -21.4466 -21.4449 -21.4449 -10.0140 -10.0140 -10.0127 -10.0127 -8.9042 -8.9042 -8.9028 -8.9028 -5.3067 -5.3067 -5.3015 -5.3015 -5.0555 -5.0555 -5.0451 -5.0451 -4.9378 -4.9378 -4.9270 -4.9270 -4.7387 -4.7387 -4.7221 -4.7221 -2.9652 -2.9652 -2.9459 -2.9459 -2.6040 -2.6040 -2.5855 -2.5855 -2.0631 -2.0631 -2.0461 -2.0461 -1.8274 -1.8274 -1.8088 -1.8088 -0.8754 -0.8754 -0.8670 -0.8670 0.9498 0.9498 0.9560 0.9560 6.3549 6.3549 6.3556 6.3556 8.8605 8.8605 8.8610 8.8610 9.7420 9.7420 9.7428 9.7428 k = 0.1333 0.5000-0.0000 ( 6392 PWs) bands (ev): -25.1863 -25.1863 -25.1855 -25.1855 -24.9041 -24.9041 -24.9031 -24.9031 -21.9177 -21.9177 -21.9156 -21.9156 -21.4466 -21.4466 -21.4447 -21.4447 -10.0139 -10.0139 -10.0125 -10.0125 -8.9045 -8.9045 -8.9029 -8.9029 -5.3040 -5.3040 -5.2981 -5.2981 -5.0718 -5.0718 -5.0607 -5.0607 -4.9355 -4.9355 -4.9239 -4.9239 -4.7287 -4.7287 -4.7114 -4.7114 -2.9730 -2.9730 -2.9527 -2.9527 -2.5889 -2.5889 -2.5694 -2.5694 -2.0740 -2.0740 -2.0558 -2.0558 -1.8280 -1.8280 -1.8080 -1.8080 -0.8729 -0.8729 -0.8636 -0.8636 0.9491 0.9491 0.9560 0.9560 6.3762 6.3762 6.3770 6.3770 8.8311 8.8311 8.8315 8.8315 9.7158 9.7158 9.7165 9.7165 k = 0.1500 0.5000-0.0000 ( 6388 PWs) bands (ev): -25.1860 -25.1860 -25.1851 -25.1851 -24.9045 -24.9045 -24.9034 -24.9034 -21.9180 -21.9180 -21.9157 -21.9157 -21.4466 -21.4466 -21.4445 -21.4445 -10.0138 -10.0138 -10.0122 -10.0122 -8.9048 -8.9048 -8.9031 -8.9031 -5.3012 -5.3012 -5.2944 -5.2944 -5.0881 -5.0881 -5.0765 -5.0765 -4.9329 -4.9329 -4.9206 -4.9206 -4.7190 -4.7190 -4.7011 -4.7011 -2.9802 -2.9802 -2.9591 -2.9591 -2.5737 -2.5737 -2.5535 -2.5535 -2.0853 -2.0853 -2.0660 -2.0660 -1.8284 -1.8284 -1.8073 -1.8073 -0.8703 -0.8703 -0.8602 -0.8602 0.9485 0.9485 0.9561 0.9561 6.4002 6.4002 6.4011 6.4011 8.7970 8.7970 8.7974 8.7974 9.6920 9.6920 9.6926 9.6926 k = 0.1667 0.5000-0.0000 ( 6372 PWs) bands (ev): -25.1856 -25.1856 -25.1847 -25.1847 -24.9049 -24.9049 -24.9037 -24.9037 -21.9182 -21.9182 -21.9157 -21.9157 -21.4465 -21.4465 -21.4443 -21.4443 -10.0137 -10.0137 -10.0120 -10.0120 -8.9051 -8.9051 -8.9033 -8.9033 -5.2982 -5.2982 -5.2907 -5.2907 -5.1043 -5.1043 -5.0923 -5.0923 -4.9300 -4.9300 -4.9170 -4.9170 -4.7099 -4.7099 -4.6915 -4.6915 -2.9865 -2.9865 -2.9648 -2.9648 -2.5589 -2.5589 -2.5381 -2.5381 -2.0964 -2.0964 -2.0763 -2.0763 -1.8287 -1.8287 -1.8067 -1.8067 -0.8678 -0.8678 -0.8569 -0.8569 0.9480 0.9480 0.9561 0.9561 6.4269 6.4269 6.4279 6.4279 8.7582 8.7582 8.7585 8.7585 9.6711 9.6711 9.6715 9.6715 k = 0.1833 0.5000-0.0000 ( 6364 PWs) bands (ev): -25.1852 -25.1852 -25.1842 -25.1842 -24.9054 -24.9054 -24.9041 -24.9041 -21.9184 -21.9184 -21.9158 -21.9158 -21.4465 -21.4465 -21.4441 -21.4441 -10.0136 -10.0136 -10.0117 -10.0117 -8.9054 -8.9054 -8.9035 -8.9035 -5.2951 -5.2951 -5.2868 -5.2868 -5.1203 -5.1203 -5.1079 -5.1079 -4.9267 -4.9267 -4.9129 -4.9129 -4.7015 -4.7015 -4.6827 -4.6827 -2.9920 -2.9920 -2.9698 -2.9698 -2.5449 -2.5449 -2.5238 -2.5238 -2.1071 -2.1071 -2.0864 -2.0864 -1.8289 -1.8289 -1.8062 -1.8062 -0.8653 -0.8653 -0.8539 -0.8539 0.9476 0.9476 0.9561 0.9561 6.4564 6.4564 6.4574 6.4574 8.7147 8.7147 8.7150 8.7150 9.6532 9.6532 9.6534 9.6534 k = 0.2000 0.5000-0.0000 ( 6364 PWs) bands (ev): -25.1848 -25.1848 -25.1838 -25.1838 -24.9058 -24.9058 -24.9045 -24.9045 -21.9186 -21.9186 -21.9159 -21.9159 -21.4464 -21.4464 -21.4440 -21.4440 -10.0134 -10.0134 -10.0115 -10.0115 -8.9057 -8.9057 -8.9037 -8.9037 -5.2921 -5.2921 -5.2830 -5.2830 -5.1359 -5.1359 -5.1231 -5.1231 -4.9229 -4.9229 -4.9084 -4.9084 -4.6941 -4.6941 -4.6749 -4.6749 -2.9963 -2.9963 -2.9739 -2.9739 -2.5324 -2.5324 -2.5110 -2.5110 -2.1169 -2.1169 -2.0958 -2.0958 -1.8289 -1.8289 -1.8058 -1.8058 -0.8630 -0.8630 -0.8512 -0.8512 0.9473 0.9473 0.9561 0.9561 6.4885 6.4885 6.4896 6.4896 8.6669 8.6669 8.6670 8.6670 9.6384 9.6384 9.6384 9.6384 k = 0.2167 0.5000-0.0000 ( 6356 PWs) bands (ev): -25.1843 -25.1843 -25.1833 -25.1833 -24.9063 -24.9063 -24.9049 -24.9049 -21.9188 -21.9188 -21.9161 -21.9161 -21.4463 -21.4463 -21.4438 -21.4438 -10.0132 -10.0132 -10.0113 -10.0113 -8.9060 -8.9060 -8.9040 -8.9040 -5.2892 -5.2892 -5.2793 -5.2793 -5.1510 -5.1510 -5.1379 -5.1379 -4.9185 -4.9185 -4.9032 -4.9032 -4.6876 -4.6876 -4.6682 -4.6682 -2.9996 -2.9996 -2.9770 -2.9770 -2.5217 -2.5217 -2.5002 -2.5002 -2.1253 -2.1253 -2.1040 -2.1040 -1.8290 -1.8290 -1.8056 -1.8056 -0.8610 -0.8610 -0.8488 -0.8488 0.9471 0.9471 0.9562 0.9562 6.5232 6.5232 6.5243 6.5243 8.6149 8.6149 8.6150 8.6150 9.6265 9.6265 9.6266 9.6266 k = 0.2333 0.5000-0.0000 ( 6366 PWs) bands (ev): -25.1839 -25.1839 -25.1828 -25.1828 -24.9068 -24.9068 -24.9054 -24.9054 -21.9190 -21.9190 -21.9162 -21.9162 -21.4463 -21.4463 -21.4437 -21.4437 -10.0130 -10.0130 -10.0111 -10.0111 -8.9063 -8.9063 -8.9042 -8.9042 -5.2865 -5.2865 -5.2758 -5.2758 -5.1656 -5.1656 -5.1522 -5.1522 -4.9135 -4.9135 -4.8975 -4.8975 -4.6823 -4.6823 -4.6627 -4.6627 -3.0017 -3.0017 -2.9791 -2.9791 -2.5134 -2.5134 -2.4918 -2.4918 -2.1318 -2.1318 -2.1104 -2.1104 -1.8289 -1.8289 -1.8054 -1.8054 -0.8593 -0.8593 -0.8469 -0.8469 0.9469 0.9469 0.9562 0.9562 6.5604 6.5604 6.5617 6.5617 8.5592 8.5592 8.5593 8.5593 9.6173 9.6173 9.6176 9.6176 k = 0.2500 0.5000-0.0000 ( 6380 PWs) bands (ev): -25.1834 -25.1834 -25.1823 -25.1823 -24.9072 -24.9072 -24.9058 -24.9058 -21.9192 -21.9192 -21.9164 -21.9164 -21.4461 -21.4461 -21.4435 -21.4435 -10.0129 -10.0129 -10.0109 -10.0109 -8.9066 -8.9066 -8.9045 -8.9045 -5.2840 -5.2840 -5.2725 -5.2725 -5.1794 -5.1794 -5.1657 -5.1657 -4.9077 -4.9077 -4.8911 -4.8911 -4.6781 -4.6781 -4.6583 -4.6583 -3.0026 -3.0026 -2.9800 -2.9800 -2.5078 -2.5078 -2.4864 -2.4864 -2.1361 -2.1361 -2.1148 -2.1148 -1.8289 -1.8289 -1.8054 -1.8054 -0.8579 -0.8579 -0.8455 -0.8455 0.9469 0.9469 0.9562 0.9562 6.6002 6.6002 6.6015 6.6015 8.5002 8.5002 8.5003 8.5003 9.6107 9.6107 9.6111 9.6111 k = 0.2667 0.5000-0.0000 ( 6360 PWs) bands (ev): -25.1829 -25.1829 -25.1818 -25.1818 -24.9077 -24.9077 -24.9063 -24.9063 -21.9194 -21.9194 -21.9166 -21.9166 -21.4460 -21.4460 -21.4434 -21.4434 -10.0126 -10.0126 -10.0106 -10.0106 -8.9069 -8.9069 -8.9048 -8.9048 -5.2819 -5.2819 -5.2696 -5.2696 -5.1924 -5.1924 -5.1784 -5.1784 -4.9013 -4.9013 -4.8841 -4.8841 -4.6752 -4.6752 -4.6552 -4.6552 -3.0023 -3.0023 -2.9799 -2.9799 -2.5053 -2.5053 -2.4840 -2.4840 -2.1379 -2.1379 -2.1167 -2.1167 -1.8288 -1.8288 -1.8055 -1.8055 -0.8569 -0.8569 -0.8445 -0.8445 0.9471 0.9471 0.9563 0.9563 6.6424 6.6424 6.6437 6.6437 8.4382 8.4382 8.4385 8.4385 9.6064 9.6064 9.6069 9.6069 k = 0.2833 0.5000-0.0000 ( 6362 PWs) bands (ev): -25.1825 -25.1825 -25.1814 -25.1814 -24.9082 -24.9082 -24.9068 -24.9068 -21.9195 -21.9195 -21.9168 -21.9168 -21.4459 -21.4459 -21.4433 -21.4433 -10.0124 -10.0124 -10.0104 -10.0104 -8.9071 -8.9071 -8.9051 -8.9051 -5.2803 -5.2803 -5.2672 -5.2672 -5.2045 -5.2045 -5.1901 -5.1901 -4.8941 -4.8941 -4.8764 -4.8764 -4.6735 -4.6735 -4.6535 -4.6535 -3.0008 -3.0008 -2.9787 -2.9787 -2.5058 -2.5058 -2.4847 -2.4847 -2.1372 -2.1372 -2.1162 -2.1162 -1.8287 -1.8287 -1.8057 -1.8057 -0.8562 -0.8562 -0.8440 -0.8440 0.9473 0.9473 0.9564 0.9564 6.6870 6.6870 6.6883 6.6883 8.3738 8.3738 8.3741 8.3741 9.6040 9.6040 9.6047 9.6047 k = 0.3000 0.5000-0.0000 ( 6364 PWs) bands (ev): -25.1820 -25.1820 -25.1809 -25.1809 -24.9086 -24.9086 -24.9072 -24.9072 -21.9196 -21.9196 -21.9170 -21.9170 -21.4457 -21.4457 -21.4432 -21.4432 -10.0122 -10.0122 -10.0103 -10.0103 -8.9074 -8.9074 -8.9054 -8.9054 -5.2793 -5.2793 -5.2656 -5.2656 -5.2155 -5.2155 -5.2008 -5.2008 -4.8862 -4.8862 -4.8680 -4.8680 -4.6731 -4.6731 -4.6530 -4.6530 -2.9982 -2.9982 -2.9765 -2.9765 -2.5093 -2.5093 -2.4886 -2.4886 -2.1339 -2.1339 -2.1134 -2.1134 -1.8287 -1.8287 -1.8061 -1.8061 -0.8558 -0.8558 -0.8440 -0.8440 0.9476 0.9476 0.9565 0.9565 6.7339 6.7339 6.7353 6.7353 8.3074 8.3074 8.3078 8.3078 9.6034 9.6034 9.6041 9.6041 k = 0.3167 0.5000-0.0000 ( 6368 PWs) bands (ev): -25.1815 -25.1815 -25.1805 -25.1805 -24.9090 -24.9090 -24.9077 -24.9077 -21.9198 -21.9198 -21.9172 -21.9172 -21.4455 -21.4455 -21.4432 -21.4432 -10.0120 -10.0120 -10.0101 -10.0101 -8.9076 -8.9076 -8.9057 -8.9057 -5.2790 -5.2790 -5.2649 -5.2649 -5.2249 -5.2249 -5.2101 -5.2101 -4.8776 -4.8776 -4.8589 -4.8589 -4.6740 -4.6740 -4.6538 -4.6538 -2.9946 -2.9946 -2.9734 -2.9734 -2.5154 -2.5154 -2.4951 -2.4951 -2.1285 -2.1285 -2.1086 -2.1086 -1.8286 -1.8286 -1.8066 -1.8066 -0.8558 -0.8558 -0.8444 -0.8444 0.9481 0.9481 0.9566 0.9566 6.7830 6.7830 6.7844 6.7844 8.2393 8.2393 8.2397 8.2397 9.6041 9.6041 9.6048 9.6048 k = 0.3333 0.5000-0.0000 ( 6376 PWs) bands (ev): -25.1810 -25.1810 -25.1801 -25.1801 -24.9094 -24.9094 -24.9081 -24.9081 -21.9198 -21.9198 -21.9174 -21.9174 -21.4454 -21.4454 -21.4431 -21.4431 -10.0118 -10.0118 -10.0100 -10.0100 -8.9078 -8.9078 -8.9060 -8.9060 -5.2794 -5.2794 -5.2656 -5.2656 -5.2324 -5.2324 -5.2181 -5.2181 -4.8684 -4.8684 -4.8493 -4.8493 -4.6762 -4.6762 -4.6558 -4.6558 -2.9900 -2.9900 -2.9694 -2.9694 -2.5235 -2.5235 -2.5038 -2.5038 -2.1215 -2.1215 -2.1022 -2.1022 -1.8285 -1.8285 -1.8073 -1.8073 -0.8560 -0.8560 -0.8452 -0.8452 0.9486 0.9486 0.9567 0.9567 6.8344 6.8344 6.8358 6.8358 8.1698 8.1698 8.1704 8.1704 9.6058 9.6058 9.6066 9.6066 k = 0.3500 0.5000-0.0000 ( 6364 PWs) bands (ev): -25.1806 -25.1806 -25.1797 -25.1797 -24.9097 -24.9097 -24.9086 -24.9086 -21.9199 -21.9199 -21.9176 -21.9176 -21.4452 -21.4452 -21.4431 -21.4431 -10.0115 -10.0115 -10.0099 -10.0099 -8.9080 -8.9080 -8.9063 -8.9063 -5.2808 -5.2808 -5.2681 -5.2681 -5.2375 -5.2375 -5.2246 -5.2246 -4.8585 -4.8585 -4.8391 -4.8391 -4.6795 -4.6795 -4.6591 -4.6591 -2.9846 -2.9846 -2.9648 -2.9648 -2.5331 -2.5331 -2.5142 -2.5142 -2.1131 -2.1131 -2.0948 -2.0948 -1.8283 -1.8283 -1.8081 -1.8081 -0.8564 -0.8564 -0.8463 -0.8463 0.9493 0.9493 0.9568 0.9568 6.8877 6.8877 6.8891 6.8891 8.0994 8.0994 8.1000 8.1000 9.6084 9.6084 9.6092 9.6092 k = 0.3667 0.5000-0.0000 ( 6354 PWs) bands (ev): -25.1802 -25.1802 -25.1793 -25.1793 -24.9101 -24.9101 -24.9090 -24.9090 -21.9199 -21.9199 -21.9179 -21.9179 -21.4450 -21.4450 -21.4431 -21.4431 -10.0113 -10.0113 -10.0098 -10.0098 -8.9081 -8.9081 -8.9065 -8.9065 -5.2829 -5.2829 -5.2723 -5.2723 -5.2403 -5.2403 -5.2296 -5.2296 -4.8481 -4.8481 -4.8284 -4.8284 -4.6840 -4.6840 -4.6635 -4.6635 -2.9785 -2.9785 -2.9598 -2.9598 -2.5437 -2.5437 -2.5258 -2.5258 -2.1041 -2.1041 -2.0868 -2.0868 -1.8281 -1.8281 -1.8091 -1.8091 -0.8570 -0.8570 -0.8477 -0.8477 0.9500 0.9500 0.9569 0.9569 6.9431 6.9431 6.9445 6.9445 8.0282 8.0282 8.0290 8.0290 9.6115 9.6115 9.6123 9.6123 k = 0.3833 0.5000-0.0000 ( 6358 PWs) bands (ev): -25.1798 -25.1798 -25.1790 -25.1790 -24.9103 -24.9103 -24.9094 -24.9094 -21.9200 -21.9200 -21.9181 -21.9181 -21.4448 -21.4448 -21.4431 -21.4431 -10.0111 -10.0111 -10.0097 -10.0097 -8.9082 -8.9082 -8.9068 -8.9068 -5.2857 -5.2857 -5.2774 -5.2774 -5.2415 -5.2415 -5.2333 -5.2333 -4.8372 -4.8372 -4.8173 -4.8173 -4.6896 -4.6896 -4.6691 -4.6691 -2.9719 -2.9719 -2.9545 -2.9545 -2.5546 -2.5546 -2.5379 -2.5379 -2.0948 -2.0948 -2.0788 -2.0788 -1.8279 -1.8279 -1.8103 -1.8103 -0.8577 -0.8577 -0.8493 -0.8493 0.9507 0.9507 0.9569 0.9569 7.0003 7.0003 7.0017 7.0017 7.9567 7.9567 7.9575 7.9575 9.6149 9.6149 9.6156 9.6156 k = 0.4000 0.5000-0.0000 ( 6358 PWs) bands (ev): -25.1794 -25.1794 -25.1788 -25.1788 -24.9106 -24.9106 -24.9097 -24.9097 -21.9200 -21.9200 -21.9183 -21.9183 -21.4446 -21.4446 -21.4431 -21.4431 -10.0109 -10.0109 -10.0097 -10.0097 -8.9083 -8.9083 -8.9071 -8.9071 -5.2888 -5.2888 -5.2825 -5.2825 -5.2420 -5.2420 -5.2358 -5.2358 -4.8260 -4.8260 -4.8059 -4.8059 -4.6962 -4.6962 -4.6757 -4.6757 -2.9650 -2.9650 -2.9492 -2.9492 -2.5653 -2.5653 -2.5500 -2.5500 -2.0856 -2.0856 -2.0712 -2.0712 -1.8275 -1.8275 -1.8117 -1.8117 -0.8584 -0.8584 -0.8510 -0.8510 0.9514 0.9514 0.9569 0.9569 7.0592 7.0592 7.0605 7.0605 7.8851 7.8851 7.8860 7.8860 9.6184 9.6184 9.6191 9.6191 k = 0.4167 0.5000-0.0000 ( 6358 PWs) bands (ev): -25.1791 -25.1791 -25.1786 -25.1786 -24.9108 -24.9108 -24.9101 -24.9101 -21.9199 -21.9199 -21.9185 -21.9185 -21.4445 -21.4445 -21.4432 -21.4432 -10.0107 -10.0107 -10.0097 -10.0097 -8.9084 -8.9084 -8.9073 -8.9073 -5.2919 -5.2919 -5.2873 -5.2873 -5.2420 -5.2420 -5.2376 -5.2376 -4.8145 -4.8145 -4.7944 -4.7944 -4.7037 -4.7037 -4.6833 -4.6833 -2.9582 -2.9582 -2.9442 -2.9442 -2.5752 -2.5752 -2.5617 -2.5617 -2.0770 -2.0770 -2.0644 -2.0644 -1.8270 -1.8270 -1.8132 -1.8132 -0.8590 -0.8590 -0.8527 -0.8527 0.9522 0.9522 0.9568 0.9568 7.1196 7.1196 7.1209 7.1209 7.8138 7.8138 7.8147 7.8147 9.6218 9.6218 9.6223 9.6223 k = 0.4333 0.5000-0.0000 ( 6362 PWs) bands (ev): -25.1788 -25.1788 -25.1784 -25.1784 -24.9109 -24.9109 -24.9103 -24.9103 -21.9199 -21.9199 -21.9187 -21.9187 -21.4443 -21.4443 -21.4432 -21.4432 -10.0105 -10.0105 -10.0097 -10.0097 -8.9084 -8.9084 -8.9075 -8.9075 -5.2947 -5.2947 -5.2915 -5.2915 -5.2419 -5.2419 -5.2388 -5.2388 -4.8028 -4.8028 -4.7828 -4.7828 -4.7119 -4.7119 -4.6917 -4.6917 -2.9516 -2.9516 -2.9399 -2.9399 -2.5839 -2.5839 -2.5725 -2.5725 -2.0691 -2.0691 -2.0586 -2.0586 -1.8263 -1.8263 -1.8148 -1.8148 -0.8595 -0.8595 -0.8543 -0.8543 0.9529 0.9529 0.9567 0.9567 7.1812 7.1812 7.1826 7.1826 7.7430 7.7430 7.7440 7.7440 9.6248 9.6248 9.6253 9.6253 k = 0.4500 0.5000-0.0000 ( 6354 PWs) bands (ev): -25.1786 -25.1786 -25.1783 -25.1783 -24.9110 -24.9110 -24.9106 -24.9106 -21.9198 -21.9198 -21.9189 -21.9189 -21.4441 -21.4441 -21.4433 -21.4433 -10.0103 -10.0103 -10.0097 -10.0097 -8.9084 -8.9084 -8.9077 -8.9077 -5.2971 -5.2971 -5.2948 -5.2948 -5.2417 -5.2417 -5.2396 -5.2396 -4.7912 -4.7912 -4.7716 -4.7716 -4.7205 -4.7205 -4.7008 -4.7008 -2.9457 -2.9457 -2.9364 -2.9364 -2.5908 -2.5908 -2.5819 -2.5819 -2.0624 -2.0624 -2.0543 -2.0543 -1.8254 -1.8254 -1.8165 -1.8165 -0.8598 -0.8598 -0.8558 -0.8558 0.9536 0.9536 0.9565 0.9565 7.2436 7.2436 7.2449 7.2449 7.6735 7.6735 7.6745 7.6745 9.6273 9.6273 9.6277 9.6277 k = 0.4667 0.5000-0.0000 ( 6354 PWs) bands (ev): -25.1784 -25.1784 -25.1782 -25.1782 -24.9111 -24.9111 -24.9108 -24.9108 -21.9197 -21.9197 -21.9191 -21.9191 -21.4440 -21.4440 -21.4434 -21.4434 -10.0101 -10.0101 -10.0097 -10.0097 -8.9083 -8.9083 -8.9079 -8.9079 -5.2988 -5.2988 -5.2974 -5.2974 -5.2415 -5.2415 -5.2402 -5.2402 -4.7797 -4.7797 -4.7613 -4.7613 -4.7289 -4.7289 -4.7104 -4.7104 -2.9406 -2.9406 -2.9343 -2.9343 -2.5955 -2.5955 -2.5894 -2.5894 -2.0570 -2.0570 -2.0515 -2.0515 -1.8243 -1.8243 -1.8182 -1.8182 -0.8598 -0.8598 -0.8572 -0.8572 0.9542 0.9542 0.9562 0.9562 7.3055 7.3055 7.3067 7.3067 7.6064 7.6064 7.6075 7.6075 9.6293 9.6293 9.6295 9.6295 k = 0.4833 0.5000-0.0000 ( 6338 PWs) bands (ev): -25.1783 -25.1783 -25.1782 -25.1782 -24.9111 -24.9111 -24.9109 -24.9109 -21.9196 -21.9196 -21.9193 -21.9193 -21.4438 -21.4438 -21.4435 -21.4435 -10.0100 -10.0100 -10.0098 -10.0098 -8.9083 -8.9083 -8.9080 -8.9080 -5.2997 -5.2997 -5.2990 -5.2990 -5.2412 -5.2412 -5.2406 -5.2406 -4.7688 -4.7688 -4.7554 -4.7554 -4.7336 -4.7336 -4.7202 -4.7202 -2.9368 -2.9368 -2.9335 -2.9335 -2.5979 -2.5979 -2.5947 -2.5947 -2.0531 -2.0531 -2.0503 -2.0503 -1.8230 -1.8230 -1.8199 -1.8199 -0.8596 -0.8596 -0.8582 -0.8582 0.9548 0.9548 0.9558 0.9558 7.3628 7.3628 7.3637 7.3637 7.5463 7.5463 7.5472 7.5472 9.6305 9.6305 9.6306 9.6306 k = 0.5000 0.5000-0.0000 ( 6304 PWs) bands (ev): -25.1782 -25.1782 -25.1782 -25.1782 -24.9110 -24.9110 -24.9110 -24.9110 -21.9194 -21.9194 -21.9194 -21.9194 -21.4436 -21.4436 -21.4436 -21.4436 -10.0098 -10.0098 -10.0098 -10.0098 -8.9082 -8.9082 -8.9082 -8.9082 -5.2998 -5.2998 -5.2998 -5.2998 -5.2409 -5.2409 -5.2409 -5.2409 -4.7594 -4.7594 -4.7594 -4.7594 -4.7292 -4.7292 -4.7292 -4.7292 -2.9343 -2.9343 -2.9343 -2.9343 -2.5976 -2.5976 -2.5976 -2.5976 -2.0508 -2.0508 -2.0508 -2.0508 -1.8215 -1.8215 -1.8215 -1.8215 -0.8590 -0.8590 -0.8590 -0.8590 0.9554 0.9554 0.9554 0.9554 7.3939 7.3939 7.3939 7.3939 7.5150 7.5150 7.5150 7.5150 9.6310 9.6310 9.6310 9.6310 k = 0.5000 0.5000-0.0000 ( 6304 PWs) bands (ev): -25.1782 -25.1782 -25.1782 -25.1782 -24.9110 -24.9110 -24.9110 -24.9110 -21.9194 -21.9194 -21.9194 -21.9194 -21.4436 -21.4436 -21.4436 -21.4436 -10.0098 -10.0098 -10.0098 -10.0098 -8.9082 -8.9082 -8.9082 -8.9082 -5.2998 -5.2998 -5.2998 -5.2998 -5.2409 -5.2409 -5.2409 -5.2409 -4.7594 -4.7594 -4.7594 -4.7594 -4.7292 -4.7292 -4.7292 -4.7292 -2.9343 -2.9343 -2.9343 -2.9343 -2.5976 -2.5976 -2.5976 -2.5976 -2.0508 -2.0508 -2.0508 -2.0508 -1.8215 -1.8215 -1.8215 -1.8215 -0.8590 -0.8590 -0.8590 -0.8590 0.9554 0.9554 0.9554 0.9554 7.3939 7.3939 7.3939 7.3939 7.5150 7.5150 7.5150 7.5150 9.6310 9.6310 9.6310 9.6310 k = 0.4881 0.4881-0.0000 ( 6342 PWs) bands (ev): -25.1786 -25.1786 -25.1779 -25.1779 -24.9111 -24.9111 -24.9109 -24.9109 -21.9201 -21.9201 -21.9188 -21.9188 -21.4438 -21.4438 -21.4435 -21.4435 -10.0112 -10.0112 -10.0085 -10.0085 -8.9083 -8.9083 -8.9080 -8.9080 -5.2999 -5.2999 -5.2988 -5.2988 -5.2412 -5.2412 -5.2406 -5.2406 -4.7696 -4.7696 -4.7537 -4.7537 -4.7354 -4.7354 -4.7193 -4.7193 -2.9371 -2.9371 -2.9332 -2.9332 -2.5985 -2.5985 -2.5941 -2.5941 -2.0539 -2.0539 -2.0495 -2.0495 -1.8238 -1.8238 -1.8192 -1.8192 -0.8615 -0.8615 -0.8563 -0.8563 0.9548 0.9548 0.9558 0.9558 7.3387 7.3387 7.3952 7.3952 7.5162 7.5162 7.5699 7.5699 9.6292 9.6292 9.6320 9.6320 k = 0.4762 0.4762-0.0000 ( 6352 PWs) bands (ev): -25.1798 -25.1798 -25.1769 -25.1769 -24.9111 -24.9111 -24.9108 -24.9108 -21.9221 -21.9221 -21.9167 -21.9167 -21.4440 -21.4440 -21.4434 -21.4434 -10.0154 -10.0154 -10.0044 -10.0044 -8.9083 -8.9083 -8.9079 -8.9079 -5.3000 -5.3000 -5.2961 -5.2961 -5.2415 -5.2415 -5.2401 -5.2401 -4.7832 -4.7832 -4.7510 -4.7510 -4.7397 -4.7397 -4.7065 -4.7065 -2.9424 -2.9424 -2.9325 -2.9325 -2.5992 -2.5992 -2.5856 -2.5856 -2.0614 -2.0614 -2.0471 -2.0471 -1.8288 -1.8288 -1.8140 -1.8140 -0.8686 -0.8686 -0.8484 -0.8484 0.9541 0.9541 0.9563 0.9563 7.2480 7.2480 7.3990 7.3990 7.5197 7.5197 7.6597 7.6597 9.6238 9.6238 9.6350 9.6350 k = 0.4643 0.4643-0.0000 ( 6348 PWs) bands (ev): -25.1817 -25.1817 -25.1752 -25.1752 -24.9111 -24.9111 -24.9105 -24.9105 -21.9254 -21.9254 -21.9134 -21.9134 -21.4441 -21.4441 -21.4433 -21.4433 -10.0223 -10.0223 -9.9976 -9.9976 -8.9084 -8.9084 -8.9077 -8.9077 -5.3002 -5.3002 -5.2917 -5.2917 -5.2419 -5.2419 -5.2392 -5.2392 -4.7984 -4.7984 -4.7501 -4.7501 -4.7432 -4.7432 -4.6924 -4.6924 -2.9504 -2.9504 -2.9317 -2.9317 -2.6002 -2.6002 -2.5722 -2.5722 -2.0730 -2.0730 -2.0430 -2.0430 -1.8369 -1.8369 -1.8061 -1.8061 -0.8803 -0.8803 -0.8353 -0.8353 0.9532 0.9532 0.9567 0.9567 7.1522 7.1522 7.4054 7.4054 7.5255 7.5255 7.7538 7.7538 9.6151 9.6151 9.6399 9.6399 k = 0.4524 0.4524-0.0000 ( 6354 PWs) bands (ev): -25.1843 -25.1843 -25.1729 -25.1729 -24.9110 -24.9110 -24.9103 -24.9103 -21.9300 -21.9300 -21.9087 -21.9087 -21.4443 -21.4443 -21.4432 -21.4432 -10.0319 -10.0319 -9.9881 -9.9881 -8.9084 -8.9084 -8.9075 -8.9075 -5.3004 -5.3004 -5.2860 -5.2860 -5.2423 -5.2423 -5.2378 -5.2378 -4.8145 -4.8145 -4.7530 -4.7530 -4.7438 -4.7438 -4.6779 -4.6779 -2.9605 -2.9605 -2.9306 -2.9306 -2.6015 -2.6015 -2.5545 -2.5545 -2.0882 -2.0882 -2.0375 -2.0375 -1.8480 -1.8480 -1.7961 -1.7961 -0.8966 -0.8966 -0.8173 -0.8173 0.9521 0.9521 0.9572 0.9572 7.0552 7.0552 7.4142 7.4142 7.5335 7.5335 7.8483 7.8483 9.6034 9.6034 9.6468 9.6468 k = 0.4405 0.4405-0.0000 ( 6358 PWs) bands (ev): -25.1877 -25.1877 -25.1699 -25.1699 -24.9109 -24.9109 -24.9099 -24.9099 -21.9358 -21.9358 -21.9027 -21.9027 -21.4445 -21.4445 -21.4431 -21.4431 -10.0441 -10.0441 -9.9760 -9.9760 -8.9084 -8.9084 -8.9072 -8.9072 -5.3006 -5.3006 -5.2795 -5.2795 -5.2429 -5.2429 -5.2352 -5.2352 -4.8310 -4.8310 -4.7595 -4.7595 -4.7419 -4.7419 -4.6634 -4.6634 -2.9721 -2.9721 -2.9293 -2.9293 -2.6032 -2.6032 -2.5332 -2.5332 -2.1062 -2.1062 -2.0304 -2.0304 -1.8618 -1.8618 -1.7847 -1.7847 -0.9173 -0.9173 -0.7946 -0.7946 0.9507 0.9507 0.9577 0.9577 6.9579 6.9579 7.4256 7.4256 7.5439 7.5439 7.9421 7.9421 9.5891 9.5891 9.6556 9.6556 k = 0.4286 0.4286-0.0000 ( 6360 PWs) bands (ev): -25.1917 -25.1917 -25.1663 -25.1663 -24.9108 -24.9108 -24.9095 -24.9095 -21.9429 -21.9429 -21.8955 -21.8955 -21.4447 -21.4447 -21.4431 -21.4431 -10.0588 -10.0588 -9.9613 -9.9613 -8.9084 -8.9084 -8.9069 -8.9069 -5.3010 -5.3010 -5.2731 -5.2731 -5.2436 -5.2436 -5.2305 -5.2305 -4.8477 -4.8477 -4.7678 -4.7678 -4.7390 -4.7390 -4.6491 -4.6491 -2.9847 -2.9847 -2.9277 -2.9277 -2.6051 -2.6051 -2.5089 -2.5089 -2.1266 -2.1266 -2.0219 -2.0219 -1.8782 -1.8782 -1.7724 -1.7724 -0.9423 -0.9423 -0.7675 -0.7675 0.9491 0.9491 0.9582 0.9582 6.8608 6.8608 7.4394 7.4394 7.5565 7.5565 8.0345 8.0345 9.5726 9.5726 9.6662 9.6662 k = 0.4167 0.4167-0.0000 ( 6362 PWs) bands (ev): -25.1964 -25.1964 -25.1621 -25.1621 -24.9107 -24.9107 -24.9091 -24.9091 -21.9512 -21.9512 -21.8870 -21.8870 -21.4449 -21.4449 -21.4430 -21.4430 -10.0760 -10.0760 -9.9440 -9.9440 -8.9083 -8.9083 -8.9065 -8.9065 -5.3013 -5.3013 -5.2679 -5.2679 -5.2444 -5.2444 -5.2229 -5.2229 -4.8646 -4.8646 -4.7775 -4.7775 -4.7354 -4.7354 -4.6349 -4.6349 -2.9977 -2.9977 -2.9260 -2.9260 -2.6074 -2.6074 -2.4821 -2.4821 -2.1488 -2.1488 -2.0121 -2.0121 -1.8967 -1.8967 -1.7596 -1.7596 -0.9714 -0.9714 -0.7364 -0.7364 0.9471 0.9471 0.9586 0.9586 6.7641 6.7641 7.4555 7.4555 7.5713 7.5713 8.1251 8.1251 9.5546 9.5546 9.6785 9.6785 k = 0.4048 0.4048-0.0000 ( 6354 PWs) bands (ev): -25.2017 -25.2017 -25.1572 -25.1572 -24.9105 -24.9105 -24.9087 -24.9087 -21.9607 -21.9607 -21.8774 -21.8774 -21.4451 -21.4451 -21.4430 -21.4430 -10.0955 -10.0955 -9.9242 -9.9242 -8.9082 -8.9082 -8.9061 -8.9061 -5.3018 -5.3018 -5.2645 -5.2645 -5.2453 -5.2453 -5.2116 -5.2116 -4.8816 -4.8816 -4.7886 -4.7886 -4.7311 -4.7311 -4.6210 -4.6210 -3.0109 -3.0109 -2.9241 -2.9241 -2.6098 -2.6098 -2.4534 -2.4534 -2.1726 -2.1726 -2.0010 -2.0010 -1.9172 -1.9172 -1.7467 -1.7467 -1.0044 -1.0044 -0.7015 -0.7015 0.9449 0.9449 0.9589 0.9589 6.6681 6.6681 7.4740 7.4740 7.5882 7.5882 8.2133 8.2133 9.5356 9.5356 9.6924 9.6924 k = 0.3929 0.3929-0.0000 ( 6354 PWs) bands (ev): -25.2076 -25.2076 -25.1518 -25.1518 -24.9103 -24.9103 -24.9082 -24.9082 -21.9713 -21.9713 -21.8667 -21.8667 -21.4453 -21.4453 -21.4429 -21.4429 -10.1171 -10.1171 -9.9020 -9.9020 -8.9081 -8.9081 -8.9056 -8.9056 -5.3023 -5.3023 -5.2627 -5.2627 -5.2464 -5.2464 -5.1971 -5.1971 -4.8987 -4.8987 -4.8009 -4.8009 -4.7262 -4.7262 -4.6074 -4.6074 -3.0239 -3.0239 -2.9221 -2.9221 -2.6125 -2.6125 -2.4230 -2.4230 -2.1978 -2.1978 -1.9889 -1.9889 -1.9393 -1.9393 -1.7337 -1.7337 -1.0410 -1.0410 -0.6631 -0.6631 0.9425 0.9425 0.9589 0.9589 6.5728 6.5728 7.4947 7.4947 7.6072 7.6072 8.2986 8.2986 9.5162 9.5162 9.7077 9.7077 k = 0.3810 0.3810-0.0000 ( 6366 PWs) bands (ev): -25.2140 -25.2140 -25.1458 -25.1458 -24.9101 -24.9101 -24.9077 -24.9077 -21.9829 -21.9829 -21.8550 -21.8550 -21.4455 -21.4455 -21.4429 -21.4429 -10.1408 -10.1408 -9.8776 -9.8776 -8.9079 -8.9079 -8.9051 -8.9051 -5.3028 -5.3028 -5.2621 -5.2621 -5.2475 -5.2475 -5.1797 -5.1797 -4.9157 -4.9157 -4.8143 -4.8143 -4.7207 -4.7207 -4.5942 -4.5942 -3.0366 -3.0366 -2.9200 -2.9200 -2.6153 -2.6153 -2.3914 -2.3914 -2.2241 -2.2241 -1.9769 -1.9769 -1.9616 -1.9616 -1.7209 -1.7209 -1.0811 -1.0811 -0.6215 -0.6215 0.9397 0.9397 0.9587 0.9587 6.4784 6.4784 7.5176 7.5176 7.6283 7.6283 8.3803 8.3803 9.4973 9.4973 9.7244 9.7244 k = 0.3690 0.3690-0.0000 ( 6374 PWs) bands (ev): -25.2208 -25.2208 -25.1393 -25.1393 -24.9099 -24.9099 -24.9072 -24.9072 -21.9956 -21.9956 -21.8423 -21.8423 -21.4457 -21.4457 -21.4429 -21.4429 -10.1664 -10.1664 -9.8509 -9.8509 -8.9077 -8.9077 -8.9046 -8.9046 -5.3034 -5.3034 -5.2624 -5.2624 -5.2486 -5.2486 -5.1601 -5.1601 -4.9327 -4.9327 -4.8288 -4.8288 -4.7144 -4.7144 -4.5813 -4.5813 -3.0488 -3.0488 -2.9179 -2.9179 -2.6183 -2.6183 -2.3586 -2.3586 -2.2513 -2.2513 -1.9899 -1.9899 -1.9593 -1.9593 -1.7083 -1.7083 -1.1243 -1.1243 -0.5770 -0.5770 0.9368 0.9368 0.9583 0.9583 6.3850 6.3850 7.5426 7.5426 7.6514 7.6514 8.4577 8.4577 9.4794 9.4794 9.7422 9.7422 k = 0.3571 0.3571-0.0000 ( 6378 PWs) bands (ev): -25.2281 -25.2281 -25.1322 -25.1322 -24.9097 -24.9097 -24.9067 -24.9067 -22.0093 -22.0093 -21.8287 -21.8287 -21.4459 -21.4459 -21.4429 -21.4429 -10.1937 -10.1937 -9.8222 -9.8222 -8.9074 -8.9074 -8.9040 -8.9040 -5.3041 -5.3041 -5.2633 -5.2633 -5.2498 -5.2498 -5.1385 -5.1385 -4.9496 -4.9496 -4.8442 -4.8442 -4.7075 -4.7075 -4.5687 -4.5687 -3.0604 -3.0604 -2.9157 -2.9157 -2.6214 -2.6214 -2.3252 -2.3252 -2.2794 -2.2794 -2.0157 -2.0157 -1.9444 -1.9444 -1.6961 -1.6961 -1.1704 -1.1704 -0.5299 -0.5299 0.9335 0.9335 0.9574 0.9574 6.2927 6.2927 7.5696 7.5696 7.6763 7.6763 8.5300 8.5300 9.4635 9.4635 9.7610 9.7610 k = 0.3452 0.3452-0.0000 ( 6376 PWs) bands (ev): -25.2357 -25.2357 -25.1247 -25.1247 -24.9095 -24.9095 -24.9063 -24.9063 -22.0238 -22.0238 -21.8143 -21.8143 -21.4461 -21.4461 -21.4429 -21.4429 -10.2225 -10.2225 -9.7914 -9.7914 -8.9071 -8.9071 -8.9034 -8.9034 -5.3048 -5.3048 -5.2648 -5.2648 -5.2508 -5.2508 -5.1151 -5.1151 -4.9663 -4.9663 -4.8605 -4.8605 -4.6998 -4.6998 -4.5566 -4.5566 -3.0714 -3.0714 -2.9136 -2.9136 -2.6245 -2.6245 -2.3083 -2.3083 -2.2911 -2.2911 -2.0430 -2.0430 -1.9283 -1.9283 -1.6842 -1.6842 -1.2191 -1.2191 -0.4803 -0.4803 0.9301 0.9301 0.9562 0.9562 6.2016 6.2016 7.5985 7.5985 7.7031 7.7031 8.5961 8.5961 9.4504 9.4504 9.7806 9.7806 k = 0.3333 0.3333-0.0000 ( 6384 PWs) bands (ev): -25.2436 -25.2436 -25.1166 -25.1166 -24.9092 -24.9092 -24.9058 -24.9058 -22.0392 -22.0392 -21.7991 -21.7991 -21.4463 -21.4463 -21.4429 -21.4429 -10.2527 -10.2527 -9.7589 -9.7589 -8.9066 -8.9066 -8.9028 -8.9028 -5.3055 -5.3055 -5.2668 -5.2668 -5.2518 -5.2518 -5.0903 -5.0903 -4.9829 -4.9829 -4.8775 -4.8775 -4.6914 -4.6914 -4.5447 -4.5447 -3.0815 -3.0815 -2.9116 -2.9116 -2.6276 -2.6276 -2.3378 -2.3378 -2.2567 -2.2567 -2.0713 -2.0713 -1.9114 -1.9114 -1.6727 -1.6727 -1.2701 -1.2701 -0.4286 -0.4286 0.9264 0.9264 0.9546 0.9546 6.1119 6.1119 7.6292 7.6292 7.7316 7.7316 8.6550 8.6550 9.4411 9.4411 9.8007 9.8007 k = 0.3214 0.3214-0.0000 ( 6386 PWs) bands (ev): -25.2518 -25.2518 -25.1082 -25.1082 -24.9089 -24.9089 -24.9054 -24.9054 -22.0553 -22.0553 -21.7834 -21.7834 -21.4464 -21.4464 -21.4429 -21.4429 -10.2840 -10.2840 -9.7246 -9.7246 -8.9062 -8.9062 -8.9021 -8.9021 -5.3063 -5.3063 -5.2692 -5.2692 -5.2527 -5.2527 -5.0641 -5.0641 -4.9991 -4.9991 -4.8951 -4.8951 -4.6823 -4.6823 -4.5333 -4.5333 -3.0909 -3.0909 -2.9098 -2.9098 -2.6308 -2.6308 -2.3679 -2.3679 -2.2222 -2.2222 -2.1004 -2.1004 -1.8938 -1.8938 -1.6617 -1.6617 -1.3230 -1.3230 -0.3749 -0.3749 0.9226 0.9226 0.9525 0.9525 6.0235 6.0235 7.6617 7.6617 7.7618 7.7618 8.7056 8.7056 9.4364 9.4364 9.8211 9.8211 k = 0.3095 0.3095-0.0000 ( 6382 PWs) bands (ev): -25.2601 -25.2601 -25.0994 -25.0994 -24.9087 -24.9087 -24.9050 -24.9050 -22.0720 -22.0720 -21.7670 -21.7670 -21.4466 -21.4466 -21.4428 -21.4428 -10.3163 -10.3163 -9.6887 -9.6887 -8.9056 -8.9056 -8.9014 -8.9014 -5.3072 -5.3072 -5.2720 -5.2720 -5.2534 -5.2534 -5.0373 -5.0373 -5.0145 -5.0145 -4.9133 -4.9133 -4.6725 -4.6725 -4.5223 -4.5223 -3.0995 -3.0995 -2.9081 -2.9081 -2.6340 -2.6340 -2.3984 -2.3984 -2.1878 -2.1878 -2.1301 -2.1301 -1.8756 -1.8756 -1.6511 -1.6511 -1.3774 -1.3774 -0.3196 -0.3196 0.9185 0.9185 0.9499 0.9499 5.9367 5.9367 7.6958 7.6958 7.7935 7.7935 8.7470 8.7470 9.4372 9.4372 9.8415 9.8415 k = 0.2976 0.2976-0.0000 ( 6394 PWs) bands (ev): -25.2687 -25.2687 -25.0902 -25.0902 -24.9084 -24.9084 -24.9046 -24.9046 -22.0894 -22.0894 -21.7502 -21.7502 -21.4467 -21.4467 -21.4429 -21.4429 -10.3494 -10.3494 -9.6515 -9.6515 -8.9051 -8.9051 -8.9007 -8.9007 -5.3081 -5.3081 -5.2752 -5.2752 -5.2541 -5.2541 -5.0325 -5.0325 -5.0064 -5.0064 -4.9319 -4.9319 -4.6620 -4.6620 -4.5116 -4.5116 -3.1072 -3.1072 -2.9066 -2.9066 -2.6371 -2.6371 -2.4293 -2.4293 -2.1606 -2.1606 -2.1537 -2.1537 -1.8571 -1.8571 -1.6409 -1.6409 -1.4330 -1.4330 -0.2628 -0.2628 0.9142 0.9142 0.9469 0.9469 5.8514 5.8514 7.7313 7.7313 7.8267 7.8267 8.7787 8.7787 9.4436 9.4436 9.8616 9.8616 k = 0.2857 0.2857-0.0000 ( 6382 PWs) bands (ev): -25.2773 -25.2773 -25.0807 -25.0807 -24.9081 -24.9081 -24.9042 -24.9042 -22.1072 -22.1072 -21.7331 -21.7331 -21.4468 -21.4468 -21.4428 -21.4428 -10.3830 -10.3830 -9.6130 -9.6130 -8.9044 -8.9044 -8.9000 -8.9000 -5.3091 -5.3091 -5.2786 -5.2786 -5.2546 -5.2546 -5.0474 -5.0474 -4.9773 -4.9773 -4.9508 -4.9508 -4.6508 -4.6508 -4.5013 -4.5013 -3.1139 -3.1139 -2.9054 -2.9054 -2.6402 -2.6402 -2.4604 -2.4604 -2.1912 -2.1912 -2.1207 -2.1207 -1.8381 -1.8381 -1.6313 -1.6313 -1.4891 -1.4891 -0.2048 -0.2048 0.9099 0.9099 0.9435 0.9435 5.7678 5.7678 7.7683 7.7683 7.8611 7.8611 8.8007 8.8007 9.4553 9.4553 9.8810 9.8810 k = 0.2738 0.2738-0.0000 ( 6392 PWs) bands (ev): -25.2860 -25.2860 -25.0709 -25.0709 -24.9078 -24.9078 -24.9039 -24.9039 -22.1254 -22.1254 -21.7156 -21.7156 -21.4470 -21.4470 -21.4429 -21.4429 -10.4170 -10.4170 -9.5735 -9.5735 -8.9038 -8.9038 -8.8992 -8.8992 -5.3101 -5.3101 -5.2824 -5.2824 -5.2550 -5.2550 -5.0625 -5.0625 -4.9700 -4.9700 -4.9469 -4.9469 -4.6390 -4.6390 -4.4914 -4.4914 -3.1198 -3.1198 -2.9044 -2.9044 -2.6433 -2.6433 -2.4918 -2.4918 -2.2222 -2.2222 -2.0890 -2.0890 -1.8190 -1.8190 -1.6221 -1.6221 -1.5452 -1.5452 -0.1457 -0.1457 0.9053 0.9053 0.9395 0.9395 5.6861 5.6861 7.8066 7.8066 7.8969 7.8969 8.8138 8.8138 9.4713 9.4713 9.8994 9.8994 k = 0.2619 0.2619-0.0000 ( 6392 PWs) bands (ev): -25.2946 -25.2946 -25.0610 -25.0610 -24.9075 -24.9075 -24.9036 -24.9036 -22.1439 -22.1439 -21.6980 -21.6980 -21.4471 -21.4471 -21.4429 -21.4429 -10.4512 -10.4512 -9.5331 -9.5331 -8.9030 -8.9030 -8.8985 -8.8985 -5.3112 -5.3112 -5.2863 -5.2863 -5.2553 -5.2553 -5.0773 -5.0773 -4.9893 -4.9893 -4.9156 -4.9156 -4.6265 -4.6265 -4.4819 -4.4819 -3.1247 -3.1247 -2.9038 -2.9038 -2.6463 -2.6463 -2.5233 -2.5233 -2.2535 -2.2535 -2.0594 -2.0594 -1.7998 -1.7998 -1.6142 -1.6142 -1.5994 -1.5994 -0.0860 -0.0860 0.9007 0.9007 0.9352 0.9352 5.6062 5.6062 7.8461 7.8461 7.9336 7.9336 8.8190 8.8190 9.4901 9.4901 9.9163 9.9163 k = 0.2500 0.2500-0.0000 ( 6408 PWs) bands (ev): -25.3033 -25.3033 -25.0508 -25.0508 -24.9072 -24.9072 -24.9033 -24.9033 -22.1625 -22.1625 -21.6804 -21.6804 -21.4472 -21.4472 -21.4429 -21.4429 -10.4855 -10.4855 -9.4920 -9.4920 -8.9023 -8.9023 -8.8977 -8.8977 -5.3124 -5.3124 -5.2904 -5.2904 -5.2555 -5.2555 -5.0916 -5.0916 -5.0087 -5.0087 -4.8837 -4.8837 -4.6135 -4.6135 -4.4728 -4.4728 -3.1287 -3.1287 -2.9036 -2.9036 -2.6492 -2.6492 -2.5547 -2.5547 -2.2848 -2.2848 -2.0334 -2.0334 -1.7806 -1.7806 -1.6533 -1.6533 -1.6044 -1.6044 -0.0258 -0.0258 0.8959 0.8959 0.9305 0.9305 5.5283 5.5283 7.8866 7.8866 7.9714 7.9714 8.8179 8.8179 9.5100 9.5100 9.9312 9.9312 k = 0.2381 0.2381-0.0000 ( 6398 PWs) bands (ev): -25.3118 -25.3118 -25.0406 -25.0406 -24.9069 -24.9069 -24.9031 -24.9031 -22.1813 -22.1813 -21.6627 -21.6627 -21.4473 -21.4473 -21.4429 -21.4429 -10.5195 -10.5195 -9.4505 -9.4505 -8.9015 -8.9015 -8.8970 -8.8970 -5.3137 -5.3137 -5.2947 -5.2947 -5.2556 -5.2556 -5.1056 -5.1056 -5.0279 -5.0279 -4.8514 -4.8514 -4.6000 -4.6000 -4.4641 -4.4641 -3.1316 -3.1316 -2.9037 -2.9037 -2.6521 -2.6521 -2.5861 -2.5861 -2.3161 -2.3161 -2.0135 -2.0135 -1.7618 -1.7618 -1.7002 -1.7002 -1.5967 -1.5967 0.0346 0.0346 0.8911 0.8911 0.9254 0.9254 5.4525 5.4525 7.9280 7.9280 8.0099 8.0099 8.8119 8.8119 9.5292 9.5292 9.9438 9.9438 k = 0.2262 0.2262-0.0000 ( 6406 PWs) bands (ev): -25.3202 -25.3202 -25.0303 -25.0303 -24.9066 -24.9066 -24.9028 -24.9028 -22.2001 -22.2001 -21.6452 -21.6452 -21.4474 -21.4474 -21.4429 -21.4429 -10.5531 -10.5531 -9.4088 -9.4088 -8.9007 -8.9007 -8.8962 -8.8962 -5.3152 -5.3152 -5.2990 -5.2990 -5.2557 -5.2557 -5.1191 -5.1191 -5.0470 -5.0470 -4.8186 -4.8186 -4.5860 -4.5860 -4.4558 -4.4558 -3.1336 -3.1336 -2.9044 -2.9044 -2.6550 -2.6550 -2.6171 -2.6171 -2.3471 -2.3471 -2.0040 -2.0040 -1.7478 -1.7478 -1.7330 -1.7330 -1.5892 -1.5892 0.0950 0.0950 0.8863 0.8863 0.9199 0.9199 5.3789 5.3789 7.9701 7.9701 8.0491 8.0491 8.8022 8.8022 9.5464 9.5464 9.9535 9.9535 k = 0.2143 0.2143-0.0000 ( 6390 PWs) bands (ev): -25.3284 -25.3284 -25.0199 -25.0199 -24.9063 -24.9063 -24.9026 -24.9026 -22.2188 -22.2188 -21.6279 -21.6279 -21.4474 -21.4474 -21.4429 -21.4429 -10.5862 -10.5862 -9.3670 -9.3670 -8.8999 -8.8999 -8.8954 -8.8954 -5.3167 -5.3167 -5.3034 -5.3034 -5.2557 -5.2557 -5.1321 -5.1321 -5.0657 -5.0657 -4.7857 -4.7857 -4.5717 -4.5717 -4.4479 -4.4479 -3.1344 -3.1344 -2.9055 -2.9055 -2.6584 -2.6584 -2.6472 -2.6472 -2.3778 -2.3778 -2.0102 -2.0102 -1.7629 -1.7629 -1.7217 -1.7217 -1.5821 -1.5821 0.1550 0.1550 0.8814 0.8814 0.9143 0.9143 5.3077 5.3077 8.0129 8.0129 8.0888 8.0888 8.7899 8.7899 9.5604 9.5604 9.9599 9.9599 k = 0.2024 0.2024-0.0000 ( 6398 PWs) bands (ev): -25.3365 -25.3365 -25.0097 -25.0097 -24.9061 -24.9061 -24.9025 -24.9025 -22.2372 -22.2372 -21.6109 -21.6109 -21.4475 -21.4475 -21.4429 -21.4429 -10.6186 -10.6186 -9.3255 -9.3255 -8.8991 -8.8991 -8.8947 -8.8947 -5.3185 -5.3185 -5.3077 -5.3077 -5.2556 -5.2556 -5.1445 -5.1445 -5.0840 -5.0840 -4.7527 -4.7527 -4.5571 -4.5571 -4.4404 -4.4404 -3.1342 -3.1342 -2.9072 -2.9072 -2.6793 -2.6793 -2.6592 -2.6592 -2.4080 -2.4080 -2.0346 -2.0346 -1.7677 -1.7677 -1.7038 -1.7038 -1.5755 -1.5755 0.2144 0.2144 0.8765 0.8765 0.9084 0.9084 5.2389 5.2389 8.0562 8.0562 8.1287 8.1287 8.7757 8.7757 9.5704 9.5704 9.9628 9.9628 k = 0.1905 0.1905-0.0000 ( 6398 PWs) bands (ev): -25.3442 -25.3442 -24.9995 -24.9995 -24.9058 -24.9058 -24.9023 -24.9023 -22.2553 -22.2553 -21.5943 -21.5943 -21.4475 -21.4475 -21.4429 -21.4429 -10.6501 -10.6501 -9.2844 -9.2844 -8.8983 -8.8983 -8.8940 -8.8940 -5.3205 -5.3205 -5.3119 -5.3119 -5.2555 -5.2555 -5.1565 -5.1565 -5.1018 -5.1018 -4.7199 -4.7199 -4.5422 -4.5422 -4.4333 -4.4333 -3.1329 -3.1329 -2.9095 -2.9095 -2.7089 -2.7089 -2.6620 -2.6620 -2.4375 -2.4375 -2.0730 -2.0730 -1.7592 -1.7592 -1.6859 -1.6859 -1.5692 -1.5692 0.2729 0.2729 0.8716 0.8716 0.9023 0.9023 5.1726 5.1726 8.0997 8.0997 8.1687 8.1687 8.7605 8.7605 9.5761 9.5761 9.9620 9.9620 k = 0.1786 0.1786-0.0000 ( 6394 PWs) bands (ev): -25.3517 -25.3517 -24.9896 -24.9896 -24.9056 -24.9056 -24.9022 -24.9022 -22.2730 -22.2730 -21.5782 -21.5782 -21.4476 -21.4476 -21.4429 -21.4429 -10.6805 -10.6805 -9.2440 -9.2440 -8.8975 -8.8975 -8.8932 -8.8932 -5.3228 -5.3228 -5.3158 -5.3158 -5.2553 -5.2553 -5.1678 -5.1678 -5.1189 -5.1189 -4.6874 -4.6874 -4.5273 -4.5273 -4.4265 -4.4265 -3.1304 -3.1304 -2.9125 -2.9125 -2.7380 -2.7380 -2.6644 -2.6644 -2.4660 -2.4660 -2.1197 -2.1197 -1.7429 -1.7429 -1.6684 -1.6684 -1.5633 -1.5633 0.3301 0.3301 0.8668 0.8668 0.8962 0.8962 5.1091 5.1091 8.1434 8.1434 8.2087 8.2087 8.7447 8.7447 9.5774 9.5774 9.9575 9.9575 k = 0.1667 0.1667-0.0000 ( 6378 PWs) bands (ev): -25.3588 -25.3588 -24.9799 -24.9799 -24.9053 -24.9053 -24.9020 -24.9020 -22.2902 -22.2902 -21.5626 -21.5626 -21.4476 -21.4476 -21.4429 -21.4429 -10.7097 -10.7097 -9.2045 -9.2045 -8.8967 -8.8967 -8.8925 -8.8925 -5.3256 -5.3256 -5.3194 -5.3194 -5.2552 -5.2552 -5.1785 -5.1785 -5.1353 -5.1353 -4.6553 -4.6553 -4.5124 -4.5124 -4.4202 -4.4202 -3.1267 -3.1267 -2.9162 -2.9162 -2.7662 -2.7662 -2.6666 -2.6666 -2.4934 -2.4934 -2.1703 -2.1703 -1.7228 -1.7228 -1.6515 -1.6515 -1.5578 -1.5578 0.3858 0.3858 0.8620 0.8620 0.8901 0.8901 5.0485 5.0485 8.1869 8.1869 8.2482 8.2482 8.7287 8.7287 9.5746 9.5746 9.9494 9.9494 k = 0.1548 0.1548-0.0000 ( 6388 PWs) bands (ev): -25.3656 -25.3656 -24.9705 -24.9705 -24.9051 -24.9051 -24.9019 -24.9019 -22.3067 -22.3067 -21.5478 -21.5478 -21.4477 -21.4477 -21.4429 -21.4429 -10.7376 -10.7376 -9.1663 -9.1663 -8.8959 -8.8959 -8.8919 -8.8919 -5.3287 -5.3287 -5.3227 -5.3227 -5.2550 -5.2550 -5.1887 -5.1887 -5.1507 -5.1507 -4.6239 -4.6239 -4.4976 -4.4976 -4.4142 -4.4142 -3.1219 -3.1219 -2.9207 -2.9207 -2.7935 -2.7935 -2.6686 -2.6686 -2.5195 -2.5195 -2.2227 -2.2227 -1.7012 -1.7012 -1.6353 -1.6353 -1.5527 -1.5527 0.4396 0.4396 0.8574 0.8574 0.8840 0.8840 4.9910 4.9910 8.2302 8.2302 8.2872 8.2872 8.7128 8.7128 9.5682 9.5682 9.9381 9.9381 k = 0.1429 0.1429-0.0000 ( 6386 PWs) bands (ev): -25.3720 -25.3720 -24.9614 -24.9614 -24.9049 -24.9049 -24.9018 -24.9018 -22.3224 -22.3224 -21.5337 -21.5337 -21.4477 -21.4477 -21.4429 -21.4429 -10.7639 -10.7639 -9.1296 -9.1296 -8.8952 -8.8952 -8.8912 -8.8912 -5.3322 -5.3322 -5.3258 -5.3258 -5.2549 -5.2549 -5.1981 -5.1981 -5.1651 -5.1651 -4.5935 -4.5935 -4.4830 -4.4830 -4.4087 -4.4087 -3.1158 -3.1158 -2.9260 -2.9260 -2.8197 -2.8197 -2.6706 -2.6706 -2.5440 -2.5440 -2.2752 -2.2752 -1.6795 -1.6795 -1.6198 -1.6198 -1.5478 -1.5478 0.4912 0.4912 0.8529 0.8529 0.8781 0.8781 4.9366 4.9366 8.2728 8.2728 8.3253 8.3253 8.6973 8.6973 9.5589 9.5589 9.9238 9.9238 k = 0.1310 0.1310-0.0000 ( 6395 PWs) bands (ev): -25.3780 -25.3780 -24.9528 -24.9528 -24.9047 -24.9047 -24.9017 -24.9017 -22.3374 -22.3374 -21.5204 -21.5204 -21.4477 -21.4477 -21.4429 -21.4429 -10.7887 -10.7887 -9.0946 -9.0946 -8.8945 -8.8945 -8.8906 -8.8906 -5.3357 -5.3357 -5.3288 -5.3288 -5.2549 -5.2549 -5.2069 -5.2069 -5.1783 -5.1783 -4.5641 -4.5641 -4.4689 -4.4689 -4.4035 -4.4035 -3.1085 -3.1085 -2.9320 -2.9320 -2.8445 -2.8445 -2.6724 -2.6724 -2.5668 -2.5668 -2.3271 -2.3271 -1.6584 -1.6584 -1.6052 -1.6052 -1.5434 -1.5434 0.5403 0.5403 0.8485 0.8485 0.8723 0.8723 4.8856 4.8856 8.3145 8.3145 8.3623 8.3623 8.6825 8.6825 9.5474 9.5474 9.9072 9.9072 k = 0.1190 0.1190-0.0000 ( 6399 PWs) bands (ev): -25.3836 -25.3836 -24.9448 -24.9448 -24.9045 -24.9045 -24.9016 -24.9016 -22.3514 -22.3514 -21.5081 -21.5081 -21.4477 -21.4477 -21.4429 -21.4429 -10.8117 -10.8117 -9.0616 -9.0616 -8.8939 -8.8939 -8.8900 -8.8900 -5.3391 -5.3391 -5.3320 -5.3320 -5.2551 -5.2551 -5.2148 -5.2148 -5.1902 -5.1902 -4.5362 -4.5362 -4.4552 -4.4552 -4.3986 -4.3986 -3.1001 -3.1001 -2.9388 -2.9388 -2.8678 -2.8678 -2.6740 -2.6740 -2.5877 -2.5877 -2.3777 -2.3777 -1.6385 -1.6385 -1.5914 -1.5914 -1.5392 -1.5392 0.5865 0.5865 0.8444 0.8444 0.8669 0.8669 4.8382 4.8382 8.3550 8.3550 8.3977 8.3977 8.6684 8.6684 9.5343 9.5343 9.8887 9.8887 k = 0.1071 0.1071-0.0000 ( 6397 PWs) bands (ev): -25.3887 -25.3887 -24.9372 -24.9372 -24.9044 -24.9044 -24.9016 -24.9016 -22.3644 -22.3644 -21.4967 -21.4967 -21.4477 -21.4477 -21.4428 -21.4428 -10.8329 -10.8329 -9.0308 -9.0308 -8.8933 -8.8933 -8.8895 -8.8895 -5.3424 -5.3424 -5.3352 -5.3352 -5.2554 -5.2554 -5.2218 -5.2218 -5.2009 -5.2009 -4.5099 -4.5099 -4.4422 -4.4422 -4.3942 -4.3942 -3.0905 -3.0905 -2.9463 -2.9463 -2.8893 -2.8893 -2.6755 -2.6755 -2.6064 -2.6064 -2.4266 -2.4266 -1.6201 -1.6201 -1.5785 -1.5785 -1.5352 -1.5352 0.6295 0.6295 0.8405 0.8405 0.8618 0.8618 4.7945 4.7945 8.3940 8.3940 8.4314 8.4314 8.6553 8.6553 9.5205 9.5205 9.8688 9.8688 k = 0.0952 0.0952-0.0000 ( 6395 PWs) bands (ev): -25.3933 -25.3933 -24.9304 -24.9304 -24.9042 -24.9042 -24.9015 -24.9015 -22.3762 -22.3762 -21.4864 -21.4864 -21.4476 -21.4476 -21.4428 -21.4428 -10.8521 -10.8521 -9.0025 -9.0025 -8.8928 -8.8928 -8.8890 -8.8890 -5.3454 -5.3454 -5.3386 -5.3386 -5.2561 -5.2561 -5.2279 -5.2279 -5.2101 -5.2101 -4.4856 -4.4856 -4.4299 -4.4299 -4.3900 -4.3900 -3.0799 -3.0799 -2.9544 -2.9544 -2.9088 -2.9088 -2.6768 -2.6768 -2.6231 -2.6231 -2.4733 -2.4733 -1.6035 -1.6035 -1.5665 -1.5665 -1.5316 -1.5316 0.6690 0.6690 0.8369 0.8369 0.8572 0.8572 4.7547 4.7547 8.4309 8.4309 8.4629 8.4629 8.6433 8.6433 9.5066 9.5066 9.8483 9.8483 k = 0.0833 0.0833-0.0000 ( 6401 PWs) bands (ev): -25.3974 -25.3974 -24.9242 -24.9242 -24.9041 -24.9041 -24.9014 -24.9014 -22.3869 -22.3869 -21.4772 -21.4772 -21.4475 -21.4475 -21.4428 -21.4428 -10.8693 -10.8693 -8.9769 -8.9769 -8.8923 -8.8923 -8.8885 -8.8885 -5.3481 -5.3481 -5.3421 -5.3421 -5.2572 -5.2572 -5.2327 -5.2327 -5.2181 -5.2181 -4.4637 -4.4637 -4.4184 -4.4184 -4.3862 -4.3862 -3.0685 -3.0685 -2.9627 -2.9627 -2.9261 -2.9261 -2.6780 -2.6780 -2.6375 -2.6375 -2.5174 -2.5174 -1.5891 -1.5891 -1.5554 -1.5554 -1.5281 -1.5281 0.7045 0.7045 0.8336 0.8336 0.8530 0.8530 4.7191 4.7191 8.4653 8.4653 8.4920 8.4920 8.6324 8.6324 9.4931 9.4931 9.8278 9.8278 k = 0.0714 0.0714-0.0000 ( 6399 PWs) bands (ev): -25.4010 -25.4010 -24.9187 -24.9187 -24.9039 -24.9039 -24.9013 -24.9013 -22.3963 -22.3963 -21.4692 -21.4692 -21.4474 -21.4474 -21.4428 -21.4428 -10.8844 -10.8844 -8.9542 -8.9542 -8.8918 -8.8918 -8.8881 -8.8881 -5.3505 -5.3505 -5.3455 -5.3455 -5.2587 -5.2587 -5.2363 -5.2363 -5.2248 -5.2248 -4.4445 -4.4445 -4.4078 -4.4078 -4.3826 -4.3826 -3.0567 -3.0567 -2.9709 -2.9709 -2.9411 -2.9411 -2.6791 -2.6791 -2.6498 -2.6498 -2.5584 -2.5584 -1.5769 -1.5769 -1.5453 -1.5453 -1.5249 -1.5249 0.7357 0.7357 0.8310 0.8310 0.8493 0.8493 4.6877 4.6877 8.4967 8.4967 8.5182 8.5182 8.6229 8.6229 9.4805 9.4805 9.8079 9.8079 k = 0.0595 0.0595-0.0000 ( 6393 PWs) bands (ev): -25.4041 -25.4041 -24.9141 -24.9141 -24.9037 -24.9037 -24.9013 -24.9013 -22.4044 -22.4044 -21.4625 -21.4625 -21.4471 -21.4471 -21.4428 -21.4428 -10.8972 -10.8972 -8.9347 -8.9347 -8.8914 -8.8914 -8.8878 -8.8878 -5.3526 -5.3526 -5.3487 -5.3487 -5.2605 -5.2605 -5.2388 -5.2388 -5.2303 -5.2303 -4.4286 -4.4286 -4.3980 -4.3980 -4.3792 -4.3792 -3.0451 -3.0451 -2.9783 -2.9783 -2.9536 -2.9536 -2.6800 -2.6800 -2.6599 -2.6599 -2.5958 -2.5958 -1.5672 -1.5672 -1.5362 -1.5362 -1.5219 -1.5219 0.7622 0.7622 0.8291 0.8291 0.8462 0.8462 4.6609 4.6609 8.5245 8.5245 8.5412 8.5412 8.6147 8.6147 9.4691 9.4691 9.7894 9.7894 k = 0.0476 0.0476-0.0000 ( 6391 PWs) bands (ev): -25.4066 -25.4066 -24.9103 -24.9103 -24.9035 -24.9035 -24.9012 -24.9012 -22.4110 -22.4110 -21.4572 -21.4572 -21.4466 -21.4466 -21.4428 -21.4428 -10.9078 -10.9078 -8.9186 -8.9186 -8.8910 -8.8910 -8.8875 -8.8875 -5.3544 -5.3544 -5.3517 -5.3517 -5.2624 -5.2624 -5.2404 -5.2404 -5.2347 -5.2347 -4.4163 -4.4163 -4.3890 -4.3890 -4.3762 -4.3762 -3.0348 -3.0348 -2.9839 -2.9839 -2.9637 -2.9637 -2.6807 -2.6807 -2.6681 -2.6681 -2.6288 -2.6288 -1.5596 -1.5596 -1.5284 -1.5284 -1.5191 -1.5191 0.7832 0.7832 0.8284 0.8284 0.8436 0.8436 4.6387 4.6387 8.5480 8.5480 8.5609 8.5609 8.6081 8.6081 9.4595 9.4595 9.7730 9.7730 k = 0.0357 0.0357-0.0000 ( 6395 PWs) bands (ev): -25.4086 -25.4086 -24.9077 -24.9077 -24.9030 -24.9030 -24.9012 -24.9012 -22.4163 -22.4163 -21.4536 -21.4536 -21.4457 -21.4457 -21.4428 -21.4428 -10.9161 -10.9161 -8.9060 -8.9060 -8.8906 -8.8906 -8.8873 -8.8873 -5.3558 -5.3558 -5.3541 -5.3541 -5.2641 -5.2641 -5.2414 -5.2414 -5.2381 -5.2381 -4.4076 -4.4076 -4.3811 -4.3811 -4.3734 -4.3734 -3.0273 -3.0273 -2.9863 -2.9863 -2.9715 -2.9715 -2.6813 -2.6813 -2.6743 -2.6743 -2.6566 -2.6566 -1.5542 -1.5542 -1.5220 -1.5220 -1.5168 -1.5168 0.7978 0.7978 0.8298 0.8298 0.8416 0.8416 4.6212 4.6212 8.5664 8.5664 8.5769 8.5769 8.6031 8.6031 9.4517 9.4517 9.7594 9.7594 k = 0.0238 0.0238-0.0000 ( 6395 PWs) bands (ev): -25.4100 -25.4100 -24.9062 -24.9062 -24.9022 -24.9022 -24.9012 -24.9012 -22.4201 -22.4201 -21.4517 -21.4517 -21.4444 -21.4444 -21.4428 -21.4428 -10.9221 -10.9221 -8.8974 -8.8974 -8.8898 -8.8898 -8.8871 -8.8871 -5.3567 -5.3567 -5.3560 -5.3560 -5.2654 -5.2654 -5.2420 -5.2420 -5.2405 -5.2405 -4.4020 -4.4020 -4.3748 -4.3748 -4.3712 -4.3712 -3.0237 -3.0237 -2.9852 -2.9852 -2.9770 -2.9770 -2.6818 -2.6818 -2.6793 -2.6793 -2.6773 -2.6773 -1.5505 -1.5505 -1.5173 -1.5173 -1.5150 -1.5150 0.8056 0.8056 0.8335 0.8335 0.8402 0.8402 4.6087 4.6087 8.5789 8.5789 8.5889 8.5889 8.6000 8.6000 9.4460 9.4460 9.7491 9.7491 k = 0.0119 0.0119-0.0000 ( 6401 PWs) bands (ev): -25.4109 -25.4109 -24.9056 -24.9056 -24.9014 -24.9014 -24.9011 -24.9011 -22.4224 -22.4224 -21.4508 -21.4508 -21.4433 -21.4433 -21.4428 -21.4428 -10.9257 -10.9257 -8.8935 -8.8935 -8.8881 -8.8881 -8.8870 -8.8870 -5.3573 -5.3573 -5.3572 -5.3572 -5.2662 -5.2662 -5.2423 -5.2423 -5.2419 -5.2419 -4.3990 -4.3990 -4.3707 -4.3707 -4.3698 -4.3698 -3.0228 -3.0228 -2.9827 -2.9827 -2.9804 -2.9804 -2.6918 -2.6918 -2.6819 -2.6819 -2.6811 -2.6811 -1.5484 -1.5484 -1.5145 -1.5145 -1.5139 -1.5139 0.8086 0.8086 0.8375 0.8375 0.8393 0.8393 4.6012 4.6012 8.5854 8.5854 8.5966 8.5966 8.5991 8.5991 9.4425 9.4425 9.7428 9.7428 k = 0.0000 0.0000 0.0000 ( 6403 PWs) bands (ev): -25.4111 -25.4111 -24.9054 -24.9054 -24.9011 -24.9011 -24.9011 -24.9011 -22.4231 -22.4231 -21.4506 -21.4506 -21.4428 -21.4428 -21.4428 -21.4428 -10.9269 -10.9269 -8.8927 -8.8927 -8.8870 -8.8870 -8.8870 -8.8870 -5.3575 -5.3575 -5.3575 -5.3575 -5.2665 -5.2665 -5.2424 -5.2424 -5.2424 -5.2424 -4.3980 -4.3980 -4.3693 -4.3693 -4.3693 -4.3693 -3.0228 -3.0228 -2.9815 -2.9815 -2.9815 -2.9815 -2.6964 -2.6964 -2.6820 -2.6820 -2.6820 -2.6820 -1.5477 -1.5477 -1.5135 -1.5135 -1.5135 -1.5135 0.8093 0.8093 0.8391 0.8391 0.8391 0.8391 4.5986 4.5986 8.5871 8.5871 8.5992 8.5992 8.5992 8.5992 9.4413 9.4413 9.7406 9.7406 k = 0.0000 0.0000 0.0000 ( 6403 PWs) bands (ev): -25.4111 -25.4111 -24.9054 -24.9054 -24.9011 -24.9011 -24.9011 -24.9011 -22.4231 -22.4231 -21.4506 -21.4506 -21.4428 -21.4428 -21.4428 -21.4428 -10.9269 -10.9269 -8.8927 -8.8927 -8.8870 -8.8870 -8.8870 -8.8870 -5.3575 -5.3575 -5.3575 -5.3575 -5.2665 -5.2665 -5.2424 -5.2424 -5.2424 -5.2424 -4.3980 -4.3980 -4.3693 -4.3693 -4.3693 -4.3693 -3.0228 -3.0228 -2.9815 -2.9815 -2.9815 -2.9815 -2.6964 -2.6964 -2.6820 -2.6820 -2.6820 -2.6820 -1.5477 -1.5477 -1.5135 -1.5135 -1.5135 -1.5135 0.8093 0.8093 0.8391 0.8391 0.8391 0.8391 4.5986 4.5986 8.5871 8.5871 8.5992 8.5992 8.5992 8.5992 9.4413 9.4413 9.7406 9.7406 k = 0.0098 0.0098 0.0098 ( 6403 PWs) bands (ev): -25.4109 -25.4109 -24.9056 -24.9056 -24.9014 -24.9014 -24.9012 -24.9012 -22.4224 -22.4224 -21.4508 -21.4508 -21.4433 -21.4433 -21.4428 -21.4428 -10.9257 -10.9257 -8.8935 -8.8935 -8.8881 -8.8881 -8.8870 -8.8870 -5.3573 -5.3573 -5.3572 -5.3572 -5.2662 -5.2662 -5.2423 -5.2423 -5.2419 -5.2419 -4.3990 -4.3990 -4.3708 -4.3708 -4.3697 -4.3697 -3.0228 -3.0228 -2.9828 -2.9828 -2.9803 -2.9803 -2.6917 -2.6917 -2.6815 -2.6815 -2.6814 -2.6814 -1.5484 -1.5484 -1.5145 -1.5145 -1.5138 -1.5138 0.8086 0.8086 0.8374 0.8374 0.8393 0.8393 4.6012 4.6012 8.5856 8.5856 8.5975 8.5975 8.5979 8.5979 9.4425 9.4425 9.7428 9.7428 k = 0.0196 0.0196 0.0196 ( 6394 PWs) bands (ev): -25.4100 -25.4100 -24.9062 -24.9062 -24.9022 -24.9022 -24.9012 -24.9012 -22.4200 -22.4200 -21.4517 -21.4517 -21.4444 -21.4444 -21.4428 -21.4428 -10.9220 -10.9220 -8.8975 -8.8975 -8.8898 -8.8898 -8.8871 -8.8871 -5.3565 -5.3565 -5.3562 -5.3562 -5.2653 -5.2653 -5.2420 -5.2420 -5.2405 -5.2405 -4.4022 -4.4022 -4.3753 -4.3753 -4.3708 -4.3708 -3.0239 -3.0239 -2.9853 -2.9853 -2.9767 -2.9767 -2.6807 -2.6807 -2.6799 -2.6799 -2.6774 -2.6774 -1.5506 -1.5506 -1.5176 -1.5176 -1.5148 -1.5148 0.8056 0.8056 0.8335 0.8335 0.8401 0.8401 4.6089 4.6089 8.5810 8.5810 8.5924 8.5924 8.5941 8.5941 9.4461 9.4461 9.7493 9.7493 k = 0.0294 0.0294 0.0294 ( 6400 PWs) bands (ev): -25.4085 -25.4085 -24.9077 -24.9077 -24.9030 -24.9030 -24.9012 -24.9012 -22.4162 -22.4162 -21.4537 -21.4537 -21.4457 -21.4457 -21.4428 -21.4428 -10.9160 -10.9160 -8.9063 -8.9063 -8.8906 -8.8906 -8.8872 -8.8872 -5.3553 -5.3553 -5.3546 -5.3546 -5.2640 -5.2640 -5.2414 -5.2414 -5.2380 -5.2380 -4.4079 -4.4079 -4.3826 -4.3826 -4.3720 -4.3720 -3.0282 -3.0282 -2.9859 -2.9859 -2.9710 -2.9710 -2.6781 -2.6781 -2.6773 -2.6773 -2.6561 -2.6561 -1.5544 -1.5544 -1.5228 -1.5228 -1.5162 -1.5162 0.7979 0.7979 0.8296 0.8296 0.8414 0.8414 4.6216 4.6216 8.5731 8.5731 8.5845 8.5845 8.5878 8.5878 9.4518 9.4518 9.7599 9.7599 k = 0.0392 0.0392 0.0392 ( 6397 PWs) bands (ev): -25.4065 -25.4065 -24.9104 -24.9104 -24.9035 -24.9035 -24.9013 -24.9013 -22.4109 -22.4109 -21.4574 -21.4574 -21.4466 -21.4466 -21.4428 -21.4428 -10.9075 -10.9075 -8.9191 -8.9191 -8.8910 -8.8910 -8.8874 -8.8874 -5.3536 -5.3536 -5.3525 -5.3525 -5.2622 -5.2622 -5.2405 -5.2405 -5.2346 -5.2346 -4.4165 -4.4165 -4.3928 -4.3928 -4.3729 -4.3729 -3.0369 -3.0369 -2.9822 -2.9822 -2.9632 -2.9632 -2.6748 -2.6748 -2.6735 -2.6735 -2.6282 -2.6282 -1.5601 -1.5601 -1.5299 -1.5299 -1.5178 -1.5178 0.7834 0.7834 0.8281 0.8281 0.8432 0.8432 4.6394 4.6394 8.5616 8.5616 8.5744 8.5744 8.5791 8.5791 9.4597 9.4597 9.7742 9.7742 k = 0.0490 0.0490 0.0490 ( 6400 PWs) bands (ev): -25.4040 -25.4040 -24.9141 -24.9141 -24.9038 -24.9038 -24.9014 -24.9014 -22.4041 -22.4041 -21.4627 -21.4627 -21.4471 -21.4471 -21.4428 -21.4428 -10.8968 -10.8968 -8.9355 -8.9355 -8.8914 -8.8914 -8.8877 -8.8877 -5.3516 -5.3516 -5.3499 -5.3499 -5.2601 -5.2601 -5.2389 -5.2389 -5.2300 -5.2300 -4.4280 -4.4280 -4.4055 -4.4055 -4.3733 -4.3733 -3.0487 -3.0487 -2.9745 -2.9745 -2.9537 -2.9537 -2.6705 -2.6705 -2.6684 -2.6684 -2.5950 -2.5950 -1.5678 -1.5678 -1.5391 -1.5391 -1.5193 -1.5193 0.7626 0.7626 0.8286 0.8286 0.8455 0.8455 4.6619 4.6619 8.5465 8.5465 8.5625 8.5625 8.5682 8.5682 9.4693 9.4693 9.7918 9.7918 k = 0.0588 0.0588 0.0588 ( 6406 PWs) bands (ev): -25.4009 -25.4009 -24.9188 -24.9188 -24.9040 -24.9040 -24.9014 -24.9014 -22.3959 -22.3959 -21.4695 -21.4695 -21.4474 -21.4474 -21.4428 -21.4428 -10.8838 -10.8838 -8.9553 -8.9553 -8.8917 -8.8917 -8.8880 -8.8880 -5.3495 -5.3495 -5.3471 -5.3471 -5.2580 -5.2580 -5.2364 -5.2364 -5.2243 -5.2243 -4.4421 -4.4421 -4.4206 -4.4206 -4.3732 -4.3732 -3.0619 -3.0619 -2.9642 -2.9642 -2.9427 -2.9427 -2.6649 -2.6649 -2.6619 -2.6619 -2.5577 -2.5577 -1.5776 -1.5776 -1.5501 -1.5501 -1.5207 -1.5207 0.7366 0.7366 0.8303 0.8303 0.8482 0.8482 4.6892 4.6892 8.5283 8.5283 8.5491 8.5491 8.5553 8.5553 9.4804 9.4804 9.8120 9.8120 k = 0.0686 0.0686 0.0686 ( 6418 PWs) bands (ev): -25.3973 -25.3973 -24.9242 -24.9242 -24.9042 -24.9042 -24.9015 -24.9015 -22.3865 -22.3865 -21.4776 -21.4776 -21.4476 -21.4476 -21.4428 -21.4428 -10.8686 -10.8686 -8.9783 -8.9783 -8.8922 -8.8922 -8.8884 -8.8884 -5.3472 -5.3472 -5.3442 -5.3442 -5.2564 -5.2564 -5.2324 -5.2324 -5.2173 -5.2173 -4.4587 -4.4587 -4.4379 -4.4379 -4.3728 -4.3728 -3.0754 -3.0754 -2.9521 -2.9521 -2.9308 -2.9308 -2.6581 -2.6581 -2.6539 -2.6539 -2.5170 -2.5170 -1.5894 -1.5894 -1.5630 -1.5630 -1.5219 -1.5219 0.7061 0.7061 0.8329 0.8329 0.8512 0.8512 4.7210 4.7210 8.5074 8.5074 8.5340 8.5340 8.5404 8.5404 9.4926 9.4926 9.8344 9.8344 k = 0.0784 0.0784 0.0784 ( 6400 PWs) bands (ev): -25.3931 -25.3931 -24.9304 -24.9304 -24.9043 -24.9043 -24.9016 -24.9016 -22.3757 -22.3757 -21.4869 -21.4869 -21.4476 -21.4476 -21.4427 -21.4427 -10.8514 -10.8514 -9.0041 -9.0041 -8.8926 -8.8926 -8.8887 -8.8887 -5.3448 -5.3448 -5.3414 -5.3414 -5.2555 -5.2555 -5.2266 -5.2266 -5.2090 -5.2090 -4.4774 -4.4774 -4.4571 -4.4571 -4.3720 -4.3720 -3.0886 -3.0886 -2.9388 -2.9388 -2.9181 -2.9181 -2.6498 -2.6498 -2.6442 -2.6442 -2.4734 -2.4734 -1.6032 -1.6032 -1.5777 -1.5777 -1.5230 -1.5230 0.6715 0.6715 0.8359 0.8359 0.8546 0.8546 4.7571 4.7571 8.4844 8.4844 8.5175 8.5175 8.5240 8.5240 9.5052 9.5052 9.8584 9.8584 k = 0.0882 0.0882 0.0882 ( 6385 PWs) bands (ev): -25.3885 -25.3885 -24.9372 -24.9372 -24.9045 -24.9045 -24.9017 -24.9017 -22.3639 -22.3639 -21.4972 -21.4972 -21.4477 -21.4477 -21.4427 -21.4427 -10.8321 -10.8321 -9.0325 -9.0325 -8.8930 -8.8930 -8.8892 -8.8892 -5.3426 -5.3426 -5.3387 -5.3387 -5.2554 -5.2554 -5.2188 -5.2188 -5.1994 -5.1994 -4.4978 -4.4978 -4.4781 -4.4781 -4.3710 -4.3710 -3.1012 -3.1012 -2.9249 -2.9249 -2.9053 -2.9053 -2.6398 -2.6398 -2.6325 -2.6325 -2.4274 -2.4274 -1.6187 -1.6187 -1.5940 -1.5940 -1.5239 -1.5239 0.6335 0.6335 0.8394 0.8394 0.8583 0.8583 4.7974 4.7974 8.4596 8.4596 8.4996 8.4996 8.5061 8.5061 9.5175 9.5175 9.8833 9.8833 k = 0.0980 0.0980 0.0980 ( 6382 PWs) bands (ev): -25.3834 -25.3834 -24.9446 -24.9446 -24.9046 -24.9046 -24.9019 -24.9019 -22.3510 -22.3510 -21.5085 -21.5085 -21.4477 -21.4477 -21.4427 -21.4427 -10.8111 -10.8111 -9.0632 -9.0632 -8.8935 -8.8935 -8.8896 -8.8896 -5.3406 -5.3406 -5.3363 -5.3363 -5.2561 -5.2561 -5.2092 -5.2092 -5.1883 -5.1883 -4.5197 -4.5197 -4.5005 -4.5005 -4.3698 -4.3698 -3.1128 -3.1128 -2.9108 -2.9108 -2.8926 -2.8926 -2.6281 -2.6281 -2.6188 -2.6188 -2.3795 -2.3795 -1.6360 -1.6360 -1.6120 -1.6120 -1.5248 -1.5248 0.5924 0.5924 0.8431 0.8431 0.8622 0.8622 4.8417 4.8417 8.4335 8.4335 8.4806 8.4806 8.4870 8.4870 9.5285 9.5285 9.9088 9.9088 k = 0.1078 0.1078 0.1078 ( 6382 PWs) bands (ev): -25.3779 -25.3779 -24.9526 -24.9526 -24.9048 -24.9048 -24.9020 -24.9020 -22.3372 -22.3372 -21.5207 -21.5207 -21.4477 -21.4477 -21.4427 -21.4427 -10.7884 -10.7884 -9.0959 -9.0959 -8.8940 -8.8940 -8.8901 -8.8901 -5.3388 -5.3388 -5.3344 -5.3344 -5.2574 -5.2574 -5.1978 -5.1978 -5.1759 -5.1759 -4.5428 -4.5428 -4.5241 -4.5241 -4.3684 -4.3684 -3.1235 -3.1235 -2.8971 -2.8971 -2.8804 -2.8804 -2.6144 -2.6144 -2.6031 -2.6031 -2.3301 -2.3301 -1.6547 -1.6547 -1.6314 -1.6314 -1.5256 -1.5256 0.5489 0.5489 0.8470 0.8470 0.8662 0.8662 4.8897 4.8897 8.4064 8.4064 8.4606 8.4606 8.4669 8.4669 9.5373 9.5373 9.9346 9.9346 k = 0.1176 0.1176 0.1176 ( 6382 PWs) bands (ev): -25.3720 -25.3720 -24.9609 -24.9609 -24.9050 -24.9050 -24.9022 -24.9022 -22.3227 -22.3227 -21.5336 -21.5336 -21.4477 -21.4477 -21.4427 -21.4427 -10.7642 -10.7642 -9.1303 -9.1303 -8.8945 -8.8945 -8.8906 -8.8906 -5.3373 -5.3373 -5.3329 -5.3329 -5.2593 -5.2593 -5.1848 -5.1848 -5.1620 -5.1620 -4.5670 -4.5670 -4.5486 -4.5486 -4.3668 -4.3668 -3.1332 -3.1332 -2.8839 -2.8839 -2.8690 -2.8690 -2.5988 -2.5988 -2.5852 -2.5852 -2.2797 -2.2797 -1.6749 -1.6749 -1.6521 -1.6521 -1.5264 -1.5264 0.5034 0.5034 0.8511 0.8511 0.8703 0.8703 4.9413 4.9413 8.3785 8.3785 8.4400 8.4400 8.4461 8.4461 9.5427 9.5427 9.9606 9.9606 k = 0.1275 0.1275 0.1275 ( 6385 PWs) bands (ev): -25.3658 -25.3658 -24.9696 -24.9696 -24.9052 -24.9052 -24.9024 -24.9024 -22.3076 -22.3076 -21.5472 -21.5472 -21.4477 -21.4477 -21.4426 -21.4426 -10.7388 -10.7388 -9.1660 -9.1660 -8.8950 -8.8950 -8.8911 -8.8911 -5.3362 -5.3362 -5.3319 -5.3319 -5.2619 -5.2619 -5.1703 -5.1703 -5.1468 -5.1468 -4.5918 -4.5918 -4.5740 -4.5740 -4.3651 -4.3651 -3.1419 -3.1419 -2.8716 -2.8716 -2.8585 -2.8585 -2.5812 -2.5812 -2.5653 -2.5653 -2.2286 -2.2286 -1.6962 -1.6962 -1.6741 -1.6741 -1.5272 -1.5272 0.4565 0.4565 0.8552 0.8552 0.8744 0.8744 4.9962 4.9962 8.3501 8.3501 8.4188 8.4188 8.4247 8.4247 9.5434 9.5434 9.9873 9.9873 k = 0.1373 0.1373 0.1373 ( 6376 PWs) bands (ev): -25.3593 -25.3593 -24.9785 -24.9785 -24.9054 -24.9054 -24.9025 -24.9025 -22.2920 -22.2920 -21.5612 -21.5612 -21.4477 -21.4477 -21.4426 -21.4426 -10.7124 -10.7124 -9.2025 -9.2025 -8.8954 -8.8954 -8.8915 -8.8915 -5.3355 -5.3355 -5.3314 -5.3314 -5.2650 -5.2650 -5.1543 -5.1543 -5.1303 -5.1303 -4.6171 -4.6171 -4.5998 -4.5998 -4.3632 -4.3632 -3.1495 -3.1495 -2.8604 -2.8604 -2.8490 -2.8490 -2.5618 -2.5618 -2.5435 -2.5435 -2.1774 -2.1774 -1.7186 -1.7186 -1.6971 -1.6971 -1.5279 -1.5279 0.4087 0.4087 0.8592 0.8592 0.8785 0.8785 5.0543 5.0543 8.3213 8.3213 8.3973 8.3973 8.4031 8.4031 9.5385 9.5385 10.0151 10.0151 k = 0.1471 0.1471 0.1471 ( 6394 PWs) bands (ev): -25.3526 -25.3526 -24.9875 -24.9875 -24.9056 -24.9056 -24.9028 -24.9028 -22.2762 -22.2762 -21.5755 -21.5755 -21.4477 -21.4477 -21.4426 -21.4426 -10.6854 -10.6854 -9.2394 -9.2394 -8.8959 -8.8959 -8.8920 -8.8920 -5.3353 -5.3353 -5.3315 -5.3315 -5.2688 -5.2688 -5.1370 -5.1370 -5.1126 -5.1126 -4.6426 -4.6426 -4.6259 -4.6259 -4.3612 -4.3612 -3.1561 -3.1561 -2.8502 -2.8502 -2.8404 -2.8404 -2.5407 -2.5407 -2.5201 -2.5201 -2.1266 -2.1266 -1.7419 -1.7419 -1.7211 -1.7211 -1.5287 -1.5287 0.3608 0.3608 0.8632 0.8632 0.8825 0.8825 5.1153 5.1153 8.2924 8.2924 8.3756 8.3756 8.3812 8.3812 9.5272 9.5272 10.0445 10.0445 k = 0.1569 0.1569 0.1569 ( 6394 PWs) bands (ev): -25.3457 -25.3457 -24.9966 -24.9966 -24.9058 -24.9058 -24.9030 -24.9030 -22.2603 -22.2603 -21.5900 -21.5900 -21.4477 -21.4477 -21.4426 -21.4426 -10.6580 -10.6580 -9.2762 -9.2762 -8.8964 -8.8964 -8.8924 -8.8924 -5.3355 -5.3355 -5.3323 -5.3323 -5.2731 -5.2731 -5.1185 -5.1185 -5.0937 -5.0937 -4.6681 -4.6681 -4.6521 -4.6521 -4.3591 -4.3591 -3.1616 -3.1616 -2.8411 -2.8411 -2.8328 -2.8328 -2.5182 -2.5182 -2.4954 -2.4954 -2.0768 -2.0768 -1.7657 -1.7657 -1.7457 -1.7457 -1.5295 -1.5295 0.3134 0.3134 0.8670 0.8670 0.8863 0.8863 5.1792 5.1792 8.2635 8.2635 8.3540 8.3540 8.3594 8.3594 9.5091 9.5091 10.0762 10.0762 k = 0.1667 0.1667 0.1667 ( 6394 PWs) bands (ev): -25.3388 -25.3388 -25.0055 -25.0055 -24.9060 -24.9060 -24.9032 -24.9032 -22.2447 -22.2447 -21.6043 -21.6043 -21.4477 -21.4477 -21.4426 -21.4426 -10.6306 -10.6306 -9.3123 -9.3123 -8.8968 -8.8968 -8.8928 -8.8928 -5.3362 -5.3362 -5.3336 -5.3336 -5.2781 -5.2781 -5.0989 -5.0989 -5.0737 -5.0737 -4.6933 -4.6933 -4.6780 -4.6780 -4.3569 -4.3569 -3.1663 -3.1663 -2.8330 -2.8330 -2.8261 -2.8261 -2.4948 -2.4948 -2.4698 -2.4698 -2.0286 -2.0286 -1.7900 -1.7900 -1.7707 -1.7707 -1.5302 -1.5302 0.2674 0.2674 0.8706 0.8706 0.8899 0.8899 5.2457 5.2457 8.2347 8.2347 8.3327 8.3327 8.3379 8.3379 9.4844 9.4844 10.1104 10.1104 k = 0.1765 0.1765 0.1765 ( 6388 PWs) bands (ev): -25.3319 -25.3319 -25.0142 -25.0142 -24.9062 -24.9062 -24.9034 -24.9034 -22.2296 -22.2296 -21.6182 -21.6182 -21.4477 -21.4477 -21.4425 -21.4425 -10.6038 -10.6038 -9.3473 -9.3473 -8.8972 -8.8972 -8.8932 -8.8932 -5.3374 -5.3374 -5.3356 -5.3356 -5.2837 -5.2837 -5.0785 -5.0785 -5.0528 -5.0528 -4.7180 -4.7180 -4.7036 -4.7036 -4.3546 -4.3546 -3.1699 -3.1699 -2.8259 -2.8259 -2.8202 -2.8202 -2.4708 -2.4708 -2.4438 -2.4438 -1.9828 -1.9828 -1.8143 -1.8143 -1.7959 -1.7959 -1.5310 -1.5310 0.2234 0.2234 0.8740 0.8740 0.8933 0.8933 5.3148 5.3148 8.2061 8.2061 8.3117 8.3117 8.3166 8.3166 9.4535 9.4535 10.1473 10.1473 k = 0.1863 0.1863 0.1863 ( 6403 PWs) bands (ev): -25.3252 -25.3252 -25.0225 -25.0225 -24.9064 -24.9064 -24.9036 -24.9036 -22.2152 -22.2152 -21.6315 -21.6315 -21.4477 -21.4477 -21.4425 -21.4425 -10.5781 -10.5781 -9.3804 -9.3804 -8.8975 -8.8975 -8.8935 -8.8935 -5.3393 -5.3393 -5.3383 -5.3383 -5.2899 -5.2899 -5.0573 -5.0573 -5.0312 -5.0312 -4.7419 -4.7419 -4.7285 -4.7285 -4.3523 -4.3523 -3.1727 -3.1727 -2.8197 -2.8197 -2.8149 -2.8149 -2.4468 -2.4468 -2.4178 -2.4178 -1.9401 -1.9401 -1.8383 -1.8383 -1.8209 -1.8209 -1.5318 -1.5318 0.1823 0.1823 0.8770 0.8770 0.8963 0.8963 5.3861 5.3861 8.1778 8.1778 8.2912 8.2912 8.2959 8.2959 9.4170 9.4170 10.1867 10.1867 k = 0.1961 0.1961 0.1961 ( 6391 PWs) bands (ev): -25.3189 -25.3189 -25.0302 -25.0302 -24.9067 -24.9067 -24.9038 -24.9038 -22.2020 -22.2020 -21.6438 -21.6438 -21.4477 -21.4477 -21.4425 -21.4425 -10.5541 -10.5541 -9.4108 -9.4108 -8.8978 -8.8978 -8.8938 -8.8938 -5.3418 -5.3418 -5.3418 -5.3418 -5.2966 -5.2966 -5.0357 -5.0357 -5.0090 -5.0090 -4.7646 -4.7646 -4.7524 -4.7524 -4.3498 -4.3498 -3.1746 -3.1746 -2.8141 -2.8141 -2.8103 -2.8103 -2.4233 -2.4233 -2.3923 -2.3923 -1.9014 -1.9014 -1.8616 -1.8616 -1.8453 -1.8453 -1.5326 -1.5326 0.1451 0.1451 0.8796 0.8796 0.8989 0.8989 5.4597 5.4597 8.1498 8.1498 8.2713 8.2713 8.2759 8.2759 9.3756 9.3756 10.2286 10.2286 k = 0.2059 0.2059 0.2059 ( 6400 PWs) bands (ev): -25.3129 -25.3129 -25.0372 -25.0372 -24.9069 -24.9069 -24.9041 -24.9041 -22.1903 -22.1903 -21.6548 -21.6548 -21.4476 -21.4476 -21.4425 -21.4425 -10.5324 -10.5324 -9.4380 -9.4380 -8.8980 -8.8980 -8.8940 -8.8940 -5.3461 -5.3461 -5.3450 -5.3450 -5.3040 -5.3040 -5.0142 -5.0142 -4.9866 -4.9866 -4.7855 -4.7855 -4.7748 -4.7748 -4.3473 -4.3473 -3.1757 -3.1757 -2.8092 -2.8092 -2.8061 -2.8061 -2.4011 -2.4011 -2.3682 -2.3682 -1.8835 -1.8835 -1.8684 -1.8684 -1.8675 -1.8675 -1.5334 -1.5334 0.1125 0.1125 0.8819 0.8819 0.9012 0.9012 5.5354 5.5354 8.1223 8.1223 8.2523 8.2523 8.2566 8.2566 9.3302 9.3302 10.2727 10.2727 k = 0.2157 0.2157 0.2157 ( 6388 PWs) bands (ev): -25.3076 -25.3076 -25.0433 -25.0433 -24.9071 -24.9071 -24.9043 -24.9043 -22.1805 -22.1805 -21.6641 -21.6641 -21.4476 -21.4476 -21.4424 -21.4424 -10.5138 -10.5138 -9.4610 -9.4610 -8.8981 -8.8981 -8.8941 -8.8941 -5.3513 -5.3513 -5.3490 -5.3490 -5.3119 -5.3119 -4.9932 -4.9932 -4.9646 -4.9646 -4.8039 -4.8039 -4.7950 -4.7950 -4.3447 -4.3447 -3.1759 -3.1759 -2.8049 -2.8049 -2.8024 -2.8024 -2.3810 -2.3810 -2.3462 -2.3462 -1.9033 -1.9033 -1.8895 -1.8895 -1.8393 -1.8393 -1.5342 -1.5342 0.0856 0.0856 0.8837 0.8837 0.9030 0.9030 5.6129 5.6129 8.0953 8.0953 8.2341 8.2341 8.2383 8.2383 9.2815 9.2815 10.3183 10.3183 k = 0.2255 0.2255 0.2255 ( 6388 PWs) bands (ev): -25.3030 -25.3030 -25.0483 -25.0483 -24.9074 -24.9074 -24.9046 -24.9046 -22.1728 -22.1728 -21.6714 -21.6714 -21.4476 -21.4476 -21.4424 -21.4424 -10.4990 -10.4990 -9.4792 -9.4792 -8.8982 -8.8982 -8.8942 -8.8942 -5.3573 -5.3573 -5.3537 -5.3537 -5.3204 -5.3204 -4.9742 -4.9742 -4.9445 -4.9445 -4.8186 -4.8186 -4.8115 -4.8115 -4.3421 -4.3421 -3.1754 -3.1754 -2.8011 -2.8011 -2.7991 -2.7991 -2.3639 -2.3639 -2.3273 -2.3273 -1.9202 -1.9202 -1.9076 -1.9076 -1.8175 -1.8175 -1.5350 -1.5350 0.0650 0.0650 0.8851 0.8851 0.9043 0.9043 5.6923 5.6923 8.0687 8.0687 8.2169 8.2169 8.2209 8.2209 9.2301 9.2301 10.3203 10.3203 k = 0.2353 0.2353 0.2353 ( 6385 PWs) bands (ev): -25.2994 -25.2994 -25.0520 -25.0520 -24.9076 -24.9076 -24.9048 -24.9048 -22.1677 -22.1677 -21.6764 -21.6764 -21.4476 -21.4476 -21.4424 -21.4424 -10.4885 -10.4885 -9.4918 -9.4918 -8.8982 -8.8982 -8.8942 -8.8942 -5.3643 -5.3643 -5.3593 -5.3593 -5.3295 -5.3295 -4.9590 -4.9590 -4.9288 -4.9288 -4.8274 -4.8274 -4.8218 -4.8218 -4.3395 -4.3395 -3.1741 -3.1741 -2.7977 -2.7977 -2.7961 -2.7961 -2.3510 -2.3510 -2.3128 -2.3128 -1.9331 -1.9331 -1.9217 -1.9217 -1.8028 -1.8028 -1.5358 -1.5358 0.0515 0.0515 0.8860 0.8860 0.9052 0.9052 5.7733 5.7733 8.0425 8.0425 8.2008 8.2008 8.2046 8.2046 9.1766 9.1766 10.2767 10.2767 k = 0.2451 0.2451 0.2451 ( 6382 PWs) bands (ev): -25.2969 -25.2969 -25.0543 -25.0543 -24.9079 -24.9079 -24.9050 -24.9050 -22.1653 -22.1653 -21.6789 -21.6789 -21.4476 -21.4476 -21.4424 -21.4424 -10.4829 -10.4829 -9.4983 -9.4983 -8.8982 -8.8982 -8.8941 -8.8941 -5.3722 -5.3722 -5.3658 -5.3658 -5.3391 -5.3391 -4.9504 -4.9504 -4.9216 -4.9216 -4.8278 -4.8278 -4.8217 -4.8217 -4.3369 -4.3369 -3.1721 -3.1721 -2.7947 -2.7947 -2.7935 -2.7935 -2.3432 -2.3432 -2.3039 -2.3039 -1.9411 -1.9411 -1.9305 -1.9305 -1.7956 -1.7956 -1.5367 -1.5367 0.0455 0.0455 0.8863 0.8863 0.9056 0.9056 5.8559 5.8559 8.0169 8.0169 8.1859 8.1859 8.1894 8.1894 9.1217 9.1217 10.2289 10.2289 k = 0.2549 0.2549 0.2549 ( 6388 PWs) bands (ev): -25.2955 -25.2955 -25.0551 -25.0551 -24.9081 -24.9081 -24.9053 -24.9053 -22.1658 -22.1658 -21.6786 -21.6786 -21.4475 -21.4475 -21.4424 -21.4424 -10.4825 -10.4825 -9.4985 -9.4985 -8.8980 -8.8980 -8.8940 -8.8940 -5.3810 -5.3810 -5.3732 -5.3732 -5.3494 -5.3494 -4.9494 -4.9494 -4.9241 -4.9241 -4.8185 -4.8185 -4.8099 -4.8099 -4.3342 -4.3342 -3.1694 -3.1694 -2.7921 -2.7921 -2.7911 -2.7911 -2.3413 -2.3413 -2.3014 -2.3014 -1.9435 -1.9435 -1.9331 -1.9331 -1.7962 -1.7962 -1.5375 -1.5375 0.0471 0.0471 0.8862 0.8862 0.9054 0.9054 5.9398 5.9398 7.9917 7.9917 8.1722 8.1722 8.1756 8.1756 9.0659 9.0659 10.1776 10.1776 k = 0.2647 0.2647 0.2647 ( 6388 PWs) bands (ev): -25.2954 -25.2954 -25.0544 -25.0544 -24.9084 -24.9084 -24.9055 -24.9055 -22.1691 -22.1691 -21.6758 -21.6758 -21.4475 -21.4475 -21.4423 -21.4423 -10.4872 -10.4872 -9.4924 -9.4924 -8.8978 -8.8978 -8.8938 -8.8938 -5.3906 -5.3906 -5.3815 -5.3815 -5.3601 -5.3601 -4.9543 -4.9543 -4.9329 -4.9329 -4.8015 -4.8015 -4.7900 -4.7900 -4.3315 -4.3315 -3.1660 -3.1660 -2.7898 -2.7898 -2.7890 -2.7890 -2.3455 -2.3455 -2.3058 -2.3058 -1.9400 -1.9400 -1.9293 -1.9293 -1.8045 -1.8045 -1.5383 -1.5383 0.0565 0.0565 0.8856 0.8856 0.9048 0.9048 6.0250 6.0250 7.9671 7.9671 8.1598 8.1598 8.1630 8.1630 9.0097 9.0097 10.1231 10.1231 k = 0.2745 0.2745 0.2745 ( 6388 PWs) bands (ev): -25.2964 -25.2964 -25.0521 -25.0521 -24.9086 -24.9086 -24.9058 -24.9058 -22.1751 -22.1751 -21.6704 -21.6704 -21.4475 -21.4475 -21.4423 -21.4423 -10.4969 -10.4969 -9.4802 -9.4802 -8.8976 -8.8976 -8.8936 -8.8936 -5.4010 -5.4010 -5.3906 -5.3906 -5.3715 -5.3715 -4.9622 -4.9622 -4.9441 -4.9441 -4.7795 -4.7795 -4.7659 -4.7659 -4.3289 -4.3289 -3.1618 -3.1618 -2.7878 -2.7878 -2.7871 -2.7871 -2.3555 -2.3555 -2.3165 -2.3165 -1.9311 -1.9311 -1.9196 -1.9196 -1.8202 -1.8202 -1.5391 -1.5391 0.0731 0.0731 0.8845 0.8845 0.9037 0.9037 6.1113 6.1113 7.9429 7.9429 8.1488 8.1488 8.1519 8.1519 8.9535 8.9535 10.0661 10.0661 k = 0.2843 0.2843 0.2843 ( 6376 PWs) bands (ev): -25.2986 -25.2986 -25.0484 -25.0484 -24.9088 -24.9088 -24.9060 -24.9060 -22.1836 -22.1836 -21.6628 -21.6628 -21.4475 -21.4475 -21.4423 -21.4423 -10.5110 -10.5110 -9.4623 -9.4623 -8.8973 -8.8973 -8.8932 -8.8932 -5.4121 -5.4121 -5.4006 -5.4006 -5.3833 -5.3833 -4.9713 -4.9713 -4.9557 -4.9557 -4.7546 -4.7546 -4.7394 -4.7394 -4.3263 -4.3263 -3.1570 -3.1570 -2.7862 -2.7862 -2.7855 -2.7855 -2.3704 -2.3704 -2.3325 -2.3325 -1.9175 -1.9175 -1.9049 -1.9049 -1.8427 -1.8427 -1.5398 -1.5398 0.0965 0.0965 0.8829 0.8829 0.9021 0.9021 6.1985 6.1985 7.9192 7.9192 8.1392 8.1392 8.1421 8.1421 8.8979 8.8979 10.0069 10.0069 k = 0.2941 0.2941 0.2941 ( 6373 PWs) bands (ev): -25.3017 -25.3017 -25.0434 -25.0434 -24.9091 -24.9091 -24.9062 -24.9062 -22.1942 -22.1942 -21.6532 -21.6532 -21.4474 -21.4474 -21.4423 -21.4423 -10.5289 -10.5289 -9.4395 -9.4395 -8.8969 -8.8969 -8.8928 -8.8928 -5.4238 -5.4238 -5.4113 -5.4113 -5.3956 -5.3956 -4.9803 -4.9803 -4.9669 -4.9669 -4.7280 -4.7280 -4.7118 -4.7118 -4.3237 -4.3237 -3.1514 -3.1514 -2.7848 -2.7848 -2.7841 -2.7841 -2.3893 -2.3893 -2.3526 -2.3526 -1.9002 -1.9002 -1.8864 -1.8864 -1.8714 -1.8714 -1.5406 -1.5406 0.1259 0.1259 0.8808 0.8808 0.9000 0.9000 6.2865 6.2865 7.8960 7.8960 8.1311 8.1311 8.1338 8.1338 8.8431 8.8431 9.9462 9.9462 k = 0.3039 0.3039 0.3039 ( 6382 PWs) bands (ev): -25.3057 -25.3057 -25.0373 -25.0373 -24.9093 -24.9093 -24.9065 -24.9065 -22.2066 -22.2066 -21.6420 -21.6420 -21.4474 -21.4474 -21.4423 -21.4423 -10.5499 -10.5499 -9.4125 -9.4125 -8.8964 -8.8964 -8.8924 -8.8924 -5.4360 -5.4360 -5.4227 -5.4227 -5.4083 -5.4083 -4.9889 -4.9889 -4.9773 -4.9773 -4.7005 -4.7005 -4.6834 -4.6834 -4.3211 -4.3211 -3.1452 -3.1452 -2.7838 -2.7838 -2.7829 -2.7829 -2.4112 -2.4112 -2.3758 -2.3758 -1.9054 -1.9054 -1.8803 -1.8803 -1.8652 -1.8652 -1.5413 -1.5413 0.1604 0.1604 0.8783 0.8783 0.8975 0.8975 6.3749 6.3749 7.8735 7.8735 8.1245 8.1245 8.1271 8.1271 8.7896 8.7896 9.8843 9.8843 k = 0.3137 0.3137 0.3137 ( 6370 PWs) bands (ev): -25.3103 -25.3103 -25.0302 -25.0302 -24.9095 -24.9095 -24.9067 -24.9067 -22.2205 -22.2205 -21.6296 -21.6296 -21.4474 -21.4474 -21.4423 -21.4423 -10.5734 -10.5734 -9.3820 -9.3820 -8.8959 -8.8959 -8.8919 -8.8919 -5.4487 -5.4487 -5.4346 -5.4346 -5.4213 -5.4213 -4.9967 -4.9967 -4.9867 -4.9867 -4.6724 -4.6724 -4.6547 -4.6547 -4.3186 -4.3186 -3.1382 -3.1382 -2.7830 -2.7830 -2.7820 -2.7820 -2.4350 -2.4350 -2.4011 -2.4011 -1.9439 -1.9439 -1.8586 -1.8586 -1.8423 -1.8423 -1.5420 -1.5420 0.1991 0.1991 0.8754 0.8754 0.8946 0.8946 6.4636 6.4636 7.8516 7.8516 8.1194 8.1194 8.1218 8.1218 8.7378 8.7378 9.8217 9.8217 k = 0.3235 0.3235 0.3235 ( 6370 PWs) bands (ev): -25.3154 -25.3154 -25.0224 -25.0224 -24.9097 -24.9097 -24.9069 -24.9069 -22.2354 -22.2354 -21.6162 -21.6162 -21.4474 -21.4474 -21.4422 -21.4422 -10.5986 -10.5986 -9.3489 -9.3489 -8.8954 -8.8954 -8.8914 -8.8914 -5.4616 -5.4616 -5.4469 -5.4469 -5.4345 -5.4345 -5.0038 -5.0038 -4.9951 -4.9951 -4.6440 -4.6440 -4.6258 -4.6258 -4.3161 -4.3161 -3.1305 -3.1305 -2.7827 -2.7827 -2.7814 -2.7814 -2.4602 -2.4602 -2.4276 -2.4276 -1.9862 -1.9862 -1.8358 -1.8358 -1.8184 -1.8184 -1.5427 -1.5427 0.2411 0.2411 0.8721 0.8721 0.8913 0.8913 6.5522 6.5522 7.8307 7.8307 8.1158 8.1158 8.1181 8.1181 8.6881 8.6881 9.7589 9.7589 k = 0.3333 0.3333 0.3333 ( 6364 PWs) bands (ev): -25.3209 -25.3209 -25.0141 -25.0141 -24.9099 -24.9099 -24.9071 -24.9071 -22.2510 -22.2510 -21.6023 -21.6023 -21.4474 -21.4474 -21.4422 -21.4422 -10.6249 -10.6249 -9.3139 -9.3139 -8.8948 -8.8948 -8.8908 -8.8908 -5.4747 -5.4747 -5.4594 -5.4594 -5.4478 -5.4478 -5.0099 -5.0099 -5.0025 -5.0025 -4.6155 -4.6155 -4.5970 -4.5970 -4.3137 -4.3137 -3.1220 -3.1220 -2.7828 -2.7828 -2.7811 -2.7811 -2.4861 -2.4861 -2.4549 -2.4549 -2.0313 -2.0313 -1.8124 -1.8124 -1.7940 -1.7940 -1.5433 -1.5433 0.2855 0.2855 0.8686 0.8686 0.8878 0.8878 6.6403 6.6403 7.8109 7.8109 8.1138 8.1138 8.1159 8.1159 8.6406 8.6406 9.6962 9.6962 k = 0.3431 0.3431 0.3431 ( 6370 PWs) bands (ev): -25.3266 -25.3266 -25.0054 -25.0054 -24.9102 -24.9102 -24.9073 -24.9073 -22.2671 -22.2671 -21.5880 -21.5880 -21.4473 -21.4473 -21.4422 -21.4422 -10.6519 -10.6519 -9.2775 -9.2775 -8.8941 -8.8941 -8.8902 -8.8902 -5.4879 -5.4879 -5.4721 -5.4721 -5.4612 -5.4612 -5.0154 -5.0154 -5.0090 -5.0090 -4.5873 -4.5873 -4.5684 -4.5684 -4.3114 -4.3114 -3.1127 -3.1127 -2.7834 -2.7834 -2.7812 -2.7812 -2.5122 -2.5122 -2.4823 -2.4823 -2.0786 -2.0786 -1.7889 -1.7889 -1.7696 -1.7696 -1.5439 -1.5439 0.3316 0.3316 0.8647 0.8647 0.8839 0.8839 6.7273 6.7273 7.7928 7.7928 8.1132 8.1132 8.1152 8.1152 8.5957 8.5957 9.6341 9.6341 k = 0.3529 0.3529 0.3529 ( 6379 PWs) bands (ev): -25.3324 -25.3324 -24.9965 -24.9965 -24.9104 -24.9104 -24.9075 -24.9075 -22.2833 -22.2833 -21.5736 -21.5736 -21.4473 -21.4473 -21.4422 -21.4422 -10.6790 -10.6790 -9.2405 -9.2405 -8.8935 -8.8935 -8.8895 -8.8895 -5.5009 -5.5009 -5.4847 -5.4847 -5.4745 -5.4745 -5.0200 -5.0200 -5.0146 -5.0146 -4.5594 -4.5594 -4.5402 -4.5402 -4.3091 -4.3091 -3.1026 -3.1026 -2.7846 -2.7846 -2.7816 -2.7816 -2.5379 -2.5379 -2.5096 -2.5096 -2.1274 -2.1274 -1.7656 -1.7656 -1.7455 -1.7455 -1.5445 -1.5445 0.3785 0.3785 0.8607 0.8607 0.8798 0.8798 6.8125 6.8125 7.7770 7.7770 8.1142 8.1142 8.1160 8.1160 8.5536 8.5536 9.5729 9.5729 k = 0.3627 0.3627 0.3627 ( 6386 PWs) bands (ev): -25.3381 -25.3381 -24.9876 -24.9876 -24.9105 -24.9105 -24.9077 -24.9077 -22.2995 -22.2995 -21.5594 -21.5594 -21.4473 -21.4473 -21.4422 -21.4422 -10.7057 -10.7057 -9.2033 -9.2033 -8.8929 -8.8929 -8.8889 -8.8889 -5.5138 -5.5138 -5.4972 -5.4972 -5.4876 -5.4876 -5.0240 -5.0240 -5.0195 -5.0195 -4.5320 -4.5320 -4.5126 -4.5126 -4.3070 -4.3070 -3.0916 -3.0916 -2.7865 -2.7865 -2.7825 -2.7825 -2.5628 -2.5628 -2.5362 -2.5362 -2.1771 -2.1771 -1.7428 -1.7428 -1.7220 -1.7220 -1.5450 -1.5450 0.4255 0.4255 0.8564 0.8564 0.8756 0.8756 6.8950 6.8950 7.7645 7.7645 8.1165 8.1165 8.1183 8.1183 8.5145 8.5145 9.5130 9.5130 k = 0.3725 0.3725 0.3725 ( 6380 PWs) bands (ev): -25.3438 -25.3438 -24.9787 -24.9787 -24.9107 -24.9107 -24.9079 -24.9079 -22.3154 -22.3154 -21.5454 -21.5454 -21.4473 -21.4473 -21.4422 -21.4422 -10.7318 -10.7318 -9.1664 -9.1664 -8.8922 -8.8922 -8.8882 -8.8882 -5.5264 -5.5264 -5.5093 -5.5093 -5.5004 -5.5004 -5.0274 -5.0274 -5.0236 -5.0236 -4.5053 -4.5053 -4.4856 -4.4856 -4.3049 -4.3049 -3.0798 -3.0798 -2.7892 -2.7892 -2.7840 -2.7840 -2.5865 -2.5865 -2.5618 -2.5618 -2.2272 -2.2272 -1.7208 -1.7208 -1.6992 -1.6992 -1.5454 -1.5454 0.4720 0.4720 0.8522 0.8522 0.8713 0.8713 6.9733 6.9733 7.7565 7.7565 8.1203 8.1203 8.1219 8.1219 8.4786 8.4786 9.4547 9.4547 k = 0.3824 0.3824 0.3824 ( 6380 PWs) bands (ev): -25.3492 -25.3492 -24.9699 -24.9699 -24.9109 -24.9109 -24.9081 -24.9081 -22.3308 -22.3308 -21.5320 -21.5320 -21.4473 -21.4473 -21.4422 -21.4422 -10.7570 -10.7570 -9.1303 -9.1303 -8.8915 -8.8915 -8.8876 -8.8876 -5.5385 -5.5385 -5.5210 -5.5210 -5.5128 -5.5128 -5.0303 -5.0303 -5.0271 -5.0271 -4.4795 -4.4795 -4.4596 -4.4596 -4.3029 -4.3029 -3.0669 -3.0669 -2.7929 -2.7929 -2.7861 -2.7861 -2.6086 -2.6086 -2.5860 -2.5860 -2.2773 -2.2773 -1.6997 -1.6997 -1.6775 -1.6775 -1.5458 -1.5458 0.5174 0.5174 0.8478 0.8478 0.8669 0.8669 7.0457 7.0457 7.7549 7.7549 8.1252 8.1252 8.1268 8.1268 8.4458 8.4458 9.3984 9.3984 k = 0.3922 0.3922 0.3922 ( 6380 PWs) bands (ev): -25.3544 -25.3544 -24.9615 -24.9615 -24.9110 -24.9110 -24.9082 -24.9082 -22.3456 -22.3456 -21.5192 -21.5192 -21.4472 -21.4472 -21.4422 -21.4422 -10.7810 -10.7810 -9.0955 -9.0955 -8.8909 -8.8909 -8.8870 -8.8870 -5.5500 -5.5500 -5.5322 -5.5322 -5.5248 -5.5248 -5.0327 -5.0327 -5.0301 -5.0301 -4.4548 -4.4548 -4.4346 -4.4346 -4.3010 -4.3010 -3.0531 -3.0531 -2.7978 -2.7978 -2.7891 -2.7891 -2.6286 -2.6286 -2.6084 -2.6084 -2.3269 -2.3269 -1.6798 -1.6798 -1.6569 -1.6569 -1.5461 -1.5461 0.5612 0.5612 0.8436 0.8436 0.8626 0.8626 7.1100 7.1100 7.7618 7.7618 8.1314 8.1314 8.1328 8.1328 8.4162 8.4162 9.3443 9.3443 k = 0.4020 0.4020 0.4020 ( 6380 PWs) bands (ev): -25.3593 -25.3593 -24.9535 -24.9535 -24.9111 -24.9111 -24.9084 -24.9084 -22.3596 -22.3596 -21.5071 -21.5071 -21.4472 -21.4472 -21.4422 -21.4422 -10.8034 -10.8034 -9.0623 -9.0623 -8.8902 -8.8902 -8.8863 -8.8863 -5.5609 -5.5609 -5.5427 -5.5427 -5.5361 -5.5361 -5.0347 -5.0347 -5.0326 -5.0326 -4.4314 -4.4314 -4.4108 -4.4108 -4.2992 -4.2992 -3.0382 -3.0382 -2.8040 -2.8040 -2.7930 -2.7930 -2.6462 -2.6462 -2.6288 -2.6288 -2.3757 -2.3757 -1.6612 -1.6612 -1.6376 -1.6376 -1.5462 -1.5462 0.6027 0.6027 0.8395 0.8395 0.8583 0.8583 7.1641 7.1641 7.7794 7.7794 8.1385 8.1385 8.1398 8.1398 8.3899 8.3899 9.2928 9.2928 k = 0.4118 0.4118 0.4118 ( 6368 PWs) bands (ev): -25.3639 -25.3639 -24.9459 -24.9459 -24.9112 -24.9112 -24.9085 -24.9085 -22.3727 -22.3727 -21.4959 -21.4959 -21.4471 -21.4471 -21.4422 -21.4422 -10.8243 -10.8243 -9.0311 -9.0311 -8.8896 -8.8896 -8.8857 -8.8857 -5.5711 -5.5711 -5.5525 -5.5525 -5.5468 -5.5468 -5.0363 -5.0363 -5.0347 -5.0347 -4.4094 -4.4094 -4.3885 -4.3885 -4.2974 -4.2974 -3.0223 -3.0223 -2.8114 -2.8114 -2.7979 -2.7979 -2.6611 -2.6611 -2.6467 -2.6467 -2.4233 -2.4233 -1.6441 -1.6441 -1.6198 -1.6198 -1.5463 -1.5463 0.6417 0.6417 0.8355 0.8355 0.8543 0.8543 7.2063 7.2063 7.8093 7.8093 8.1464 8.1464 8.1477 8.1477 8.3668 8.3668 9.2442 9.2442 k = 0.4216 0.4216 0.4216 ( 6359 PWs) bands (ev): -25.3681 -25.3681 -24.9389 -24.9389 -24.9113 -24.9113 -24.9086 -24.9086 -22.3847 -22.3847 -21.4857 -21.4857 -21.4470 -21.4470 -21.4421 -21.4421 -10.8433 -10.8433 -9.0022 -9.0022 -8.8890 -8.8890 -8.8852 -8.8852 -5.5804 -5.5804 -5.5614 -5.5614 -5.5567 -5.5567 -5.0377 -5.0377 -5.0364 -5.0364 -4.3891 -4.3891 -4.3678 -4.3678 -4.2957 -4.2957 -3.0053 -3.0053 -2.8199 -2.8199 -2.8039 -2.8039 -2.6734 -2.6734 -2.6619 -2.6619 -2.4696 -2.4696 -1.6287 -1.6287 -1.6036 -1.6036 -1.5461 -1.5461 0.6775 0.6775 0.8319 0.8319 0.8504 0.8504 7.2364 7.2364 7.8515 7.8515 8.1549 8.1549 8.1561 8.1561 8.3468 8.3468 9.1991 9.1991 k = 0.4314 0.4314 0.4314 ( 6359 PWs) bands (ev): -25.3718 -25.3718 -24.9326 -24.9326 -24.9114 -24.9114 -24.9087 -24.9087 -22.3956 -22.3956 -21.4765 -21.4765 -21.4469 -21.4469 -21.4421 -21.4421 -10.8604 -10.8604 -8.9759 -8.9759 -8.8885 -8.8885 -8.8846 -8.8846 -5.5889 -5.5889 -5.5695 -5.5695 -5.5657 -5.5657 -5.0388 -5.0388 -5.0379 -5.0379 -4.3708 -4.3708 -4.3489 -4.3489 -4.2940 -4.2940 -2.9873 -2.9873 -2.8290 -2.8290 -2.8107 -2.8107 -2.6831 -2.6831 -2.6744 -2.6744 -2.5141 -2.5141 -1.6150 -1.6150 -1.5890 -1.5890 -1.5458 -1.5458 0.7099 0.7099 0.8287 0.8287 0.8469 0.8469 7.2558 7.2558 7.9041 7.9041 8.1637 8.1637 8.1648 8.1648 8.3301 8.3301 9.1576 9.1576 k = 0.4412 0.4412 0.4412 ( 6338 PWs) bands (ev): -25.3751 -25.3751 -24.9270 -24.9270 -24.9114 -24.9114 -24.9088 -24.9088 -22.4052 -22.4052 -21.4685 -21.4685 -21.4467 -21.4467 -21.4421 -21.4421 -10.8754 -10.8754 -8.9526 -8.9526 -8.8880 -8.8880 -8.8842 -8.8842 -5.5964 -5.5964 -5.5766 -5.5766 -5.5737 -5.5737 -5.0397 -5.0397 -5.0390 -5.0390 -4.3547 -4.3547 -4.3321 -4.3321 -4.2923 -4.2923 -2.9684 -2.9684 -2.8382 -2.8382 -2.8180 -2.8180 -2.6906 -2.6906 -2.6844 -2.6844 -2.5568 -2.5568 -1.6032 -1.6032 -1.5761 -1.5761 -1.5452 -1.5452 0.7384 0.7384 0.8261 0.8261 0.8436 0.8436 7.2668 7.2668 7.9639 7.9639 8.1725 8.1725 8.1735 8.1735 8.3169 8.3169 9.1204 9.1204 k = 0.4510 0.4510 0.4510 ( 6350 PWs) bands (ev): -25.3779 -25.3779 -24.9223 -24.9223 -24.9114 -24.9114 -24.9089 -24.9089 -22.4135 -22.4135 -21.4618 -21.4618 -21.4464 -21.4464 -21.4421 -21.4421 -10.8883 -10.8883 -8.9324 -8.9324 -8.8875 -8.8875 -8.8838 -8.8838 -5.6028 -5.6028 -5.5827 -5.5827 -5.5806 -5.5806 -5.0404 -5.0404 -5.0400 -5.0400 -4.3410 -4.3410 -4.3175 -4.3175 -4.2906 -4.2906 -2.9487 -2.9487 -2.8467 -2.8467 -2.8254 -2.8254 -2.6962 -2.6962 -2.6920 -2.6920 -2.5971 -2.5971 -1.5935 -1.5935 -1.5652 -1.5652 -1.5444 -1.5444 0.7625 0.7625 0.8243 0.8243 0.8408 0.8408 7.2721 7.2721 8.0268 8.0268 8.1809 8.1809 8.1818 8.1818 8.3074 8.3074 9.0877 9.0877 k = 0.4608 0.4608 0.4608 ( 6347 PWs) bands (ev): -25.3802 -25.3802 -24.9184 -24.9184 -24.9112 -24.9112 -24.9090 -24.9090 -22.4203 -22.4203 -21.4566 -21.4566 -21.4459 -21.4459 -21.4421 -21.4421 -10.8990 -10.8990 -8.9157 -8.9157 -8.8871 -8.8871 -8.8834 -8.8834 -5.6082 -5.6082 -5.5878 -5.5878 -5.5864 -5.5864 -5.0410 -5.0410 -5.0407 -5.0407 -4.3299 -4.3299 -4.3052 -4.3052 -4.2886 -4.2886 -2.9289 -2.9289 -2.8536 -2.8536 -2.8323 -2.8323 -2.7004 -2.7004 -2.6977 -2.6977 -2.6348 -2.6348 -1.5859 -1.5859 -1.5561 -1.5561 -1.5433 -1.5433 0.7815 0.7815 0.8238 0.8238 0.8385 0.8385 7.2738 7.2738 8.0880 8.0880 8.1885 8.1885 8.1894 8.1894 8.3026 8.3026 9.0601 9.0601 k = 0.4706 0.4706 0.4706 ( 6347 PWs) bands (ev): -25.3821 -25.3821 -24.9157 -24.9157 -24.9108 -24.9108 -24.9090 -24.9090 -22.4257 -22.4257 -21.4529 -21.4529 -21.4450 -21.4450 -21.4421 -21.4421 -10.9074 -10.9074 -8.9026 -8.9026 -8.8866 -8.8866 -8.8832 -8.8832 -5.6124 -5.6124 -5.5917 -5.5917 -5.5910 -5.5910 -5.0414 -5.0414 -5.0412 -5.0412 -4.3217 -4.3217 -4.2955 -4.2955 -4.2866 -4.2866 -2.9105 -2.9105 -2.8578 -2.8578 -2.8383 -2.8383 -2.7034 -2.7034 -2.7017 -2.7017 -2.6690 -2.6690 -1.5803 -1.5803 -1.5489 -1.5489 -1.5420 -1.5420 0.7945 0.7945 0.8253 0.8253 0.8366 0.8366 7.2737 7.2737 8.1411 8.1411 8.1950 8.1950 8.1958 8.1958 8.3044 8.3044 9.0380 9.0380 k = 0.4804 0.4804 0.4804 ( 6329 PWs) bands (ev): -25.3833 -25.3833 -24.9141 -24.9141 -24.9101 -24.9101 -24.9090 -24.9090 -22.4296 -22.4296 -21.4510 -21.4510 -21.4437 -21.4437 -21.4421 -21.4421 -10.9134 -10.9134 -8.8936 -8.8936 -8.8857 -8.8857 -8.8830 -8.8830 -5.6154 -5.6154 -5.5946 -5.5946 -5.5942 -5.5942 -5.0417 -5.0417 -5.0416 -5.0416 -4.3162 -4.3162 -4.2885 -4.2885 -4.2847 -4.2847 -2.8964 -2.8964 -2.8569 -2.8569 -2.8428 -2.8428 -2.7060 -2.7060 -2.7044 -2.7044 -2.6978 -2.6978 -1.5765 -1.5765 -1.5438 -1.5438 -1.5409 -1.5409 0.8014 0.8014 0.8289 0.8289 0.8352 0.8352 7.2728 7.2728 8.1789 8.1789 8.2000 8.2000 8.2008 8.2008 8.3140 8.3140 9.0219 9.0219 k = 0.4902 0.4902 0.4902 ( 6278 PWs) bands (ev): -25.3841 -25.3841 -24.9135 -24.9135 -24.9093 -24.9093 -24.9090 -24.9090 -22.4319 -22.4319 -21.4501 -21.4501 -21.4425 -21.4425 -21.4421 -21.4421 -10.9169 -10.9169 -8.8894 -8.8894 -8.8839 -8.8839 -8.8828 -8.8828 -5.6173 -5.6173 -5.5963 -5.5963 -5.5962 -5.5962 -5.0418 -5.0418 -5.0418 -5.0418 -4.3131 -4.3131 -4.2842 -4.2842 -4.2833 -4.2833 -2.8898 -2.8898 -2.8506 -2.8506 -2.8457 -2.8457 -2.7208 -2.7208 -2.7058 -2.7058 -2.7058 -2.7058 -1.5744 -1.5744 -1.5407 -1.5407 -1.5400 -1.5400 0.8041 0.8041 0.8326 0.8326 0.8344 0.8344 7.2720 7.2720 8.1987 8.1987 8.2031 8.2031 8.2038 8.2038 8.3273 8.3273 9.0118 9.0118 k = 0.5000 0.5000 0.5000 ( 6272 PWs) bands (ev): -25.3843 -25.3843 -24.9133 -24.9133 -24.9090 -24.9090 -24.9090 -24.9090 -22.4327 -22.4327 -21.4499 -21.4499 -21.4421 -21.4421 -21.4421 -21.4421 -10.9181 -10.9181 -8.8886 -8.8886 -8.8828 -8.8828 -8.8828 -8.8828 -5.6179 -5.6179 -5.5968 -5.5968 -5.5968 -5.5968 -5.0418 -5.0418 -5.0418 -5.0418 -4.3121 -4.3121 -4.2828 -4.2828 -4.2828 -4.2828 -2.8883 -2.8883 -2.8466 -2.8466 -2.8466 -2.8466 -2.7291 -2.7291 -2.7063 -2.7063 -2.7063 -2.7063 -1.5737 -1.5737 -1.5397 -1.5397 -1.5397 -1.5397 0.8047 0.8047 0.8341 0.8341 0.8341 0.8341 7.2717 7.2717 8.2037 8.2037 8.2049 8.2049 8.2049 8.2049 8.3337 8.3337 9.0072 9.0072 k = 0.5000 0.5000 0.5000 ( 6272 PWs) bands (ev): -25.3843 -25.3843 -24.9133 -24.9133 -24.9090 -24.9090 -24.9090 -24.9090 -22.4327 -22.4327 -21.4499 -21.4499 -21.4421 -21.4421 -21.4421 -21.4421 -10.9181 -10.9181 -8.8886 -8.8886 -8.8828 -8.8828 -8.8828 -8.8828 -5.6179 -5.6179 -5.5968 -5.5968 -5.5968 -5.5968 -5.0418 -5.0418 -5.0418 -5.0418 -4.3121 -4.3121 -4.2828 -4.2828 -4.2828 -4.2828 -2.8883 -2.8883 -2.8466 -2.8466 -2.8466 -2.8466 -2.7291 -2.7291 -2.7063 -2.7063 -2.7063 -2.7063 -1.5737 -1.5737 -1.5397 -1.5397 -1.5397 -1.5397 0.8047 0.8047 0.8341 0.8341 0.8341 0.8341 7.2717 7.2717 8.2037 8.2037 8.2049 8.2049 8.2049 8.2049 8.3337 8.3337 9.0072 9.0072 k = 0.4881 0.5000 0.4881 ( 6276 PWs) bands (ev): -25.3841 -25.3841 -24.9134 -24.9134 -24.9093 -24.9093 -24.9090 -24.9090 -22.4319 -22.4319 -21.4501 -21.4501 -21.4425 -21.4425 -21.4421 -21.4421 -10.9169 -10.9169 -8.8894 -8.8894 -8.8839 -8.8839 -8.8828 -8.8828 -5.6173 -5.6173 -5.5963 -5.5963 -5.5962 -5.5962 -5.0419 -5.0419 -5.0416 -5.0416 -4.3130 -4.3130 -4.2841 -4.2841 -4.2834 -4.2834 -2.8897 -2.8897 -2.8505 -2.8505 -2.8457 -2.8457 -2.7209 -2.7209 -2.7063 -2.7063 -2.7054 -2.7054 -1.5744 -1.5744 -1.5406 -1.5406 -1.5400 -1.5400 0.8041 0.8041 0.8326 0.8326 0.8344 0.8344 7.2720 7.2720 8.1995 8.1995 8.2011 8.2011 8.2053 8.2053 8.3273 8.3273 9.0113 9.0113 k = 0.4762 0.5000 0.4762 ( 6328 PWs) bands (ev): -25.3834 -25.3834 -24.9141 -24.9141 -24.9101 -24.9101 -24.9090 -24.9090 -22.4297 -22.4297 -21.4509 -21.4509 -21.4437 -21.4437 -21.4421 -21.4421 -10.9134 -10.9134 -8.8935 -8.8935 -8.8857 -8.8857 -8.8830 -8.8830 -5.6155 -5.6155 -5.5947 -5.5947 -5.5942 -5.5942 -5.0422 -5.0422 -5.0410 -5.0410 -4.3161 -4.3161 -4.2881 -4.2881 -4.2851 -4.2851 -2.8960 -2.8960 -2.8570 -2.8570 -2.8431 -2.8431 -2.7067 -2.7067 -2.7040 -2.7040 -2.6980 -2.6980 -1.5765 -1.5765 -1.5435 -1.5435 -1.5411 -1.5411 0.8014 0.8014 0.8290 0.8290 0.8353 0.8353 7.2728 7.2728 8.1826 8.1826 8.1911 8.1911 8.2076 8.2076 8.3128 8.3128 9.0168 9.0168 k = 0.4643 0.5000 0.4643 ( 6348 PWs) bands (ev): -25.3821 -25.3821 -24.9156 -24.9156 -24.9108 -24.9108 -24.9090 -24.9090 -22.4259 -22.4259 -21.4529 -21.4529 -21.4449 -21.4449 -21.4421 -21.4421 -10.9076 -10.9076 -8.9022 -8.9022 -8.8866 -8.8866 -8.8832 -8.8832 -5.6125 -5.6125 -5.5919 -5.5919 -5.5909 -5.5909 -5.0426 -5.0426 -5.0400 -5.0400 -4.3214 -4.3214 -4.2944 -4.2944 -4.2876 -4.2876 -2.9091 -2.9091 -2.8587 -2.8587 -2.8387 -2.8387 -2.7063 -2.7063 -2.6992 -2.6992 -2.6694 -2.6694 -1.5801 -1.5801 -1.5482 -1.5482 -1.5427 -1.5427 0.7944 0.7944 0.8254 0.8254 0.8368 0.8368 7.2739 7.2739 8.1491 8.1491 8.1762 8.1762 8.2114 8.2114 8.2997 8.2997 9.0251 9.0251 k = 0.4524 0.5000 0.4524 ( 6352 PWs) bands (ev): -25.3803 -25.3803 -24.9183 -24.9183 -24.9112 -24.9112 -24.9090 -24.9090 -22.4205 -22.4205 -21.4564 -21.4564 -21.4459 -21.4459 -21.4421 -21.4421 -10.8993 -10.8993 -8.9150 -8.9150 -8.8872 -8.8872 -8.8835 -8.8835 -5.6084 -5.6084 -5.5881 -5.5881 -5.5864 -5.5864 -5.0432 -5.0432 -5.0385 -5.0385 -4.3294 -4.3294 -4.3028 -4.3028 -4.2909 -4.2909 -2.9265 -2.9265 -2.8559 -2.8559 -2.8325 -2.8325 -2.7060 -2.7060 -2.6929 -2.6929 -2.6352 -2.6352 -1.5855 -1.5855 -1.5544 -1.5544 -1.5448 -1.5448 0.7812 0.7812 0.8241 0.8241 0.8389 0.8389 7.2746 7.2746 8.0992 8.0992 8.1582 8.1582 8.2167 8.2167 8.2932 8.2932 9.0364 9.0364 k = 0.4405 0.5000 0.4405 ( 6340 PWs) bands (ev): -25.3780 -25.3780 -24.9220 -24.9220 -24.9114 -24.9114 -24.9089 -24.9089 -22.4138 -22.4138 -21.4616 -21.4616 -21.4464 -21.4464 -21.4421 -21.4421 -10.8888 -10.8888 -8.9314 -8.9314 -8.8877 -8.8877 -8.8839 -8.8839 -5.6031 -5.6031 -5.5831 -5.5831 -5.5806 -5.5806 -5.0439 -5.0439 -5.0366 -5.0366 -4.3405 -4.3405 -4.3129 -4.3129 -4.2946 -4.2946 -2.9450 -2.9450 -2.8510 -2.8510 -2.8243 -2.8243 -2.7057 -2.7057 -2.6844 -2.6844 -2.5973 -2.5973 -1.5930 -1.5930 -1.5620 -1.5620 -1.5472 -1.5472 0.7619 0.7619 0.8248 0.8248 0.8416 0.8416 7.2745 7.2745 8.0379 8.0379 8.1394 8.1394 8.2236 8.2236 8.2924 8.2924 9.0509 9.0509 k = 0.4286 0.5000 0.4286 ( 6356 PWs) bands (ev): -25.3752 -25.3752 -24.9267 -24.9267 -24.9115 -24.9115 -24.9089 -24.9089 -22.4056 -22.4056 -21.4683 -21.4683 -21.4467 -21.4467 -21.4421 -21.4421 -10.8761 -10.8761 -8.9512 -8.9512 -8.8883 -8.8883 -8.8843 -8.8843 -5.5968 -5.5968 -5.5771 -5.5771 -5.5736 -5.5736 -5.0448 -5.0448 -5.0343 -5.0343 -4.3548 -4.3548 -4.3243 -4.3243 -4.2987 -4.2987 -2.9634 -2.9634 -2.8457 -2.8457 -2.8138 -2.8138 -2.7054 -2.7054 -2.6735 -2.6735 -2.5566 -2.5566 -1.6028 -1.6028 -1.5707 -1.5707 -1.5499 -1.5499 0.7373 0.7373 0.8267 0.8267 0.8449 0.8449 7.2725 7.2725 7.9696 7.9696 8.1220 8.1220 8.2319 8.2319 8.2955 8.2955 9.0686 9.0686 k = 0.4167 0.5000 0.4167 ( 6356 PWs) bands (ev): -25.3719 -25.3719 -24.9322 -24.9322 -24.9115 -24.9115 -24.9088 -24.9088 -22.3960 -22.3960 -21.4762 -21.4762 -21.4468 -21.4468 -21.4422 -21.4422 -10.8611 -10.8611 -8.9742 -8.9742 -8.8890 -8.8890 -8.8848 -8.8848 -5.5895 -5.5895 -5.5700 -5.5700 -5.5656 -5.5656 -5.0458 -5.0458 -5.0315 -5.0315 -4.3720 -4.3720 -4.3370 -4.3370 -4.3033 -4.3033 -2.9809 -2.9809 -2.8408 -2.8408 -2.8011 -2.8011 -2.7049 -2.7049 -2.6601 -2.6601 -2.5133 -2.5133 -1.6151 -1.6151 -1.5803 -1.5803 -1.5527 -1.5527 0.7081 0.7081 0.8295 0.8295 0.8488 0.8488 7.2678 7.2678 7.8975 7.8975 8.1078 8.1078 8.2418 8.2418 8.3012 8.3012 9.0892 9.0892 k = 0.4048 0.5000 0.4048 ( 6362 PWs) bands (ev): -25.3682 -25.3682 -24.9384 -24.9384 -24.9115 -24.9115 -24.9087 -24.9087 -22.3852 -22.3852 -21.4854 -21.4854 -21.4469 -21.4469 -21.4422 -21.4422 -10.8441 -10.8441 -9.0002 -9.0002 -8.8898 -8.8898 -8.8853 -8.8853 -5.5812 -5.5812 -5.5618 -5.5618 -5.5565 -5.5565 -5.0468 -5.0468 -5.0283 -5.0283 -4.3918 -4.3918 -4.3509 -4.3509 -4.3082 -4.3082 -2.9973 -2.9973 -2.8368 -2.8368 -2.7860 -2.7860 -2.7045 -2.7045 -2.6442 -2.6442 -2.4679 -2.4679 -1.6298 -1.6298 -1.5907 -1.5907 -1.5557 -1.5557 0.6748 0.6748 0.8328 0.8328 0.8532 0.8532 7.2595 7.2595 7.8234 7.8234 8.0987 8.0987 8.2530 8.2530 8.3090 8.3090 9.1128 9.1128 k = 0.3929 0.5000 0.3929 ( 6370 PWs) bands (ev): -25.3640 -25.3640 -24.9454 -24.9454 -24.9114 -24.9114 -24.9086 -24.9086 -22.3732 -22.3732 -21.4956 -21.4956 -21.4470 -21.4470 -21.4422 -21.4422 -10.8250 -10.8250 -9.0289 -9.0289 -8.8907 -8.8907 -8.8858 -8.8858 -5.5720 -5.5720 -5.5527 -5.5527 -5.5466 -5.5466 -5.0480 -5.0480 -5.0246 -5.0246 -4.4140 -4.4140 -4.3659 -4.3659 -4.3137 -4.3137 -3.0124 -3.0124 -2.8338 -2.8338 -2.7690 -2.7690 -2.7039 -2.7039 -2.6257 -2.6257 -2.4206 -2.4206 -1.6466 -1.6466 -1.6019 -1.6019 -1.5589 -1.5589 0.6375 0.6375 0.8365 0.8365 0.8581 0.8581 7.2468 7.2468 7.7484 7.7484 8.0959 8.0959 8.2657 8.2657 8.3185 8.3185 9.1393 9.1393 k = 0.3810 0.5000 0.3810 ( 6378 PWs) bands (ev): -25.3594 -25.3594 -24.9529 -24.9529 -24.9114 -24.9114 -24.9085 -24.9085 -22.3600 -22.3600 -21.5069 -21.5069 -21.4470 -21.4470 -21.4422 -21.4422 -10.8040 -10.8040 -9.0601 -9.0601 -8.8916 -8.8916 -8.8864 -8.8864 -5.5619 -5.5619 -5.5426 -5.5426 -5.5358 -5.5358 -5.0492 -5.0492 -5.0204 -5.0204 -4.4382 -4.4382 -4.3820 -4.3820 -4.3197 -4.3197 -3.0264 -3.0264 -2.8317 -2.8317 -2.7501 -2.7501 -2.7032 -2.7032 -2.6048 -2.6048 -2.3716 -2.3716 -1.6653 -1.6653 -1.6140 -1.6140 -1.5622 -1.5622 0.5966 0.5966 0.8406 0.8406 0.8635 0.8635 7.2294 7.2294 7.6732 7.6732 8.1003 8.1003 8.2798 8.2798 8.3294 8.3294 9.1686 9.1686 k = 0.3690 0.5000 0.3690 ( 6378 PWs) bands (ev): -25.3544 -25.3544 -24.9611 -24.9611 -24.9113 -24.9113 -24.9083 -24.9083 -22.3458 -22.3458 -21.5192 -21.5192 -21.4470 -21.4470 -21.4422 -21.4422 -10.7812 -10.7812 -9.0935 -9.0935 -8.8927 -8.8927 -8.8869 -8.8869 -5.5509 -5.5509 -5.5317 -5.5317 -5.5242 -5.5242 -5.0505 -5.0505 -5.0157 -5.0157 -4.4640 -4.4640 -4.3991 -4.3991 -4.3262 -4.3262 -3.0390 -3.0390 -2.8306 -2.8306 -2.7298 -2.7298 -2.7023 -2.7023 -2.5819 -2.5819 -2.3213 -2.3213 -1.6856 -1.6856 -1.6268 -1.6268 -1.5658 -1.5658 0.5525 0.5525 0.8448 0.8448 0.8692 0.8692 7.2071 7.2071 7.5985 7.5985 8.1123 8.1123 8.2953 8.2953 8.3418 8.3418 9.2006 9.2006 k = 0.3571 0.5000 0.3571 ( 6362 PWs) bands (ev): -25.3490 -25.3490 -24.9697 -24.9697 -24.9112 -24.9112 -24.9082 -24.9082 -22.3306 -22.3306 -21.5323 -21.5323 -21.4470 -21.4470 -21.4422 -21.4422 -10.7566 -10.7566 -9.1289 -9.1289 -8.8937 -8.8937 -8.8875 -8.8875 -5.5392 -5.5392 -5.5201 -5.5201 -5.5118 -5.5118 -5.0518 -5.0518 -5.0105 -5.0105 -4.4912 -4.4912 -4.4170 -4.4170 -4.3333 -4.3333 -3.0504 -3.0504 -2.8303 -2.8303 -2.7094 -2.7094 -2.7001 -2.7001 -2.5571 -2.5571 -2.2700 -2.2700 -1.7071 -1.7071 -1.6404 -1.6404 -1.5696 -1.5696 0.5053 0.5053 0.8493 0.8493 0.8753 0.8753 7.1800 7.1800 7.5246 7.5246 8.1319 8.1319 8.3121 8.3121 8.3554 8.3554 9.2350 9.2350 k = 0.3452 0.5000 0.3452 ( 6370 PWs) bands (ev): -25.3433 -25.3433 -24.9787 -24.9787 -24.9111 -24.9111 -24.9080 -24.9080 -22.3146 -22.3146 -21.5463 -21.5463 -21.4470 -21.4470 -21.4422 -21.4422 -10.7305 -10.7305 -9.1661 -9.1661 -8.8949 -8.8949 -8.8881 -8.8881 -5.5267 -5.5267 -5.5079 -5.5079 -5.4988 -5.4988 -5.0531 -5.0531 -5.0048 -5.0048 -4.5196 -4.5196 -4.4357 -4.4357 -4.3410 -4.3410 -3.0606 -3.0606 -2.8307 -2.8307 -2.7020 -2.7020 -2.6835 -2.6835 -2.5308 -2.5308 -2.2183 -2.2183 -1.7291 -1.7291 -1.6547 -1.6547 -1.5737 -1.5737 0.4554 0.4554 0.8540 0.8540 0.8815 0.8815 7.1487 7.1487 7.4517 7.4517 8.1587 8.1587 8.3301 8.3301 8.3702 8.3702 9.2719 9.2719 k = 0.3333 0.5000 0.3333 ( 6362 PWs) bands (ev): -25.3372 -25.3372 -24.9882 -24.9882 -24.9110 -24.9110 -24.9077 -24.9077 -22.2978 -22.2978 -21.5611 -21.5611 -21.4470 -21.4470 -21.4423 -21.4423 -10.7029 -10.7029 -9.2047 -9.2047 -8.8961 -8.8961 -8.8888 -8.8888 -5.5134 -5.5134 -5.4953 -5.4953 -5.4850 -5.4850 -5.0543 -5.0543 -4.9986 -4.9986 -4.5489 -4.5489 -4.4551 -4.4551 -4.3493 -4.3493 -3.0695 -3.0695 -2.8317 -2.8317 -2.7007 -2.7007 -2.6598 -2.6598 -2.5031 -2.5031 -2.1671 -2.1671 -1.7509 -1.7509 -1.6696 -1.6696 -1.5781 -1.5781 0.4031 0.4031 0.8588 0.8588 0.8879 0.8879 7.1138 7.1138 7.3802 7.3802 8.1921 8.1921 8.3494 8.3494 8.3862 8.3862 9.3110 9.3110 k = 0.3214 0.5000 0.3214 ( 6376 PWs) bands (ev): -25.3308 -25.3308 -24.9980 -24.9980 -24.9109 -24.9109 -24.9075 -24.9075 -22.2804 -22.2804 -21.5765 -21.5765 -21.4470 -21.4470 -21.4423 -21.4423 -10.6739 -10.6739 -9.2445 -9.2445 -8.8973 -8.8973 -8.8894 -8.8894 -5.4996 -5.4996 -5.4825 -5.4825 -5.4704 -5.4704 -5.0555 -5.0555 -4.9918 -4.9918 -4.5788 -4.5788 -4.4751 -4.4751 -4.3583 -4.3583 -3.0773 -3.0773 -2.8333 -2.8333 -2.6996 -2.6996 -2.6348 -2.6348 -2.4743 -2.4743 -2.1178 -2.1178 -1.7712 -1.7712 -1.6851 -1.6851 -1.5828 -1.5828 0.3486 0.3486 0.8637 0.8637 0.8944 0.8944 7.0760 7.0760 7.3101 7.3101 8.2314 8.2314 8.3699 8.3699 8.4033 8.4033 9.3521 9.3521 k = 0.3095 0.5000 0.3095 ( 6368 PWs) bands (ev): -25.3242 -25.3242 -25.0080 -25.0080 -24.9108 -24.9108 -24.9073 -24.9073 -22.2624 -22.2624 -21.5925 -21.5925 -21.4470 -21.4470 -21.4423 -21.4423 -10.6438 -10.6438 -9.2852 -9.2852 -8.8985 -8.8985 -8.8901 -8.8901 -5.4853 -5.4853 -5.4694 -5.4694 -5.4552 -5.4552 -5.0566 -5.0566 -4.9846 -4.9846 -4.6093 -4.6093 -4.4955 -4.4955 -4.3680 -4.3680 -3.0839 -3.0839 -2.8353 -2.8353 -2.6984 -2.6984 -2.6090 -2.6090 -2.4446 -2.4446 -2.0731 -2.0731 -1.7871 -1.7871 -1.7011 -1.7011 -1.5878 -1.5878 0.2923 0.2923 0.8686 0.8686 0.9008 0.9008 7.0358 7.0358 7.2416 7.2416 8.2761 8.2761 8.3915 8.3915 8.4215 8.4215 9.3951 9.3951 k = 0.2976 0.5000 0.2976 ( 6364 PWs) bands (ev): -25.3174 -25.3174 -25.0181 -25.0181 -24.9106 -24.9106 -24.9070 -24.9070 -22.2439 -22.2439 -21.6090 -21.6090 -21.4470 -21.4470 -21.4424 -21.4424 -10.6126 -10.6126 -9.3267 -9.3267 -8.8996 -8.8996 -8.8907 -8.8907 -5.4709 -5.4709 -5.4559 -5.4559 -5.4394 -5.4394 -5.0576 -5.0576 -4.9769 -4.9769 -4.6400 -4.6400 -4.5162 -4.5162 -4.3783 -4.3783 -3.0893 -3.0893 -2.8377 -2.8377 -2.6972 -2.6972 -2.5826 -2.5826 -2.4142 -2.4142 -2.0379 -2.0379 -1.7941 -1.7941 -1.7174 -1.7174 -1.5932 -1.5932 0.2345 0.2345 0.8736 0.8736 0.9072 0.9072 6.9940 6.9940 7.1749 7.1749 8.3253 8.3253 8.4142 8.4142 8.4406 8.4406 9.4397 9.4397 k = 0.2857 0.5000 0.2857 ( 6366 PWs) bands (ev): -25.3103 -25.3103 -25.0284 -25.0284 -24.9105 -24.9105 -24.9068 -24.9068 -22.2251 -22.2251 -21.6259 -21.6259 -21.4470 -21.4470 -21.4424 -21.4424 -10.5805 -10.5805 -9.3685 -9.3685 -8.9008 -8.9008 -8.8914 -8.8914 -5.4568 -5.4568 -5.4416 -5.4416 -5.4231 -5.4231 -5.0584 -5.0584 -4.9686 -4.9686 -4.6709 -4.6709 -4.5372 -4.5372 -4.3893 -4.3893 -3.0936 -3.0936 -2.8405 -2.8405 -2.6960 -2.6960 -2.5556 -2.5556 -2.3833 -2.3833 -2.0185 -2.0185 -1.7860 -1.7860 -1.7339 -1.7339 -1.5990 -1.5990 0.1754 0.1754 0.8787 0.8787 0.9134 0.9134 6.9512 6.9512 7.1100 7.1100 8.3786 8.3786 8.4379 8.4379 8.4608 8.4608 9.4857 9.4857 k = 0.2738 0.5000 0.2738 ( 6358 PWs) bands (ev): -25.3031 -25.3031 -25.0388 -25.0388 -24.9103 -24.9103 -24.9065 -24.9065 -22.2060 -22.2060 -21.6431 -21.6431 -21.4470 -21.4470 -21.4425 -21.4425 -10.5477 -10.5477 -9.4106 -9.4106 -8.9019 -8.9019 -8.8921 -8.8921 -5.4435 -5.4435 -5.4261 -5.4261 -5.4065 -5.4065 -5.0591 -5.0591 -4.9599 -4.9599 -4.7015 -4.7015 -4.5583 -4.5583 -4.4011 -4.4011 -3.0968 -3.0968 -2.8436 -2.8436 -2.6947 -2.6947 -2.5282 -2.5282 -2.3520 -2.3520 -2.0178 -2.0178 -1.7622 -1.7622 -1.7481 -1.7481 -1.6051 -1.6051 0.1154 0.1154 0.8837 0.8837 0.9193 0.9193 6.9076 6.9076 7.0470 7.0470 8.4352 8.4352 8.4626 8.4626 8.4819 8.4819 9.5328 9.5328 k = 0.2619 0.5000 0.2619 ( 6354 PWs) bands (ev): -25.2958 -25.2958 -25.0492 -25.0492 -24.9100 -24.9100 -24.9062 -24.9062 -22.1869 -22.1869 -21.6605 -21.6605 -21.4470 -21.4470 -21.4425 -21.4425 -10.5144 -10.5144 -9.4526 -9.4526 -8.9029 -8.9029 -8.8928 -8.8928 -5.4312 -5.4312 -5.4095 -5.4095 -5.3897 -5.3897 -5.0595 -5.0595 -4.9508 -4.9508 -4.7319 -4.7319 -4.5795 -4.5795 -4.4135 -4.4135 -3.0988 -3.0988 -2.8469 -2.8469 -2.6933 -2.6933 -2.5004 -2.5004 -2.3205 -2.3205 -2.0319 -2.0319 -1.7694 -1.7694 -1.7175 -1.7175 -1.6116 -1.6116 0.0547 0.0547 0.8887 0.8887 0.9249 0.9249 6.8639 6.8639 6.9861 6.9861 8.4866 8.4866 8.4962 8.4962 8.5041 8.5041 9.5808 9.5808 k = 0.2500 0.5000 0.2500 ( 6344 PWs) bands (ev): -25.2884 -25.2884 -25.0595 -25.0595 -24.9098 -24.9098 -24.9059 -24.9059 -22.1677 -22.1677 -21.6781 -21.6781 -21.4470 -21.4470 -21.4426 -21.4426 -10.4807 -10.4807 -9.4943 -9.4943 -8.9039 -8.9039 -8.8934 -8.8934 -5.4198 -5.4198 -5.3918 -5.3918 -5.3727 -5.3727 -5.0597 -5.0597 -4.9413 -4.9413 -4.7616 -4.7616 -4.6007 -4.6007 -4.4266 -4.4266 -3.0997 -3.0997 -2.8505 -2.8505 -2.6918 -2.6918 -2.4725 -2.4725 -2.2889 -2.2889 -2.0550 -2.0550 -1.7862 -1.7862 -1.6693 -1.6693 -1.6184 -1.6184 -0.0064 -0.0064 0.8936 0.8936 0.9302 0.9302 6.8204 6.8204 6.9273 6.9273 8.5136 8.5136 8.5264 8.5264 8.5582 8.5582 9.6293 9.6293 k = 0.2381 0.5000 0.2381 ( 6354 PWs) bands (ev): -25.2810 -25.2810 -25.0696 -25.0696 -24.9095 -24.9095 -24.9056 -24.9056 -22.1485 -22.1485 -21.6956 -21.6956 -21.4470 -21.4470 -21.4427 -21.4427 -10.4469 -10.4469 -9.5356 -9.5356 -8.9047 -8.9047 -8.8941 -8.8941 -5.4092 -5.4092 -5.3735 -5.3735 -5.3557 -5.3557 -5.0596 -5.0596 -4.9315 -4.9315 -4.7905 -4.7905 -4.6219 -4.6219 -4.4405 -4.4405 -3.0995 -3.0995 -2.8543 -2.8543 -2.6903 -2.6903 -2.4444 -2.4444 -2.2574 -2.2574 -2.0832 -2.0832 -1.8032 -1.8032 -1.6274 -1.6274 -1.6149 -1.6149 -0.0676 -0.0676 0.8985 0.8985 0.9351 0.9351 6.7773 6.7773 6.8706 6.8706 8.5404 8.5404 8.5498 8.5498 8.6227 8.6227 9.6781 9.6781 k = 0.2262 0.5000 0.2262 ( 6362 PWs) bands (ev): -25.2736 -25.2736 -25.0797 -25.0797 -24.9092 -24.9092 -24.9054 -24.9054 -22.1296 -22.1296 -21.7132 -21.7132 -21.4470 -21.4470 -21.4428 -21.4428 -10.4131 -10.4131 -9.5762 -9.5762 -8.9055 -8.9055 -8.8948 -8.8948 -5.3993 -5.3993 -5.3549 -5.3549 -5.3387 -5.3387 -5.0592 -5.0592 -4.9215 -4.9215 -4.8184 -4.8184 -4.6429 -4.6429 -4.4551 -4.4551 -3.0982 -3.0982 -2.8582 -2.8582 -2.6887 -2.6887 -2.4163 -2.4163 -2.2259 -2.2259 -2.1145 -2.1145 -1.8202 -1.8202 -1.6341 -1.6341 -1.5611 -1.5611 -0.1286 -0.1286 0.9032 0.9032 0.9396 0.9396 6.7349 6.7349 6.8162 6.8162 8.5677 8.5677 8.5739 8.5739 8.6892 8.6892 9.7267 9.7267 k = 0.2143 0.5000 0.2143 ( 6370 PWs) bands (ev): -25.2663 -25.2663 -25.0895 -25.0895 -24.9089 -24.9089 -24.9051 -24.9051 -22.1109 -22.1109 -21.7305 -21.7305 -21.4469 -21.4469 -21.4429 -21.4429 -10.3795 -10.3795 -9.6159 -9.6159 -8.9061 -8.9061 -8.8955 -8.8955 -5.3900 -5.3900 -5.3367 -5.3367 -5.3212 -5.3212 -5.0585 -5.0585 -4.9113 -4.9113 -4.8449 -4.8449 -4.6637 -4.6637 -4.4703 -4.4703 -3.0957 -3.0957 -2.8623 -2.8623 -2.6870 -2.6870 -2.3883 -2.3883 -2.1947 -2.1947 -2.1477 -2.1477 -1.8370 -1.8370 -1.6422 -1.6422 -1.5055 -1.5055 -0.1892 -0.1892 0.9079 0.9079 0.9436 0.9436 6.6935 6.6935 6.7641 6.7641 8.5953 8.5953 8.5986 8.5986 8.7573 8.7573 9.7749 9.7749 k = 0.2024 0.5000 0.2024 ( 6366 PWs) bands (ev): -25.2590 -25.2590 -25.0990 -25.0990 -24.9085 -24.9085 -24.9048 -24.9048 -22.0926 -22.0926 -21.7476 -21.7476 -21.4469 -21.4469 -21.4430 -21.4430 -10.3463 -10.3463 -9.6546 -9.6546 -8.9066 -8.9066 -8.8961 -8.8961 -5.3814 -5.3814 -5.3201 -5.3201 -5.3027 -5.3027 -5.0574 -5.0574 -4.9011 -4.9011 -4.8694 -4.8694 -4.6843 -4.6843 -4.4863 -4.4863 -3.0920 -3.0920 -2.8665 -2.8665 -2.6853 -2.6853 -2.3604 -2.3604 -2.1822 -2.1822 -2.1639 -2.1639 -1.8535 -1.8535 -1.6509 -1.6509 -1.4500 -1.4500 -0.2490 -0.2490 0.9124 0.9124 0.9472 0.9472 6.6534 6.6534 6.7144 6.7144 8.6229 8.6229 8.6240 8.6240 8.8268 8.8268 9.8221 9.8221 k = 0.1905 0.5000 0.1905 ( 6382 PWs) bands (ev): -25.2519 -25.2519 -25.1082 -25.1082 -24.9081 -24.9081 -24.9045 -24.9045 -22.0748 -22.0748 -21.7643 -21.7643 -21.4469 -21.4469 -21.4432 -21.4432 -10.3137 -10.3137 -9.6920 -9.6920 -8.9070 -8.9070 -8.8968 -8.8968 -5.3733 -5.3733 -5.3057 -5.3057 -5.2827 -5.2827 -5.0559 -5.0559 -4.8962 -4.8962 -4.8868 -4.8868 -4.7045 -4.7045 -4.5029 -4.5029 -3.0873 -3.0873 -2.8707 -2.8707 -2.6835 -2.6835 -2.3327 -2.3327 -2.2174 -2.2174 -2.1334 -2.1334 -1.8696 -1.8696 -1.6600 -1.6600 -1.3952 -1.3952 -0.3079 -0.3079 0.9167 0.9167 0.9502 0.9502 6.6146 6.6146 6.6671 6.6671 8.6490 8.6490 8.6515 8.6515 8.8973 8.8973 9.8681 9.8681 k = 0.1786 0.5000 0.1786 ( 6374 PWs) bands (ev): -25.2450 -25.2450 -25.1171 -25.1171 -24.9077 -24.9077 -24.9042 -24.9042 -22.0575 -22.0575 -21.7806 -21.7806 -21.4469 -21.4469 -21.4433 -21.4433 -10.2819 -10.2819 -9.7279 -9.7279 -8.9072 -8.9072 -8.8974 -8.8974 -5.3659 -5.3659 -5.2938 -5.2938 -5.2614 -5.2614 -5.0540 -5.0540 -4.9141 -4.9141 -4.8790 -4.8790 -4.7244 -4.7244 -4.5202 -4.5202 -3.0813 -3.0813 -2.8750 -2.8750 -2.6817 -2.6817 -2.3054 -2.3054 -2.2531 -2.2531 -2.1035 -2.1035 -1.8852 -1.8852 -1.6695 -1.6695 -1.3415 -1.3415 -0.3656 -0.3656 0.9208 0.9208 0.9527 0.9527 6.5774 6.5774 6.6223 6.6223 8.6747 8.6747 8.6794 8.6794 8.9687 8.9687 9.9124 9.9124 k = 0.1667 0.5000 0.1667 ( 6392 PWs) bands (ev): -25.2383 -25.2383 -25.1256 -25.1256 -24.9073 -24.9073 -24.9040 -24.9040 -22.0409 -22.0409 -21.7963 -21.7963 -21.4469 -21.4469 -21.4435 -21.4435 -10.2511 -10.2511 -9.7623 -9.7623 -8.9074 -8.9074 -8.8980 -8.8980 -5.3590 -5.3590 -5.2844 -5.2844 -5.2393 -5.2393 -5.0516 -5.0516 -4.9317 -4.9317 -4.8690 -4.8690 -4.7438 -4.7438 -4.5381 -4.5381 -3.0742 -3.0742 -2.8792 -2.8792 -2.6800 -2.6800 -2.2892 -2.2892 -2.2781 -2.2781 -2.0742 -2.0742 -1.9002 -1.9002 -1.6795 -1.6795 -1.2894 -1.2894 -0.4217 -0.4217 0.9248 0.9248 0.9548 0.9548 6.5419 6.5419 6.5800 6.5800 8.7006 8.7006 8.7072 8.7072 9.0407 9.0407 9.9546 9.9546 k = 0.1548 0.5000 0.1548 ( 6372 PWs) bands (ev): -25.2319 -25.2319 -25.1336 -25.1336 -24.9068 -24.9068 -24.9038 -24.9038 -22.0250 -22.0250 -21.8113 -21.8113 -21.4469 -21.4469 -21.4436 -21.4436 -10.2215 -10.2215 -9.7950 -9.7950 -8.9073 -8.9073 -8.8986 -8.8986 -5.3527 -5.3527 -5.2776 -5.2776 -5.2166 -5.2166 -5.0488 -5.0488 -4.9463 -4.9463 -4.8591 -4.8591 -4.7628 -4.7628 -4.5566 -4.5566 -3.0659 -3.0659 -2.8834 -2.8834 -2.6781 -2.6781 -2.3248 -2.3248 -2.2517 -2.2517 -2.0457 -2.0457 -1.9146 -1.9146 -1.6899 -1.6899 -1.2391 -1.2391 -0.4761 -0.4761 0.9285 0.9285 0.9564 0.9564 6.5083 6.5083 6.5404 6.5404 8.7264 8.7264 8.7345 8.7345 9.1131 9.1131 9.9943 9.9943 k = 0.1429 0.5000 0.1429 ( 6378 PWs) bands (ev): -25.2258 -25.2258 -25.1412 -25.1412 -24.9063 -24.9063 -24.9035 -24.9035 -22.0100 -22.0100 -21.8257 -21.8257 -21.4469 -21.4469 -21.4438 -21.4438 -10.1932 -10.1932 -9.8258 -9.8258 -8.9072 -8.9072 -8.8992 -8.8992 -5.3470 -5.3470 -5.2736 -5.2736 -5.1935 -5.1935 -5.0454 -5.0454 -4.9579 -4.9579 -4.8495 -4.8495 -4.7811 -4.7811 -4.5757 -4.5757 -3.0566 -3.0566 -2.8876 -2.8876 -2.6764 -2.6764 -2.3604 -2.3604 -2.2257 -2.2257 -2.0180 -2.0180 -1.9283 -1.9283 -1.7007 -1.7007 -1.1911 -1.1911 -0.5285 -0.5285 0.9320 0.9320 0.9575 0.9575 6.4766 6.4766 6.5034 6.5034 8.7520 8.7520 8.7613 8.7613 9.1857 9.1857 10.0312 10.0312 k = 0.1310 0.5000 0.1310 ( 6370 PWs) bands (ev): -25.2200 -25.2200 -25.1483 -25.1483 -24.9058 -24.9058 -24.9033 -24.9033 -21.9958 -21.9958 -21.8392 -21.8392 -21.4468 -21.4468 -21.4440 -21.4440 -10.1664 -10.1664 -9.8546 -9.8546 -8.9069 -8.9069 -8.8997 -8.8997 -5.3417 -5.3417 -5.2722 -5.2722 -5.1700 -5.1700 -5.0415 -5.0415 -4.9661 -4.9661 -4.8406 -4.8406 -4.7986 -4.7986 -4.5952 -4.5952 -3.0461 -3.0461 -2.8916 -2.8916 -2.6746 -2.6746 -2.3956 -2.3956 -2.2002 -2.2002 -1.9914 -1.9914 -1.9411 -1.9411 -1.7119 -1.7119 -1.1456 -1.1456 -0.5785 -0.5785 0.9353 0.9353 0.9582 0.9582 6.4471 6.4471 6.4692 6.4692 8.7772 8.7772 8.7872 8.7872 9.2583 9.2583 10.0650 10.0650 k = 0.1190 0.5000 0.1190 ( 6376 PWs) bands (ev): -25.2146 -25.2146 -25.1549 -25.1549 -24.9053 -24.9053 -24.9031 -24.9031 -21.9826 -21.9826 -21.8519 -21.8519 -21.4468 -21.4468 -21.4442 -21.4442 -10.1414 -10.1414 -9.8814 -9.8814 -8.9066 -8.9066 -8.9002 -8.9002 -5.3370 -5.3370 -5.2734 -5.2734 -5.1464 -5.1464 -5.0371 -5.0371 -4.9713 -4.9713 -4.8339 -4.8339 -4.8140 -4.8140 -4.6152 -4.6152 -3.0345 -3.0345 -2.8954 -2.8954 -2.6729 -2.6729 -2.4302 -2.4302 -2.1756 -2.1756 -1.9667 -1.9667 -1.9522 -1.9522 -1.7235 -1.7235 -1.1029 -1.1029 -0.6259 -0.6259 0.9383 0.9383 0.9586 0.9586 6.4198 6.4198 6.4378 6.4378 8.8019 8.8019 8.8120 8.8120 9.3306 9.3306 10.0951 10.0951 k = 0.1071 0.5000 0.1071 ( 6376 PWs) bands (ev): -25.2097 -25.2097 -25.1609 -25.1609 -24.9049 -24.9049 -24.9029 -24.9029 -21.9704 -21.9704 -21.8636 -21.8636 -21.4468 -21.4468 -21.4444 -21.4444 -10.1183 -10.1183 -9.9059 -9.9059 -8.9062 -8.9062 -8.9006 -8.9006 -5.3328 -5.3328 -5.2766 -5.2766 -5.1227 -5.1227 -5.0321 -5.0321 -4.9739 -4.9739 -4.8383 -4.8383 -4.8182 -4.8182 -4.6356 -4.6356 -3.0220 -3.0220 -2.8991 -2.8991 -2.6713 -2.6713 -2.4639 -2.4639 -2.1517 -2.1517 -1.9654 -1.9654 -1.9404 -1.9404 -1.7353 -1.7353 -1.0633 -1.0633 -0.6704 -0.6704 0.9411 0.9411 0.9586 0.9586 6.3948 6.3948 6.4091 6.4091 8.8257 8.8257 8.8356 8.8356 9.4025 9.4025 10.0847 10.0847 k = 0.0952 0.5000 0.0952 ( 6388 PWs) bands (ev): -25.2051 -25.2051 -25.1663 -25.1663 -24.9044 -24.9044 -24.9027 -24.9027 -21.9594 -21.9594 -21.8742 -21.8742 -21.4467 -21.4467 -21.4446 -21.4446 -10.0971 -10.0971 -9.9281 -9.9281 -8.9057 -8.9057 -8.9010 -8.9010 -5.3290 -5.3290 -5.2813 -5.2813 -5.0991 -5.0991 -5.0266 -5.0266 -4.9743 -4.9743 -4.8527 -4.8527 -4.8125 -4.8125 -4.6561 -4.6561 -3.0087 -3.0087 -2.9025 -2.9025 -2.6697 -2.6697 -2.4966 -2.4966 -2.1288 -2.1288 -1.9752 -1.9752 -1.9179 -1.9179 -1.7473 -1.7473 -1.0271 -1.0271 -0.7117 -0.7117 0.9436 0.9436 0.9584 0.9584 6.3722 6.3722 6.3834 6.3834 8.8483 8.8483 8.8576 8.8576 9.4735 9.4735 10.0486 10.0486 k = 0.0833 0.5000 0.0833 ( 6388 PWs) bands (ev): -25.2011 -25.2011 -25.1712 -25.1712 -24.9040 -24.9040 -24.9026 -24.9026 -21.9495 -21.9495 -21.8838 -21.8838 -21.4467 -21.4467 -21.4448 -21.4448 -10.0781 -10.0781 -9.9479 -9.9479 -8.9052 -8.9052 -8.9014 -8.9014 -5.3258 -5.3258 -5.2870 -5.2870 -5.0758 -5.0758 -5.0204 -5.0204 -4.9731 -4.9731 -4.8680 -4.8680 -4.8060 -4.8060 -4.6767 -4.6767 -2.9947 -2.9947 -2.9056 -2.9056 -2.6683 -2.6683 -2.5279 -2.5279 -2.1070 -2.1070 -1.9842 -1.9842 -1.8968 -1.8968 -1.7594 -1.7594 -0.9945 -0.9945 -0.7494 -0.7494 0.9458 0.9458 0.9580 0.9580 6.3521 6.3521 6.3605 6.3605 8.8696 8.8696 8.8778 8.8778 9.5434 9.5434 10.0152 10.0152 k = 0.0714 0.5000 0.0714 ( 6388 PWs) bands (ev): -25.1975 -25.1975 -25.1755 -25.1755 -24.9036 -24.9036 -24.9024 -24.9024 -21.9408 -21.9408 -21.8922 -21.8922 -21.4466 -21.4466 -21.4450 -21.4450 -10.0614 -10.0614 -9.9652 -9.9652 -8.9047 -8.9047 -8.9017 -8.9017 -5.3230 -5.3230 -5.2931 -5.2931 -5.0529 -5.0529 -5.0137 -5.0137 -4.9709 -4.9709 -4.8830 -4.8830 -4.8001 -4.8001 -4.6971 -4.6971 -2.9803 -2.9803 -2.9084 -2.9084 -2.6670 -2.6670 -2.5575 -2.5575 -2.0865 -2.0865 -1.9922 -1.9922 -1.8776 -1.8776 -1.7713 -1.7713 -0.9657 -0.9657 -0.7832 -0.7832 0.9478 0.9478 0.9574 0.9574 6.3345 6.3345 6.3407 6.3407 8.8891 8.8891 8.8960 8.8960 9.6118 9.6118 9.9852 9.9852 k = 0.0595 0.5000 0.0595 ( 6406 PWs) bands (ev): -25.1945 -25.1945 -25.1791 -25.1791 -24.9032 -24.9032 -24.9023 -24.9023 -21.9333 -21.9333 -21.8994 -21.8994 -21.4466 -21.4466 -21.4452 -21.4452 -10.0471 -10.0471 -9.9800 -9.9800 -8.9042 -8.9042 -8.9020 -8.9020 -5.3206 -5.3206 -5.2990 -5.2990 -5.0310 -5.0310 -5.0062 -5.0062 -4.9683 -4.9683 -4.8974 -4.8974 -4.7948 -4.7948 -4.7171 -4.7171 -2.9659 -2.9659 -2.9109 -2.9109 -2.6659 -2.6659 -2.5849 -2.5849 -2.0677 -2.0677 -1.9991 -1.9991 -1.8606 -1.8606 -1.7829 -1.7829 -0.9410 -0.9410 -0.8127 -0.8127 0.9495 0.9495 0.9568 0.9568 6.3195 6.3195 6.3238 6.3238 8.9065 8.9065 8.9118 8.9118 9.6778 9.6778 9.9589 9.9589 k = 0.0476 0.5000 0.0476 ( 6408 PWs) bands (ev): -25.1919 -25.1919 -25.1821 -25.1821 -24.9029 -24.9029 -24.9022 -24.9022 -21.9272 -21.9272 -21.9054 -21.9054 -21.4465 -21.4465 -21.4454 -21.4454 -10.0353 -10.0353 -9.9921 -9.9921 -8.9038 -8.9038 -8.9022 -8.9022 -5.3187 -5.3187 -5.3044 -5.3044 -5.0107 -5.0107 -4.9980 -4.9980 -4.9656 -4.9656 -4.9113 -4.9113 -4.7904 -4.7904 -4.7360 -4.7360 -2.9520 -2.9520 -2.9130 -2.9130 -2.6649 -2.6649 -2.6096 -2.6096 -2.0510 -2.0510 -2.0047 -2.0047 -1.8462 -1.8462 -1.7937 -1.7937 -0.9205 -0.9205 -0.8375 -0.8375 0.9509 0.9509 0.9562 0.9562 6.3072 6.3072 6.3099 6.3099 8.9214 8.9214 8.9251 8.9251 9.7406 9.7406 9.9368 9.9368 k = 0.0357 0.5000 0.0357 ( 6412 PWs) bands (ev): -25.1900 -25.1900 -25.1844 -25.1844 -24.9026 -24.9026 -24.9022 -24.9022 -21.9224 -21.9224 -21.9101 -21.9101 -21.4464 -21.4464 -21.4456 -21.4456 -10.0260 -10.0260 -10.0017 -10.0017 -8.9034 -8.9034 -8.9024 -8.9024 -5.3172 -5.3172 -5.3089 -5.3089 -4.9933 -4.9933 -4.9882 -4.9882 -4.9632 -4.9632 -4.9245 -4.9245 -4.7869 -4.7869 -4.7532 -4.7532 -2.9393 -2.9393 -2.9146 -2.9146 -2.6642 -2.6642 -2.6306 -2.6306 -2.0368 -2.0368 -2.0092 -2.0092 -1.8346 -1.8346 -1.8032 -1.8032 -0.9044 -0.9044 -0.8572 -0.8572 0.9520 0.9520 0.9556 0.9556 6.2976 6.2976 6.2991 6.2991 8.9334 8.9334 8.9357 8.9357 9.7982 9.7982 9.9191 9.9191 k = 0.0238 0.5000 0.0238 ( 6412 PWs) bands (ev): -25.1886 -25.1886 -25.1861 -25.1861 -24.9024 -24.9024 -24.9021 -24.9021 -21.9189 -21.9189 -21.9134 -21.9134 -21.4463 -21.4463 -21.4457 -21.4457 -10.0193 -10.0193 -10.0085 -10.0085 -8.9031 -8.9031 -8.9026 -8.9026 -5.3162 -5.3162 -5.3123 -5.3123 -4.9816 -4.9816 -4.9755 -4.9755 -4.9613 -4.9613 -4.9371 -4.9371 -4.7844 -4.7844 -4.7674 -4.7674 -2.9289 -2.9289 -2.9159 -2.9159 -2.6636 -2.6636 -2.6470 -2.6470 -2.0259 -2.0259 -2.0124 -2.0124 -1.8260 -1.8260 -1.8108 -1.8108 -0.8928 -0.8928 -0.8716 -0.8716 0.9529 0.9529 0.9551 0.9551 6.2907 6.2907 6.2914 6.2914 8.9423 8.9423 8.9434 8.9434 9.8474 9.8474 9.9062 9.9062 k = 0.0119 0.5000 0.0119 ( 6412 PWs) bands (ev): -25.1877 -25.1877 -25.1871 -25.1871 -24.9023 -24.9023 -24.9021 -24.9021 -21.9169 -21.9169 -21.9154 -21.9154 -21.4462 -21.4462 -21.4459 -21.4459 -10.0153 -10.0153 -10.0126 -10.0126 -8.9029 -8.9029 -8.9027 -8.9027 -5.3156 -5.3156 -5.3144 -5.3144 -4.9713 -4.9713 -4.9655 -4.9655 -4.9601 -4.9601 -4.9490 -4.9490 -4.7827 -4.7827 -4.7772 -4.7772 -2.9218 -2.9218 -2.9169 -2.9169 -2.6631 -2.6631 -2.6576 -2.6576 -2.0188 -2.0188 -2.0145 -2.0145 -1.8207 -1.8207 -1.8158 -1.8158 -0.8858 -0.8858 -0.8803 -0.8803 0.9536 0.9536 0.9546 0.9546 6.2865 6.2865 6.2867 6.2867 8.9478 8.9478 8.9481 8.9481 9.8825 9.8825 9.8984 9.8984 k = 0.0000 0.5000-0.0000 ( 6432 PWs) bands (ev): -25.1874 -25.1874 -25.1874 -25.1874 -24.9022 -24.9022 -24.9022 -24.9022 -21.9161 -21.9161 -21.9161 -21.9161 -21.4460 -21.4460 -21.4460 -21.4460 -10.0140 -10.0140 -10.0140 -10.0140 -8.9028 -8.9028 -8.9028 -8.9028 -5.3152 -5.3152 -5.3152 -5.3152 -4.9620 -4.9620 -4.9620 -4.9620 -4.9592 -4.9592 -4.9592 -4.9592 -4.7815 -4.7815 -4.7815 -4.7815 -2.9182 -2.9182 -2.9182 -2.9182 -2.6622 -2.6622 -2.6622 -2.6622 -2.0158 -2.0158 -2.0158 -2.0158 -1.8182 -1.8182 -1.8182 -1.8182 -0.8833 -0.8833 -0.8833 -0.8833 0.9541 0.9541 0.9541 0.9541 6.2851 6.2851 6.2851 6.2851 8.9496 8.9496 8.9496 8.9496 9.8957 9.8957 9.8957 9.8957 k = 0.5000 0.5000-0.0000 ( 6304 PWs) bands (ev): -25.1782 -25.1782 -25.1782 -25.1782 -24.9110 -24.9110 -24.9110 -24.9110 -21.9194 -21.9194 -21.9194 -21.9194 -21.4436 -21.4436 -21.4436 -21.4436 -10.0098 -10.0098 -10.0098 -10.0098 -8.9082 -8.9082 -8.9082 -8.9082 -5.2998 -5.2998 -5.2998 -5.2998 -5.2409 -5.2409 -5.2409 -5.2409 -4.7594 -4.7594 -4.7594 -4.7594 -4.7292 -4.7292 -4.7292 -4.7292 -2.9343 -2.9343 -2.9343 -2.9343 -2.5976 -2.5976 -2.5976 -2.5976 -2.0508 -2.0508 -2.0508 -2.0508 -1.8215 -1.8215 -1.8215 -1.8215 -0.8590 -0.8590 -0.8590 -0.8590 0.9554 0.9554 0.9554 0.9554 7.3939 7.3939 7.3939 7.3939 7.5150 7.5150 7.5150 7.5150 9.6310 9.6310 9.6310 9.6310 k = 0.5000 0.5000 0.0167 ( 6344 PWs) bands (ev): -25.1902 -25.1902 -25.1660 -25.1660 -24.9111 -24.9111 -24.9110 -24.9110 -21.9450 -21.9450 -21.8940 -21.8940 -21.4438 -21.4438 -21.4435 -21.4435 -10.0611 -10.0611 -9.9580 -9.9580 -8.9082 -8.9082 -8.9080 -8.9080 -5.3148 -5.3148 -5.2855 -5.2855 -5.2443 -5.2443 -5.2405 -5.2405 -4.7722 -4.7722 -4.7502 -4.7502 -4.7313 -4.7313 -4.7194 -4.7194 -2.9443 -2.9443 -2.9241 -2.9241 -2.5996 -2.5996 -2.5973 -2.5973 -2.0797 -2.0797 -2.0225 -2.0225 -1.8215 -1.8215 -1.8198 -1.8198 -0.9434 -0.9434 -0.7748 -0.7748 0.9545 0.9545 0.9555 0.9555 7.3826 7.3826 7.4066 7.4066 7.5161 7.5161 7.5162 7.5162 9.5583 9.5583 9.7027 9.7027 k = 0.5000 0.5000 0.0333 ( 6352 PWs) bands (ev): -25.2020 -25.2020 -25.1538 -25.1538 -24.9112 -24.9112 -24.9109 -24.9109 -21.9705 -21.9705 -21.8688 -21.8688 -21.4439 -21.4439 -21.4434 -21.4434 -10.1118 -10.1118 -9.9058 -9.9058 -8.9081 -8.9081 -8.9077 -8.9077 -5.3301 -5.3301 -5.2731 -5.2731 -5.2508 -5.2508 -5.2417 -5.2417 -4.7873 -4.7873 -4.7419 -4.7419 -4.7268 -4.7268 -4.7044 -4.7044 -2.9539 -2.9539 -2.9137 -2.9137 -2.6032 -2.6032 -2.5987 -2.5987 -2.1088 -2.1088 -1.9945 -1.9945 -1.8196 -1.8196 -1.8162 -1.8162 -1.0275 -1.0275 -0.6907 -0.6907 0.9530 0.9530 0.9550 0.9550 7.3725 7.3725 7.4206 7.4206 7.5193 7.5193 7.5195 7.5195 9.4851 9.4851 9.7728 9.7728 k = 0.5000 0.5000 0.0500 ( 6344 PWs) bands (ev): -25.2136 -25.2136 -25.1414 -25.1414 -24.9112 -24.9112 -24.9108 -24.9108 -21.9960 -21.9960 -21.8437 -21.8437 -21.4441 -21.4441 -21.4433 -21.4433 -10.1616 -10.1616 -9.8532 -9.8532 -8.9079 -8.9079 -8.9073 -8.9073 -5.3456 -5.3456 -5.2671 -5.2671 -5.2603 -5.2603 -5.2400 -5.2400 -4.8032 -4.8032 -4.7320 -4.7320 -4.7176 -4.7176 -4.6870 -4.6870 -2.9631 -2.9631 -2.9031 -2.9031 -2.6084 -2.6084 -2.6017 -2.6017 -2.1382 -2.1382 -1.9671 -1.9671 -1.8160 -1.8160 -1.8110 -1.8110 -1.1114 -1.1114 -0.6069 -0.6069 0.9509 0.9509 0.9538 0.9538 7.3636 7.3636 7.4362 7.4362 7.5248 7.5248 7.5250 7.5250 9.4119 9.4119 9.8405 9.8405 k = 0.5000 0.5000 0.0667 ( 6356 PWs) bands (ev): -25.2249 -25.2249 -25.1290 -25.1290 -24.9113 -24.9113 -24.9107 -24.9107 -22.0215 -22.0215 -21.8190 -21.8190 -21.4442 -21.4442 -21.4432 -21.4432 -10.2106 -10.2106 -9.8005 -9.8005 -8.9076 -8.9076 -8.9068 -8.9068 -5.3610 -5.3610 -5.2723 -5.2723 -5.2715 -5.2715 -5.2309 -5.2309 -4.8192 -4.8192 -4.7197 -4.7197 -4.7049 -4.7049 -4.6686 -4.6686 -2.9719 -2.9719 -2.8923 -2.8923 -2.6152 -2.6152 -2.6063 -2.6063 -2.1678 -2.1678 -1.9403 -1.9403 -1.8106 -1.8106 -1.8041 -1.8041 -1.1948 -1.1948 -0.5237 -0.5237 0.9480 0.9480 0.9519 0.9519 7.3558 7.3558 7.4533 7.4533 7.5324 7.5324 7.5327 7.5327 9.3388 9.3388 9.9047 9.9047 k = 0.5000 0.5000 0.0833 ( 6368 PWs) bands (ev): -25.2360 -25.2360 -25.1165 -25.1165 -24.9114 -24.9114 -24.9106 -24.9106 -22.0467 -22.0467 -21.7946 -21.7946 -21.4444 -21.4444 -21.4431 -21.4431 -10.2587 -10.2587 -9.7478 -9.7478 -8.9071 -8.9071 -8.9061 -8.9061 -5.3764 -5.3764 -5.2864 -5.2864 -5.2822 -5.2822 -5.2184 -5.2184 -4.8349 -4.8349 -4.7048 -4.7048 -4.6894 -4.6894 -4.6496 -4.6496 -2.9802 -2.9802 -2.8815 -2.8815 -2.6233 -2.6233 -2.6124 -2.6124 -2.1975 -2.1975 -1.9141 -1.9141 -1.8036 -1.8036 -1.7958 -1.7958 -1.2777 -1.2777 -0.4412 -0.4412 0.9446 0.9446 0.9494 0.9494 7.3488 7.3488 7.4721 7.4721 7.5423 7.5423 7.5426 7.5426 9.2663 9.2663 9.9637 9.9637 k = 0.5000 0.5000 0.1000 ( 6360 PWs) bands (ev): -25.2468 -25.2468 -25.1040 -25.1040 -24.9114 -24.9114 -24.9106 -24.9106 -22.0718 -22.0718 -21.7706 -21.7706 -21.4445 -21.4445 -21.4430 -21.4430 -10.3056 -10.3056 -9.6951 -9.6951 -8.9066 -8.9066 -8.9054 -8.9054 -5.3917 -5.3917 -5.3023 -5.3023 -5.2960 -5.2960 -5.2051 -5.2051 -4.8503 -4.8503 -4.6879 -4.6879 -4.6716 -4.6716 -4.6302 -4.6302 -2.9878 -2.9878 -2.8707 -2.8707 -2.6326 -2.6326 -2.6199 -2.6199 -2.2272 -2.2272 -1.8887 -1.8887 -1.7950 -1.7950 -1.7862 -1.7862 -1.3597 -1.3597 -0.3596 -0.3596 0.9405 0.9405 0.9463 0.9463 7.3428 7.3428 7.4926 7.4926 7.5542 7.5542 7.5547 7.5547 9.1945 9.1945 10.0152 10.0152 k = 0.5000 0.5000 0.1167 ( 6360 PWs) bands (ev): -25.2573 -25.2573 -25.0916 -25.0916 -24.9115 -24.9115 -24.9105 -24.9105 -22.0965 -22.0965 -21.7470 -21.7470 -21.4447 -21.4447 -21.4429 -21.4429 -10.3513 -10.3513 -9.6427 -9.6427 -8.9059 -8.9059 -8.9045 -8.9045 -5.4068 -5.4068 -5.3194 -5.3194 -5.3117 -5.3117 -5.1918 -5.1918 -4.8652 -4.8652 -4.6692 -4.6692 -4.6520 -4.6520 -4.6105 -4.6105 -2.9949 -2.9949 -2.8599 -2.8599 -2.6430 -2.6430 -2.6286 -2.6286 -2.2569 -2.2569 -1.8640 -1.8640 -1.7850 -1.7850 -1.7754 -1.7754 -1.4409 -1.4409 -0.2790 -0.2790 0.9359 0.9359 0.9427 0.9427 7.3374 7.3374 7.5148 7.5148 7.5684 7.5684 7.5688 7.5688 9.1238 9.1238 10.0561 10.0561 k = 0.5000 0.5000 0.1333 ( 6352 PWs) bands (ev): -25.2675 -25.2675 -25.0792 -25.0792 -24.9115 -24.9115 -24.9104 -24.9104 -22.1208 -22.1208 -21.7240 -21.7240 -21.4449 -21.4449 -21.4428 -21.4428 -10.3958 -10.3958 -9.5907 -9.5907 -8.9051 -8.9051 -8.9036 -8.9036 -5.4216 -5.4216 -5.3374 -5.3374 -5.3287 -5.3287 -5.1787 -5.1787 -4.8796 -4.8796 -4.6491 -4.6491 -4.6311 -4.6311 -4.5906 -4.5906 -3.0012 -3.0012 -2.8492 -2.8492 -2.6543 -2.6543 -2.6383 -2.6383 -2.2866 -2.2866 -1.8403 -1.8403 -1.7738 -1.7738 -1.7636 -1.7636 -1.5209 -1.5209 -0.1997 -0.1997 0.9308 0.9308 0.9385 0.9385 7.3328 7.3328 7.5389 7.5389 7.5846 7.5846 7.5851 7.5851 9.0543 9.0543 10.0826 10.0826 k = 0.5000 0.5000 0.1500 ( 6352 PWs) bands (ev): -25.2774 -25.2774 -25.0669 -25.0669 -24.9116 -24.9116 -24.9103 -24.9103 -22.1448 -22.1448 -21.7016 -21.7016 -21.4450 -21.4450 -21.4427 -21.4427 -10.4390 -10.4390 -9.5392 -9.5392 -8.9043 -8.9043 -8.9025 -8.9025 -5.4362 -5.4362 -5.3561 -5.3561 -5.3465 -5.3465 -5.1661 -5.1661 -4.8936 -4.8936 -4.6280 -4.6280 -4.6093 -4.6093 -4.5706 -4.5706 -3.0068 -3.0068 -2.8386 -2.8386 -2.6665 -2.6665 -2.6489 -2.6489 -2.3160 -2.3160 -1.8175 -1.8175 -1.7614 -1.7614 -1.7510 -1.7510 -1.5998 -1.5998 -0.1218 -0.1218 0.9252 0.9252 0.9338 0.9338 7.3286 7.3286 7.5649 7.5649 7.6030 7.6030 7.6035 7.6035 8.9862 8.9862 10.0914 10.0914 k = 0.5000 0.5000 0.1667 ( 6344 PWs) bands (ev): -25.2869 -25.2869 -25.0548 -25.0548 -24.9116 -24.9116 -24.9102 -24.9102 -22.1682 -22.1682 -21.6798 -21.6798 -21.4452 -21.4452 -21.4426 -21.4426 -10.4807 -10.4807 -9.4885 -9.4885 -8.9033 -8.9033 -8.9014 -8.9014 -5.4504 -5.4504 -5.3750 -5.3750 -5.3649 -5.3649 -5.1539 -5.1539 -4.9069 -4.9069 -4.6063 -4.6063 -4.5868 -4.5868 -4.5506 -4.5506 -3.0115 -3.0115 -2.8282 -2.8282 -2.6793 -2.6793 -2.6603 -2.6603 -2.3451 -2.3451 -1.7957 -1.7957 -1.7480 -1.7480 -1.7377 -1.7377 -1.6773 -1.6773 -0.0456 -0.0456 0.9192 0.9192 0.9286 0.9286 7.3249 7.3249 7.5927 7.5927 7.6234 7.6234 7.6240 7.6240 8.9198 8.9198 10.0815 10.0815 k = 0.5000 0.5000 0.1833 ( 6360 PWs) bands (ev): -25.2960 -25.2960 -25.0429 -25.0429 -24.9116 -24.9116 -24.9101 -24.9101 -22.1910 -22.1910 -21.6587 -21.6587 -21.4454 -21.4454 -21.4426 -21.4426 -10.5210 -10.5210 -9.4386 -9.4386 -8.9023 -8.9023 -8.9002 -8.9002 -5.4643 -5.4643 -5.3940 -5.3940 -5.3835 -5.3835 -5.1423 -5.1423 -4.9198 -4.9198 -4.5841 -4.5841 -4.5640 -4.5640 -4.5306 -4.5306 -3.0153 -3.0153 -2.8181 -2.8181 -2.6925 -2.6925 -2.6723 -2.6723 -2.3739 -2.3739 -1.7751 -1.7751 -1.7535 -1.7535 -1.7336 -1.7336 -1.7238 -1.7238 0.0288 0.0288 0.9128 0.9128 0.9231 0.9231 7.3215 7.3215 7.6224 7.6224 7.6458 7.6458 7.6464 7.6464 8.8553 8.8553 10.0545 10.0545 k = 0.5000 0.5000 0.2000 ( 6360 PWs) bands (ev): -25.3047 -25.3047 -25.0313 -25.0313 -24.9117 -24.9117 -24.9100 -24.9100 -22.2133 -22.2133 -21.6383 -21.6383 -21.4455 -21.4455 -21.4425 -21.4425 -10.5596 -10.5596 -9.3898 -9.3898 -8.9013 -8.9013 -8.8990 -8.8990 -5.4777 -5.4777 -5.4128 -5.4128 -5.4020 -5.4020 -5.1312 -5.1312 -4.9320 -4.9320 -4.5618 -4.5618 -4.5410 -4.5410 -4.5108 -4.5108 -3.0182 -3.0182 -2.8082 -2.8082 -2.7061 -2.7061 -2.6847 -2.6847 -2.4022 -2.4022 -1.8279 -1.8279 -1.7557 -1.7557 -1.7186 -1.7186 -1.7097 -1.7097 0.1011 0.1011 0.9062 0.9062 0.9172 0.9172 7.3184 7.3184 7.6541 7.6541 7.6702 7.6702 7.6709 7.6709 8.7928 8.7928 10.0138 10.0138 k = 0.5000 0.5000 0.2167 ( 6368 PWs) bands (ev): -25.3131 -25.3131 -25.0199 -25.0199 -24.9117 -24.9117 -24.9099 -24.9099 -22.2348 -22.2348 -21.6187 -21.6187 -21.4457 -21.4457 -21.4425 -21.4425 -10.5966 -10.5966 -9.3421 -9.3421 -8.9002 -8.9002 -8.8978 -8.8978 -5.4907 -5.4907 -5.4313 -5.4313 -5.4204 -5.4204 -5.1208 -5.1208 -4.9436 -4.9436 -4.5396 -4.5396 -4.5182 -4.5182 -4.4911 -4.4911 -3.0200 -3.0200 -2.7987 -2.7987 -2.7199 -2.7199 -2.6973 -2.6973 -2.4300 -2.4300 -1.9006 -1.9006 -1.7374 -1.7374 -1.7031 -1.7031 -1.6954 -1.6954 0.1712 0.1712 0.8993 0.8993 0.9111 0.9111 7.3155 7.3155 7.6877 7.6877 7.6965 7.6965 7.6972 7.6972 8.7327 8.7327 9.9630 9.9630 k = 0.5000 0.5000 0.2333 ( 6360 PWs) bands (ev): -25.3210 -25.3210 -25.0088 -25.0088 -24.9117 -24.9117 -24.9099 -24.9099 -22.2555 -22.2555 -21.6000 -21.6000 -21.4458 -21.4458 -21.4424 -21.4424 -10.6318 -10.6318 -9.2958 -9.2958 -8.8991 -8.8991 -8.8965 -8.8965 -5.5032 -5.5032 -5.4493 -5.4493 -5.4383 -5.4383 -5.1111 -5.1111 -4.9547 -4.9547 -4.5176 -4.5176 -4.4955 -4.4955 -4.4717 -4.4717 -3.0206 -3.0206 -2.7897 -2.7897 -2.7337 -2.7337 -2.7100 -2.7100 -2.4571 -2.4571 -1.9714 -1.9714 -1.7201 -1.7201 -1.6873 -1.6873 -1.6810 -1.6810 0.2389 0.2389 0.8922 0.8922 0.9048 0.9048 7.3126 7.3126 7.7231 7.7231 7.7248 7.7248 7.7254 7.7254 8.6750 8.6750 9.9051 9.9051 k = 0.5000 0.5000 0.2500 ( 6360 PWs) bands (ev): -25.3285 -25.3285 -24.9981 -24.9981 -24.9118 -24.9118 -24.9098 -24.9098 -22.2753 -22.2753 -21.5821 -21.5821 -21.4460 -21.4460 -21.4424 -21.4424 -10.6653 -10.6653 -9.2511 -9.2511 -8.8979 -8.8979 -8.8952 -8.8952 -5.5152 -5.5152 -5.4667 -5.4667 -5.4557 -5.4557 -5.1020 -5.1020 -4.9651 -4.9651 -4.4960 -4.4960 -4.4733 -4.4733 -4.4526 -4.4526 -3.0201 -3.0201 -2.7813 -2.7813 -2.7475 -2.7475 -2.7224 -2.7224 -2.4835 -2.4835 -2.0402 -2.0402 -1.7039 -1.7039 -1.6716 -1.6716 -1.6668 -1.6668 0.3038 0.3038 0.8850 0.8850 0.8983 0.8983 7.3098 7.3098 7.7546 7.7546 7.7553 7.7553 7.7605 7.7605 8.6200 8.6200 9.8399 9.8399 k = 0.5000 0.5000 0.2667 ( 6376 PWs) bands (ev): -25.3355 -25.3355 -24.9879 -24.9879 -24.9118 -24.9118 -24.9097 -24.9097 -22.2943 -22.2943 -21.5652 -21.5652 -21.4461 -21.4461 -21.4423 -21.4423 -10.6969 -10.6969 -9.2082 -9.2082 -8.8968 -8.8968 -8.8939 -8.8939 -5.5267 -5.5267 -5.4834 -5.4834 -5.4725 -5.4725 -5.0936 -5.0936 -4.9749 -4.9749 -4.4750 -4.4750 -4.4518 -4.4518 -4.4340 -4.4340 -3.0183 -3.0183 -2.7739 -2.7739 -2.7611 -2.7611 -2.7341 -2.7341 -2.5089 -2.5089 -2.1069 -2.1069 -1.6885 -1.6885 -1.6562 -1.6562 -1.6528 -1.6528 0.3659 0.3659 0.8778 0.8778 0.8918 0.8918 7.3069 7.3069 7.7863 7.7863 7.7869 7.7869 7.7997 7.7997 8.5680 8.5680 9.7629 9.7630 k = 0.5000 0.5000 0.2833 ( 6376 PWs) bands (ev): -25.3422 -25.3422 -24.9780 -24.9780 -24.9118 -24.9118 -24.9096 -24.9096 -22.3123 -22.3123 -21.5492 -21.5492 -21.4462 -21.4462 -21.4423 -21.4423 -10.7266 -10.7266 -9.1672 -9.1672 -8.8956 -8.8956 -8.8926 -8.8926 -5.5376 -5.5376 -5.4992 -5.4992 -5.4885 -5.4885 -5.0858 -5.0858 -4.9840 -4.9840 -4.4548 -4.4548 -4.4309 -4.4309 -4.4160 -4.4160 -3.0151 -3.0151 -2.7743 -2.7743 -2.7690 -2.7690 -2.7435 -2.7435 -2.5334 -2.5334 -2.1714 -2.1714 -1.6739 -1.6739 -1.6413 -1.6413 -1.6391 -1.6391 0.4249 0.4249 0.8707 0.8707 0.8854 0.8854 7.3040 7.3040 7.8194 7.8194 7.8200 7.8200 7.8405 7.8405 8.5189 8.5189 9.6856 9.6857 k = 0.5000 0.5000 0.3000 ( 6376 PWs) bands (ev): -25.3483 -25.3483 -24.9687 -24.9687 -24.9118 -24.9118 -24.9096 -24.9096 -22.3292 -22.3292 -21.5343 -21.5343 -21.4463 -21.4463 -21.4423 -21.4423 -10.7543 -10.7543 -9.1283 -9.1283 -8.8945 -8.8945 -8.8914 -8.8914 -5.5479 -5.5479 -5.5140 -5.5140 -5.5037 -5.5037 -5.0788 -5.0788 -4.9925 -4.9925 -4.4355 -4.4355 -4.4110 -4.4110 -4.3986 -4.3986 -3.0105 -3.0105 -2.7872 -2.7872 -2.7706 -2.7706 -2.7465 -2.7465 -2.5567 -2.5567 -2.2336 -2.2336 -1.6602 -1.6602 -1.6272 -1.6272 -1.6259 -1.6259 0.4805 0.4805 0.8638 0.8638 0.8790 0.8790 7.3009 7.3009 7.8539 7.8539 7.8545 7.8545 7.8830 7.8830 8.4730 8.4730 9.6095 9.6096 k = 0.5000 0.5000 0.3167 ( 6356 PWs) bands (ev): -25.3540 -25.3540 -24.9600 -24.9600 -24.9118 -24.9118 -24.9095 -24.9095 -22.3451 -22.3451 -21.5204 -21.5204 -21.4464 -21.4464 -21.4422 -21.4422 -10.7800 -10.7800 -9.0917 -9.0917 -8.8934 -8.8934 -8.8902 -8.8902 -5.5577 -5.5577 -5.5277 -5.5277 -5.5179 -5.5179 -5.0724 -5.0724 -5.0003 -5.0003 -4.4172 -4.4172 -4.3921 -4.3921 -4.3819 -4.3819 -3.0045 -3.0045 -2.7994 -2.7994 -2.7785 -2.7785 -2.7431 -2.7431 -2.5788 -2.5788 -2.2933 -2.2933 -1.6472 -1.6472 -1.6138 -1.6138 -1.6133 -1.6133 0.5327 0.5327 0.8570 0.8570 0.8728 0.8728 7.2978 7.2978 7.8896 7.8896 7.8902 7.8902 7.9269 7.9269 8.4305 8.4305 9.5350 9.5350 k = 0.5000 0.5000 0.3333 ( 6380 PWs) bands (ev): -25.3592 -25.3592 -24.9518 -24.9518 -24.9118 -24.9118 -24.9094 -24.9094 -22.3598 -22.3598 -21.5076 -21.5076 -21.4465 -21.4465 -21.4422 -21.4422 -10.8036 -10.8036 -9.0576 -9.0576 -8.8924 -8.8924 -8.8890 -8.8890 -5.5669 -5.5669 -5.5403 -5.5403 -5.5311 -5.5311 -5.0668 -5.0668 -5.0075 -5.0075 -4.4001 -4.4001 -4.3743 -4.3743 -4.3662 -4.3662 -2.9969 -2.9969 -2.8110 -2.8110 -2.7884 -2.7884 -2.7379 -2.7379 -2.5995 -2.5995 -2.3505 -2.3505 -1.6352 -1.6352 -1.6015 -1.6015 -1.6014 -1.6014 0.5810 0.5810 0.8506 0.8506 0.8668 0.8668 7.2945 7.2945 7.9263 7.9263 7.9268 7.9268 7.9720 7.9720 8.3915 8.3915 9.4625 9.4626 k = 0.5000 0.5000 0.3500 ( 6372 PWs) bands (ev): -25.3640 -25.3640 -24.9443 -24.9443 -24.9118 -24.9118 -24.9094 -24.9094 -22.3733 -22.3733 -21.4960 -21.4960 -21.4466 -21.4466 -21.4422 -21.4422 -10.8251 -10.8251 -9.0261 -9.0261 -8.8914 -8.8914 -8.8880 -8.8880 -5.5755 -5.5755 -5.5516 -5.5516 -5.5433 -5.5433 -5.0617 -5.0617 -5.0140 -5.0140 -4.3842 -4.3842 -4.3579 -4.3579 -4.3515 -4.3515 -2.9877 -2.9877 -2.8218 -2.8218 -2.7983 -2.7983 -2.7324 -2.7324 -2.6188 -2.6188 -2.4051 -2.4051 -1.6240 -1.6240 -1.5904 -1.5904 -1.5900 -1.5900 0.6254 0.6254 0.8446 0.8446 0.8611 0.8611 7.2912 7.2912 7.9636 7.9636 7.9639 7.9639 8.0181 8.0181 8.3560 8.3560 9.3926 9.3926 k = 0.5000 0.5000 0.3667 ( 6356 PWs) bands (ev): -25.3682 -25.3682 -24.9375 -24.9375 -24.9117 -24.9117 -24.9093 -24.9093 -22.3855 -22.3855 -21.4855 -21.4855 -21.4466 -21.4466 -21.4422 -21.4422 -10.8444 -10.8444 -8.9974 -8.9974 -8.8904 -8.8904 -8.8869 -8.8869 -5.5835 -5.5835 -5.5616 -5.5616 -5.5543 -5.5543 -5.0573 -5.0573 -5.0198 -5.0198 -4.3697 -4.3697 -4.3428 -4.3428 -4.3379 -4.3379 -2.9770 -2.9770 -2.8317 -2.8317 -2.8077 -2.8077 -2.7272 -2.7272 -2.6364 -2.6364 -2.4570 -2.4570 -1.6138 -1.6138 -1.5803 -1.5803 -1.5797 -1.5797 0.6657 0.6657 0.8391 0.8391 0.8558 0.8558 7.2880 7.2880 8.0010 8.0010 8.0013 8.0013 8.0647 8.0647 8.3242 8.3242 9.3256 9.3256 k = 0.5000 0.5000 0.3833 ( 6340 PWs) bands (ev): -25.3720 -25.3720 -24.9314 -24.9314 -24.9117 -24.9117 -24.9092 -24.9092 -22.3963 -22.3963 -21.4762 -21.4762 -21.4466 -21.4466 -21.4422 -21.4422 -10.8616 -10.8616 -8.9717 -8.9717 -8.8896 -8.8896 -8.8860 -8.8860 -5.5909 -5.5909 -5.5703 -5.5703 -5.5641 -5.5641 -5.0535 -5.0535 -5.0250 -5.0250 -4.3566 -4.3566 -4.3292 -4.3292 -4.3256 -4.3256 -2.9647 -2.9647 -2.8405 -2.8405 -2.8164 -2.8164 -2.7225 -2.7225 -2.6523 -2.6523 -2.5060 -2.5060 -1.6047 -1.6047 -1.5711 -1.5711 -1.5705 -1.5705 0.7015 0.7015 0.8342 0.8342 0.8510 0.8510 7.2847 7.2847 8.0382 8.0382 8.0383 8.0383 8.1114 8.1114 8.2961 8.2961 9.2622 9.2622 k = 0.5000 0.5000 0.4000 ( 6336 PWs) bands (ev): -25.3753 -25.3753 -24.9261 -24.9261 -24.9116 -24.9116 -24.9092 -24.9092 -22.4059 -22.4059 -21.4682 -21.4682 -21.4465 -21.4465 -21.4421 -21.4421 -10.8765 -10.8765 -8.9491 -8.9491 -8.8888 -8.8888 -8.8852 -8.8852 -5.5977 -5.5977 -5.5776 -5.5776 -5.5727 -5.5727 -5.0503 -5.0503 -5.0295 -5.0295 -4.3451 -4.3451 -4.3172 -4.3172 -4.3146 -4.3146 -2.9509 -2.9509 -2.8481 -2.8481 -2.8241 -2.8241 -2.7183 -2.7183 -2.6664 -2.6664 -2.5520 -2.5520 -1.5966 -1.5966 -1.5630 -1.5630 -1.5624 -1.5624 0.7327 0.7327 0.8301 0.8301 0.8467 0.8467 7.2817 7.2817 8.0743 8.0743 8.0743 8.0743 8.1574 8.1574 8.2718 8.2718 9.2032 9.2032 k = 0.5000 0.5000 0.4167 ( 6348 PWs) bands (ev): -25.3781 -25.3781 -24.9216 -24.9216 -24.9115 -24.9115 -24.9092 -24.9092 -22.4140 -22.4140 -21.4616 -21.4616 -21.4462 -21.4462 -21.4421 -21.4421 -10.8892 -10.8892 -8.9298 -8.9298 -8.8881 -8.8881 -8.8845 -8.8845 -5.6036 -5.6036 -5.5837 -5.5837 -5.5800 -5.5800 -5.0477 -5.0477 -5.0332 -5.0332 -4.3352 -4.3352 -4.3068 -4.3068 -4.3051 -4.3051 -2.9360 -2.9360 -2.8543 -2.8543 -2.8308 -2.8308 -2.7147 -2.7147 -2.6786 -2.6786 -2.5949 -2.5949 -1.5897 -1.5897 -1.5560 -1.5560 -1.5555 -1.5555 0.7589 0.7589 0.8269 0.8269 0.8429 0.8429 7.2789 7.2789 8.1084 8.1084 8.1085 8.1085 8.2017 8.2017 8.2512 8.2512 9.1496 9.1496 k = 0.5000 0.5000 0.4333 ( 6356 PWs) bands (ev): -25.3804 -25.3804 -24.9180 -24.9180 -24.9113 -24.9113 -24.9091 -24.9091 -22.4207 -22.4207 -21.4564 -21.4564 -21.4458 -21.4458 -21.4421 -21.4421 -10.8996 -10.8996 -8.9139 -8.9139 -8.8874 -8.8874 -8.8839 -8.8839 -5.6086 -5.6086 -5.5885 -5.5885 -5.5860 -5.5860 -5.0456 -5.0456 -5.0364 -5.0364 -4.3270 -4.3270 -4.2983 -4.2983 -4.2972 -4.2972 -2.9205 -2.9205 -2.8586 -2.8586 -2.8364 -2.8364 -2.7117 -2.7117 -2.6886 -2.6886 -2.6342 -2.6342 -1.5840 -1.5840 -1.5502 -1.5502 -1.5499 -1.5499 0.7795 0.7795 0.8252 0.8252 0.8398 0.8398 7.2764 7.2764 8.1394 8.1394 8.1397 8.1397 8.2344 8.2344 8.2430 8.2430 9.1024 9.1024 k = 0.5000 0.5000 0.4500 ( 6348 PWs) bands (ev): -25.3821 -25.3821 -24.9155 -24.9155 -24.9108 -24.9108 -24.9091 -24.9091 -22.4260 -22.4260 -21.4528 -21.4528 -21.4449 -21.4449 -21.4421 -21.4421 -10.9078 -10.9078 -8.9016 -8.9016 -8.8868 -8.8868 -8.8834 -8.8834 -5.6126 -5.6126 -5.5922 -5.5922 -5.5908 -5.5908 -5.0439 -5.0439 -5.0388 -5.0388 -4.3205 -4.3205 -4.2916 -4.2916 -4.2910 -4.2910 -2.9059 -2.9059 -2.8600 -2.8600 -2.8409 -2.8409 -2.7094 -2.7094 -2.6967 -2.6967 -2.6692 -2.6692 -1.5795 -1.5795 -1.5456 -1.5456 -1.5454 -1.5454 0.7938 0.7938 0.8258 0.8258 0.8373 0.8373 7.2744 7.2744 8.1659 8.1659 8.1664 8.1664 8.2213 8.2213 8.2793 8.2793 9.0631 9.0631 k = 0.5000 0.5000 0.4667 ( 6320 PWs) bands (ev): -25.3834 -25.3834 -24.9140 -24.9140 -24.9100 -24.9100 -24.9091 -24.9091 -22.4297 -22.4297 -21.4509 -21.4509 -21.4436 -21.4436 -21.4421 -21.4421 -10.9135 -10.9135 -8.8932 -8.8932 -8.8858 -8.8858 -8.8831 -8.8831 -5.6155 -5.6155 -5.5948 -5.5948 -5.5941 -5.5941 -5.0428 -5.0428 -5.0405 -5.0405 -4.3158 -4.3158 -4.2867 -4.2867 -4.2864 -4.2864 -2.8950 -2.8950 -2.8569 -2.8569 -2.8441 -2.8441 -2.7077 -2.7077 -2.7037 -2.7037 -2.6976 -2.6976 -1.5763 -1.5763 -1.5423 -1.5423 -1.5422 -1.5422 0.8013 0.8013 0.8290 0.8290 0.8355 0.8355 7.2729 7.2729 8.1865 8.1865 8.1871 8.1871 8.2120 8.2120 8.3082 8.3082 9.0331 9.0331 k = 0.5000 0.5000 0.4833 ( 6276 PWs) bands (ev): -25.3841 -25.3841 -24.9134 -24.9134 -24.9093 -24.9093 -24.9090 -24.9090 -22.4319 -22.4319 -21.4501 -21.4501 -21.4425 -21.4425 -21.4421 -21.4421 -10.9170 -10.9170 -8.8894 -8.8894 -8.8839 -8.8839 -8.8828 -8.8828 -5.6173 -5.6173 -5.5963 -5.5963 -5.5962 -5.5962 -5.0421 -5.0421 -5.0415 -5.0415 -4.3130 -4.3130 -4.2838 -4.2838 -4.2837 -4.2837 -2.8897 -2.8897 -2.8503 -2.8503 -2.8460 -2.8460 -2.7210 -2.7210 -2.7067 -2.7067 -2.7050 -2.7050 -1.5744 -1.5744 -1.5403 -1.5403 -1.5403 -1.5403 0.8041 0.8041 0.8326 0.8326 0.8345 0.8345 7.2720 7.2720 8.1996 8.1996 8.2003 8.2003 8.2064 8.2064 8.3271 8.3271 9.0140 9.0140 k = 0.5000 0.5000 0.5000 ( 6272 PWs) bands (ev): -25.3843 -25.3843 -24.9133 -24.9133 -24.9090 -24.9090 -24.9090 -24.9090 -22.4327 -22.4327 -21.4499 -21.4499 -21.4421 -21.4421 -21.4421 -21.4421 -10.9181 -10.9181 -8.8886 -8.8886 -8.8828 -8.8828 -8.8828 -8.8828 -5.6179 -5.6179 -5.5968 -5.5968 -5.5968 -5.5968 -5.0418 -5.0418 -5.0418 -5.0418 -4.3121 -4.3121 -4.2828 -4.2828 -4.2828 -4.2828 -2.8883 -2.8883 -2.8466 -2.8466 -2.8466 -2.8466 -2.7291 -2.7291 -2.7063 -2.7063 -2.7063 -2.7063 -1.5737 -1.5737 -1.5397 -1.5397 -1.5397 -1.5397 0.8047 0.8047 0.8341 0.8341 0.8341 0.8341 7.2717 7.2717 8.2037 8.2037 8.2049 8.2049 8.2049 8.2049 8.3337 8.3337 9.0072 9.0072 Writing output data file SiF4.save init_run : 0.22s CPU 0.47s WALL ( 1 calls) electrons : 186.57s CPU 189.33s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.07s WALL ( 1 calls) potinit : 0.02s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 186.56s CPU 189.32s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.05s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.07s WALL ( 231 calls) cegterg : 172.12s CPU 174.05s WALL ( 268 calls) Called by sum_band: Called by *egterg: h_psi : 96.20s CPU 97.29s WALL ( 4590 calls) s_psi : 5.76s CPU 5.91s WALL ( 4590 calls) g_psi : 0.36s CPU 0.33s WALL ( 4091 calls) cdiaghg : 56.70s CPU 57.32s WALL ( 4322 calls) cegterg:over : 10.11s CPU 9.85s WALL ( 4091 calls) cegterg:upda : 7.50s CPU 7.95s WALL ( 4091 calls) cegterg:last : 4.34s CPU 4.42s WALL ( 730 calls) cdiaghg:chol : 3.07s CPU 3.36s WALL ( 4322 calls) cdiaghg:inve : 2.36s CPU 2.43s WALL ( 4322 calls) cdiaghg:para : 4.42s CPU 4.26s WALL ( 8644 calls) Called by h_psi: h_psi:vloc : 82.08s CPU 83.20s WALL ( 4590 calls) h_psi:vnl : 13.84s CPU 13.80s WALL ( 4590 calls) add_vuspsi : 6.70s CPU 6.71s WALL ( 4590 calls) General routines calbec : 7.12s CPU 7.08s WALL ( 4590 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 76.65s CPU 77.91s WALL ( 717992 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.24s CPU 0.30s WALL ( 462 calls) Parallel routines fft_scatter : 27.21s CPU 27.85s WALL ( 718015 calls) PWSCF : 3m26.56s CPU 3m41.37s WALL This run was terminated on: 17:55: 3 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=