Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 20:31:36 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: ./Zn3As2.save/ file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 73 48 13 2838 1496 229 Max 75 49 14 2843 1511 236 Sum 2637 1741 497 102255 54171 8385 bravais-lattice index = 14 lattice parameter (alat) = 10.9793 a.u. unit-cell volume = 1323.5029 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 2 number of electrons = 92.00 number of Kohn-Sham states= 110 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 276.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.979308 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 As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 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 Zn read from file: /users/gautes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8d14e5a70806ad8c3d477ea097862760 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1201 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 As 5.00 74.92160 As( 1.00) Zn 12.00 65.40900 Zn( 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= 215 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0046512 k( 2) = ( 0.0000000 0.0178571 -0.0000000), wk = 0.0046512 k( 3) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0046512 k( 4) = ( 0.0000000 0.0535714 -0.0000000), wk = 0.0046512 k( 5) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0046512 k( 6) = ( 0.0000000 0.0892857 -0.0000000), wk = 0.0046512 k( 7) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0046512 k( 8) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0046512 k( 9) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0046512 k( 10) = ( 0.0000000 0.1607143 -0.0000000), wk = 0.0046512 k( 11) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0046512 k( 12) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0046512 k( 13) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0046512 k( 14) = ( 0.0000000 0.2321429 -0.0000000), wk = 0.0046512 k( 15) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0046512 k( 16) = ( 0.0000000 0.2678571 -0.0000000), wk = 0.0046512 k( 17) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0046512 k( 18) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0046512 k( 19) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0046512 k( 20) = ( 0.0000000 0.3392857 -0.0000000), wk = 0.0046512 k( 21) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0046512 k( 22) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0046512 k( 23) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0046512 k( 24) = ( 0.0000000 0.4107143 -0.0000000), wk = 0.0046512 k( 25) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0046512 k( 26) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0046512 k( 27) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0046512 k( 28) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0046512 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0046512 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0046512 k( 31) = ( 0.0178571 0.5000000 -0.0000000), wk = 0.0046512 k( 32) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0046512 k( 33) = ( 0.0535714 0.5000000 -0.0000000), wk = 0.0046512 k( 34) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0046512 k( 35) = ( 0.0892857 0.5000000 -0.0000000), wk = 0.0046512 k( 36) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0046512 k( 37) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0046512 k( 38) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0046512 k( 39) = ( 0.1607143 0.5000000 -0.0000000), wk = 0.0046512 k( 40) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0046512 k( 41) = ( 0.1964286 0.5000000 -0.0000000), wk = 0.0046512 k( 42) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0046512 k( 43) = ( 0.2321429 0.5000000 -0.0000000), wk = 0.0046512 k( 44) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0046512 k( 45) = ( 0.2678571 0.5000000 -0.0000000), wk = 0.0046512 k( 46) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0046512 k( 47) = ( 0.3035714 0.5000000 -0.0000000), wk = 0.0046512 k( 48) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0046512 k( 49) = ( 0.3392857 0.5000000 -0.0000000), wk = 0.0046512 k( 50) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0046512 k( 51) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0046512 k( 52) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0046512 k( 53) = ( 0.4107143 0.5000000 -0.0000000), wk = 0.0046512 k( 54) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0046512 k( 55) = ( 0.4464286 0.5000000 -0.0000000), wk = 0.0046512 k( 56) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0046512 k( 57) = ( 0.4821429 0.5000000 -0.0000000), wk = 0.0046512 k( 58) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0046512 k( 59) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0046512 k( 60) = ( 0.4871795 0.4871795 -0.0000000), wk = 0.0046512 k( 61) = ( 0.4743590 0.4743590 -0.0000000), wk = 0.0046512 k( 62) = ( 0.4615385 0.4615385 -0.0000000), wk = 0.0046512 k( 63) = ( 0.4487179 0.4487179 -0.0000000), wk = 0.0046512 k( 64) = ( 0.4358974 0.4358974 -0.0000000), wk = 0.0046512 k( 65) = ( 0.4230769 0.4230769 -0.0000000), wk = 0.0046512 k( 66) = ( 0.4102564 0.4102564 -0.0000000), wk = 0.0046512 k( 67) = ( 0.3974359 0.3974359 -0.0000000), wk = 0.0046512 k( 68) = ( 0.3846154 0.3846154 -0.0000000), wk = 0.0046512 k( 69) = ( 0.3717949 0.3717949 -0.0000000), wk = 0.0046512 k( 70) = ( 0.3589744 0.3589744 -0.0000000), wk = 0.0046512 k( 71) = ( 0.3461538 0.3461538 -0.0000000), wk = 0.0046512 k( 72) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0046512 k( 73) = ( 0.3205128 0.3205128 -0.0000000), wk = 0.0046512 k( 74) = ( 0.3076923 0.3076923 -0.0000000), wk = 0.0046512 k( 75) = ( 0.2948718 0.2948718 -0.0000000), wk = 0.0046512 k( 76) = ( 0.2820513 0.2820513 -0.0000000), wk = 0.0046512 k( 77) = ( 0.2692308 0.2692308 -0.0000000), wk = 0.0046512 k( 78) = ( 0.2564103 0.2564103 -0.0000000), wk = 0.0046512 k( 79) = ( 0.2435897 0.2435897 -0.0000000), wk = 0.0046512 k( 80) = ( 0.2307692 0.2307692 -0.0000000), wk = 0.0046512 k( 81) = ( 0.2179487 0.2179487 -0.0000000), wk = 0.0046512 k( 82) = ( 0.2051282 0.2051282 -0.0000000), wk = 0.0046512 k( 83) = ( 0.1923077 0.1923077 -0.0000000), wk = 0.0046512 k( 84) = ( 0.1794872 0.1794872 -0.0000000), wk = 0.0046512 k( 85) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0046512 k( 86) = ( 0.1538461 0.1538461 -0.0000000), wk = 0.0046512 k( 87) = ( 0.1410256 0.1410256 -0.0000000), wk = 0.0046512 k( 88) = ( 0.1282051 0.1282051 -0.0000000), wk = 0.0046512 k( 89) = ( 0.1153846 0.1153846 -0.0000000), wk = 0.0046512 k( 90) = ( 0.1025641 0.1025641 -0.0000000), wk = 0.0046512 k( 91) = ( 0.0897436 0.0897436 -0.0000000), wk = 0.0046512 k( 92) = ( 0.0769231 0.0769231 -0.0000000), wk = 0.0046512 k( 93) = ( 0.0641026 0.0641026 -0.0000000), wk = 0.0046512 k( 94) = ( 0.0512821 0.0512820 -0.0000000), wk = 0.0046512 k( 95) = ( 0.0384615 0.0384615 -0.0000000), wk = 0.0046512 k( 96) = ( 0.0256410 0.0256410 -0.0000000), wk = 0.0046512 k( 97) = ( 0.0128205 0.0128205 -0.0000000), wk = 0.0046512 k( 98) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0046512 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0046512 k( 100) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0046512 k( 101) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0046512 k( 102) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0046512 k( 103) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0046512 k( 104) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0046512 k( 105) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0046512 k( 106) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0046512 k( 107) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0046512 k( 108) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0046512 k( 109) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0046512 k( 110) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0046512 k( 111) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0046512 k( 112) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0046512 k( 113) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0046512 k( 114) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0046512 k( 115) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0046512 k( 116) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0046512 k( 117) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0046512 k( 118) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0046512 k( 119) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0046512 k( 120) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0046512 k( 121) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0046512 k( 122) = ( 0.2446809 0.2446808 0.2446808), wk = 0.0046512 k( 123) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0046512 k( 124) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0046512 k( 125) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0046512 k( 126) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0046512 k( 127) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0046512 k( 128) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0046512 k( 129) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0046512 k( 130) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0046512 k( 131) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0046512 k( 132) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0046512 k( 133) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0046512 k( 134) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0046512 k( 135) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0046512 k( 136) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0046512 k( 137) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0046512 k( 138) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0046512 k( 139) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0046512 k( 140) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0046512 k( 141) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0046512 k( 142) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0046512 k( 143) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0046512 k( 144) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0046512 k( 145) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0046512 k( 146) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0046512 k( 147) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0046512 k( 148) = ( 0.4871795 0.5000000 0.4871795), wk = 0.0046512 k( 149) = ( 0.4743590 0.5000000 0.4743590), wk = 0.0046512 k( 150) = ( 0.4615385 0.5000000 0.4615385), wk = 0.0046512 k( 151) = ( 0.4487179 0.5000000 0.4487179), wk = 0.0046512 k( 152) = ( 0.4358974 0.5000000 0.4358974), wk = 0.0046512 k( 153) = ( 0.4230769 0.5000000 0.4230769), wk = 0.0046512 k( 154) = ( 0.4102564 0.5000000 0.4102564), wk = 0.0046512 k( 155) = ( 0.3974359 0.5000000 0.3974359), wk = 0.0046512 k( 156) = ( 0.3846154 0.5000000 0.3846154), wk = 0.0046512 k( 157) = ( 0.3717949 0.5000000 0.3717949), wk = 0.0046512 k( 158) = ( 0.3589744 0.5000000 0.3589744), wk = 0.0046512 k( 159) = ( 0.3461538 0.5000000 0.3461538), wk = 0.0046512 k( 160) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0046512 k( 161) = ( 0.3205128 0.5000000 0.3205128), wk = 0.0046512 k( 162) = ( 0.3076923 0.5000000 0.3076923), wk = 0.0046512 k( 163) = ( 0.2948718 0.5000000 0.2948718), wk = 0.0046512 k( 164) = ( 0.2820513 0.5000000 0.2820513), wk = 0.0046512 k( 165) = ( 0.2692308 0.5000000 0.2692308), wk = 0.0046512 k( 166) = ( 0.2564103 0.5000000 0.2564103), wk = 0.0046512 k( 167) = ( 0.2435897 0.5000000 0.2435897), wk = 0.0046512 k( 168) = ( 0.2307692 0.5000000 0.2307692), wk = 0.0046512 k( 169) = ( 0.2179487 0.5000000 0.2179487), wk = 0.0046512 k( 170) = ( 0.2051282 0.5000000 0.2051282), wk = 0.0046512 k( 171) = ( 0.1923077 0.5000000 0.1923077), wk = 0.0046512 k( 172) = ( 0.1794872 0.5000000 0.1794872), wk = 0.0046512 k( 173) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0046512 k( 174) = ( 0.1538461 0.5000000 0.1538461), wk = 0.0046512 k( 175) = ( 0.1410256 0.5000000 0.1410256), wk = 0.0046512 k( 176) = ( 0.1282051 0.5000000 0.1282051), wk = 0.0046512 k( 177) = ( 0.1153846 0.5000000 0.1153846), wk = 0.0046512 k( 178) = ( 0.1025641 0.5000000 0.1025641), wk = 0.0046512 k( 179) = ( 0.0897436 0.5000000 0.0897436), wk = 0.0046512 k( 180) = ( 0.0769231 0.5000000 0.0769231), wk = 0.0046512 k( 181) = ( 0.0641026 0.5000000 0.0641026), wk = 0.0046512 k( 182) = ( 0.0512821 0.5000000 0.0512820), wk = 0.0046512 k( 183) = ( 0.0384615 0.5000000 0.0384615), wk = 0.0046512 k( 184) = ( 0.0256410 0.5000000 0.0256410), wk = 0.0046512 k( 185) = ( 0.0128205 0.5000000 0.0128205), wk = 0.0046512 k( 186) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0046512 k( 187) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0046512 k( 188) = ( 0.5000000 0.5000000 0.0178571), wk = 0.0046512 k( 189) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0046512 k( 190) = ( 0.5000000 0.5000000 0.0535714), wk = 0.0046512 k( 191) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0046512 k( 192) = ( 0.5000000 0.5000000 0.0892857), wk = 0.0046512 k( 193) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0046512 k( 194) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0046512 k( 195) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0046512 k( 196) = ( 0.5000000 0.5000000 0.1607143), wk = 0.0046512 k( 197) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0046512 k( 198) = ( 0.5000000 0.5000000 0.1964286), wk = 0.0046512 k( 199) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0046512 k( 200) = ( 0.5000000 0.5000000 0.2321429), wk = 0.0046512 k( 201) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0046512 k( 202) = ( 0.5000000 0.5000000 0.2678571), wk = 0.0046512 k( 203) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0046512 k( 204) = ( 0.5000000 0.5000000 0.3035714), wk = 0.0046512 k( 205) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0046512 k( 206) = ( 0.5000000 0.5000000 0.3392857), wk = 0.0046512 k( 207) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0046512 k( 208) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0046512 k( 209) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0046512 k( 210) = ( 0.5000000 0.5000000 0.4107143), wk = 0.0046512 k( 211) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0046512 k( 212) = ( 0.5000000 0.5000000 0.4464286), wk = 0.0046512 k( 213) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0046512 k( 214) = ( 0.5000000 0.5000000 0.4821429), wk = 0.0046512 k( 215) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0046512 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0046512 k( 2) = ( 0.0000000 0.0178571 0.0000000), wk = 0.0046512 k( 3) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0046512 k( 4) = ( 0.0000000 0.0535714 0.0000000), wk = 0.0046512 k( 5) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0046512 k( 6) = ( 0.0000000 0.0892857 0.0000000), wk = 0.0046512 k( 7) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0046512 k( 8) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0046512 k( 9) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0046512 k( 10) = ( 0.0000000 0.1607143 0.0000000), wk = 0.0046512 k( 11) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0046512 k( 12) = ( 0.0000000 0.1964286 0.0000000), wk = 0.0046512 k( 13) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0046512 k( 14) = ( 0.0000000 0.2321429 0.0000000), wk = 0.0046512 k( 15) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0046512 k( 16) = ( 0.0000000 0.2678571 0.0000000), wk = 0.0046512 k( 17) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0046512 k( 18) = ( 0.0000000 0.3035714 0.0000000), wk = 0.0046512 k( 19) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0046512 k( 20) = ( 0.0000000 0.3392857 0.0000000), wk = 0.0046512 k( 21) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0046512 k( 22) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0046512 k( 23) = ( 0.0000000 0.3928571 0.0000000), wk = 0.0046512 k( 24) = ( 0.0000000 0.4107143 0.0000000), wk = 0.0046512 k( 25) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0046512 k( 26) = ( 0.0000000 0.4464286 0.0000000), wk = 0.0046512 k( 27) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0046512 k( 28) = ( 0.0000000 0.4821429 0.0000000), wk = 0.0046512 k( 29) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0046512 k( 30) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0046512 k( 31) = ( 0.0178571 0.5000000 0.0000000), wk = 0.0046512 k( 32) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0046512 k( 33) = ( 0.0535714 0.5000000 0.0000000), wk = 0.0046512 k( 34) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0046512 k( 35) = ( 0.0892857 0.5000000 0.0000000), wk = 0.0046512 k( 36) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0046512 k( 37) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0046512 k( 38) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0046512 k( 39) = ( 0.1607143 0.5000000 0.0000000), wk = 0.0046512 k( 40) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0046512 k( 41) = ( 0.1964286 0.5000000 0.0000000), wk = 0.0046512 k( 42) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0046512 k( 43) = ( 0.2321429 0.5000000 0.0000000), wk = 0.0046512 k( 44) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0046512 k( 45) = ( 0.2678571 0.5000000 0.0000000), wk = 0.0046512 k( 46) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0046512 k( 47) = ( 0.3035714 0.5000000 0.0000000), wk = 0.0046512 k( 48) = ( 0.3214286 0.5000000 0.0000000), wk = 0.0046512 k( 49) = ( 0.3392857 0.5000000 0.0000000), wk = 0.0046512 k( 50) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0046512 k( 51) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0046512 k( 52) = ( 0.3928571 0.5000000 0.0000000), wk = 0.0046512 k( 53) = ( 0.4107143 0.5000000 0.0000000), wk = 0.0046512 k( 54) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0046512 k( 55) = ( 0.4464286 0.5000000 0.0000000), wk = 0.0046512 k( 56) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0046512 k( 57) = ( 0.4821429 0.5000000 0.0000000), wk = 0.0046512 k( 58) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0046512 k( 59) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0046512 k( 60) = ( 0.4871795 0.4871795 0.0000000), wk = 0.0046512 k( 61) = ( 0.4743590 0.4743590 0.0000000), wk = 0.0046512 k( 62) = ( 0.4615385 0.4615385 0.0000000), wk = 0.0046512 k( 63) = ( 0.4487179 0.4487179 0.0000000), wk = 0.0046512 k( 64) = ( 0.4358974 0.4358974 0.0000000), wk = 0.0046512 k( 65) = ( 0.4230769 0.4230769 0.0000000), wk = 0.0046512 k( 66) = ( 0.4102564 0.4102564 -0.0000000), wk = 0.0046512 k( 67) = ( 0.3974359 0.3974359 -0.0000000), wk = 0.0046512 k( 68) = ( 0.3846154 0.3846154 0.0000000), wk = 0.0046512 k( 69) = ( 0.3717949 0.3717949 0.0000000), wk = 0.0046512 k( 70) = ( 0.3589744 0.3589744 0.0000000), wk = 0.0046512 k( 71) = ( 0.3461538 0.3461538 0.0000000), wk = 0.0046512 k( 72) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0046512 k( 73) = ( 0.3205128 0.3205128 -0.0000000), wk = 0.0046512 k( 74) = ( 0.3076923 0.3076923 -0.0000000), wk = 0.0046512 k( 75) = ( 0.2948718 0.2948718 0.0000000), wk = 0.0046512 k( 76) = ( 0.2820513 0.2820513 0.0000000), wk = 0.0046512 k( 77) = ( 0.2692308 0.2692308 0.0000000), wk = 0.0046512 k( 78) = ( 0.2564103 0.2564103 0.0000000), wk = 0.0046512 k( 79) = ( 0.2435897 0.2435897 0.0000000), wk = 0.0046512 k( 80) = ( 0.2307692 0.2307692 0.0000000), wk = 0.0046512 k( 81) = ( 0.2179487 0.2179487 0.0000000), wk = 0.0046512 k( 82) = ( 0.2051282 0.2051282 0.0000000), wk = 0.0046512 k( 83) = ( 0.1923077 0.1923077 0.0000000), wk = 0.0046512 k( 84) = ( 0.1794872 0.1794872 0.0000000), wk = 0.0046512 k( 85) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0046512 k( 86) = ( 0.1538461 0.1538461 0.0000000), wk = 0.0046512 k( 87) = ( 0.1410256 0.1410256 0.0000000), wk = 0.0046512 k( 88) = ( 0.1282051 0.1282051 0.0000000), wk = 0.0046512 k( 89) = ( 0.1153846 0.1153846 -0.0000000), wk = 0.0046512 k( 90) = ( 0.1025641 0.1025641 0.0000000), wk = 0.0046512 k( 91) = ( 0.0897436 0.0897436 0.0000000), wk = 0.0046512 k( 92) = ( 0.0769231 0.0769231 0.0000000), wk = 0.0046512 k( 93) = ( 0.0641026 0.0641026 0.0000000), wk = 0.0046512 k( 94) = ( 0.0512821 0.0512821 0.0000000), wk = 0.0046512 k( 95) = ( 0.0384615 0.0384615 0.0000000), wk = 0.0046512 k( 96) = ( 0.0256410 0.0256410 0.0000000), wk = 0.0046512 k( 97) = ( 0.0128205 0.0128205 0.0000000), wk = 0.0046512 k( 98) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0046512 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0046512 k( 100) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0046512 k( 101) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0046512 k( 102) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0046512 k( 103) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0046512 k( 104) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0046512 k( 105) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0046512 k( 106) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0046512 k( 107) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0046512 k( 108) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0046512 k( 109) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0046512 k( 110) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0046512 k( 111) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0046512 k( 112) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0046512 k( 113) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0046512 k( 114) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0046512 k( 115) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0046512 k( 116) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0046512 k( 117) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0046512 k( 118) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0046512 k( 119) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0046512 k( 120) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0046512 k( 121) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0046512 k( 122) = ( 0.2446809 0.2446809 0.2446809), wk = 0.0046512 k( 123) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0046512 k( 124) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0046512 k( 125) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0046512 k( 126) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0046512 k( 127) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0046512 k( 128) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0046512 k( 129) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0046512 k( 130) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0046512 k( 131) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0046512 k( 132) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0046512 k( 133) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0046512 k( 134) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0046512 k( 135) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0046512 k( 136) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0046512 k( 137) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0046512 k( 138) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0046512 k( 139) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0046512 k( 140) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0046512 k( 141) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0046512 k( 142) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0046512 k( 143) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0046512 k( 144) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0046512 k( 145) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0046512 k( 146) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0046512 k( 147) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0046512 k( 148) = ( 0.4871795 0.5000000 0.4871795), wk = 0.0046512 k( 149) = ( 0.4743590 0.5000000 0.4743590), wk = 0.0046512 k( 150) = ( 0.4615385 0.5000000 0.4615385), wk = 0.0046512 k( 151) = ( 0.4487179 0.5000000 0.4487179), wk = 0.0046512 k( 152) = ( 0.4358974 0.5000000 0.4358974), wk = 0.0046512 k( 153) = ( 0.4230769 0.5000000 0.4230769), wk = 0.0046512 k( 154) = ( 0.4102564 0.5000000 0.4102564), wk = 0.0046512 k( 155) = ( 0.3974359 0.5000000 0.3974359), wk = 0.0046512 k( 156) = ( 0.3846154 0.5000000 0.3846154), wk = 0.0046512 k( 157) = ( 0.3717949 0.5000000 0.3717949), wk = 0.0046512 k( 158) = ( 0.3589744 0.5000000 0.3589744), wk = 0.0046512 k( 159) = ( 0.3461538 0.5000000 0.3461538), wk = 0.0046512 k( 160) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0046512 k( 161) = ( 0.3205128 0.5000000 0.3205128), wk = 0.0046512 k( 162) = ( 0.3076923 0.5000000 0.3076923), wk = 0.0046512 k( 163) = ( 0.2948718 0.5000000 0.2948718), wk = 0.0046512 k( 164) = ( 0.2820513 0.5000000 0.2820513), wk = 0.0046512 k( 165) = ( 0.2692308 0.5000000 0.2692308), wk = 0.0046512 k( 166) = ( 0.2564103 0.5000000 0.2564103), wk = 0.0046512 k( 167) = ( 0.2435897 0.5000000 0.2435897), wk = 0.0046512 k( 168) = ( 0.2307692 0.5000000 0.2307692), wk = 0.0046512 k( 169) = ( 0.2179487 0.5000000 0.2179487), wk = 0.0046512 k( 170) = ( 0.2051282 0.5000000 0.2051282), wk = 0.0046512 k( 171) = ( 0.1923077 0.5000000 0.1923077), wk = 0.0046512 k( 172) = ( 0.1794872 0.5000000 0.1794872), wk = 0.0046512 k( 173) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0046512 k( 174) = ( 0.1538461 0.5000000 0.1538461), wk = 0.0046512 k( 175) = ( 0.1410256 0.5000000 0.1410256), wk = 0.0046512 k( 176) = ( 0.1282051 0.5000000 0.1282051), wk = 0.0046512 k( 177) = ( 0.1153846 0.5000000 0.1153846), wk = 0.0046512 k( 178) = ( 0.1025641 0.5000000 0.1025641), wk = 0.0046512 k( 179) = ( 0.0897436 0.5000000 0.0897436), wk = 0.0046512 k( 180) = ( 0.0769231 0.5000000 0.0769231), wk = 0.0046512 k( 181) = ( 0.0641026 0.5000000 0.0641026), wk = 0.0046512 k( 182) = ( 0.0512821 0.5000000 0.0512821), wk = 0.0046512 k( 183) = ( 0.0384615 0.5000000 0.0384615), wk = 0.0046512 k( 184) = ( 0.0256410 0.5000000 0.0256410), wk = 0.0046512 k( 185) = ( 0.0128205 0.5000000 0.0128205), wk = 0.0046512 k( 186) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0046512 k( 187) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0046512 k( 188) = ( 0.5000000 0.5000000 0.0178571), wk = 0.0046512 k( 189) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0046512 k( 190) = ( 0.5000000 0.5000000 0.0535714), wk = 0.0046512 k( 191) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0046512 k( 192) = ( 0.5000000 0.5000000 0.0892857), wk = 0.0046512 k( 193) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0046512 k( 194) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0046512 k( 195) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0046512 k( 196) = ( 0.5000000 0.5000000 0.1607143), wk = 0.0046512 k( 197) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0046512 k( 198) = ( 0.5000000 0.5000000 0.1964286), wk = 0.0046512 k( 199) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0046512 k( 200) = ( 0.5000000 0.5000000 0.2321429), wk = 0.0046512 k( 201) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0046512 k( 202) = ( 0.5000000 0.5000000 0.2678571), wk = 0.0046512 k( 203) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0046512 k( 204) = ( 0.5000000 0.5000000 0.3035714), wk = 0.0046512 k( 205) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0046512 k( 206) = ( 0.5000000 0.5000000 0.3392857), wk = 0.0046512 k( 207) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0046512 k( 208) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0046512 k( 209) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0046512 k( 210) = ( 0.5000000 0.5000000 0.4107143), wk = 0.0046512 k( 211) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0046512 k( 212) = ( 0.5000000 0.5000000 0.4464286), wk = 0.0046512 k( 213) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0046512 k( 214) = ( 0.5000000 0.5000000 0.4821429), wk = 0.0046512 k( 215) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0046512 Dense grid: 102255 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 54171 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.64 Mb ( 380, 110) NL pseudopotentials 0.75 Mb ( 190, 260) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2839) G-vector shells 0.00 Mb ( 568) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.55 Mb ( 380, 440) Each subspace H/S matrix 0.18 Mb ( 110, 110) Each matrix 0.87 Mb ( 260, 2, 110) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./Zn3As2.save/charge-density.dat Starting wfc are 140 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.8 secs Computing kpt #: 2 total cpu time spent up to now is 4.0 secs Computing kpt #: 3 total cpu time spent up to now is 5.2 secs Computing kpt #: 4 total cpu time spent up to now is 6.4 secs Computing kpt #: 5 total cpu time spent up to now is 7.6 secs Computing kpt #: 6 total cpu time spent up to now is 8.8 secs Computing kpt #: 7 total cpu time spent up to now is 10.1 secs Computing kpt #: 8 total cpu time spent up to now is 11.3 secs Computing kpt #: 9 total cpu time spent up to now is 12.5 secs Computing kpt #: 10 total cpu time spent up to now is 13.7 secs Computing kpt #: 11 total cpu time spent up to now is 15.0 secs Computing kpt #: 12 total cpu time spent up to now is 16.2 secs Computing kpt #: 13 total cpu time spent up to now is 17.5 secs Computing kpt #: 14 total cpu time spent up to now is 18.8 secs Computing kpt #: 15 total cpu time spent up to now is 20.1 secs Computing kpt #: 16 total cpu time spent up to now is 21.4 secs Computing kpt #: 17 total cpu time spent up to now is 22.7 secs Computing kpt #: 18 total cpu time spent up to now is 24.1 secs Computing kpt #: 19 total cpu time spent up to now is 25.5 secs Computing kpt #: 20 total cpu time spent up to now is 26.9 secs Computing kpt #: 21 total cpu time spent up to now is 28.5 secs Computing kpt #: 22 total cpu time spent up to now is 30.2 secs Computing kpt #: 23 total cpu time spent up to now is 32.0 secs Computing kpt #: 24 total cpu time spent up to now is 33.7 secs Computing kpt #: 25 total cpu time spent up to now is 35.5 secs Computing kpt #: 26 total cpu time spent up to now is 37.2 secs Computing kpt #: 27 total cpu time spent up to now is 38.9 secs Computing kpt #: 28 total cpu time spent up to now is 40.6 secs Computing kpt #: 29 total cpu time spent up to now is 42.2 secs Computing kpt #: 30 total cpu time spent up to now is 43.9 secs Computing kpt #: 31 total cpu time spent up to now is 45.6 secs Computing kpt #: 32 total cpu time spent up to now is 47.4 secs Computing kpt #: 33 total cpu time spent up to now is 49.6 secs Computing kpt #: 34 total cpu time spent up to now is 51.3 secs Computing kpt #: 35 total cpu time spent up to now is 52.9 secs Computing kpt #: 36 total cpu time spent up to now is 54.4 secs Computing kpt #: 37 total cpu time spent up to now is 56.0 secs Computing kpt #: 38 total cpu time spent up to now is 57.6 secs Computing kpt #: 39 total cpu time spent up to now is 59.4 secs Computing kpt #: 40 total cpu time spent up to now is 61.0 secs Computing kpt #: 41 total cpu time spent up to now is 62.8 secs Computing kpt #: 42 total cpu time spent up to now is 64.4 secs Computing kpt #: 43 total cpu time spent up to now is 66.1 secs Computing kpt #: 44 total cpu time spent up to now is 67.7 secs Computing kpt #: 45 total cpu time spent up to now is 69.3 secs Computing kpt #: 46 total cpu time spent up to now is 71.1 secs Computing kpt #: 47 total cpu time spent up to now is 72.9 secs Computing kpt #: 48 total cpu time spent up to now is 74.7 secs Computing kpt #: 49 total cpu time spent up to now is 76.5 secs Computing kpt #: 50 total cpu time spent up to now is 78.1 secs Computing kpt #: 51 total cpu time spent up to now is 79.9 secs Computing kpt #: 52 total cpu time spent up to now is 81.6 secs Computing kpt #: 53 total cpu time spent up to now is 83.2 secs Computing kpt #: 54 total cpu time spent up to now is 85.0 secs Computing kpt #: 55 total cpu time spent up to now is 86.8 secs Computing kpt #: 56 total cpu time spent up to now is 88.6 secs Computing kpt #: 57 total cpu time spent up to now is 90.4 secs Computing kpt #: 58 total cpu time spent up to now is 92.2 secs Computing kpt #: 59 total cpu time spent up to now is 94.0 secs Computing kpt #: 60 total cpu time spent up to now is 95.9 secs Computing kpt #: 61 total cpu time spent up to now is 97.7 secs Computing kpt #: 62 total cpu time spent up to now is 99.5 secs Computing kpt #: 63 total cpu time spent up to now is 101.1 secs Computing kpt #: 64 total cpu time spent up to now is 102.6 secs Computing kpt #: 65 total cpu time spent up to now is 104.2 secs Computing kpt #: 66 total cpu time spent up to now is 105.7 secs Computing kpt #: 67 total cpu time spent up to now is 107.2 secs Computing kpt #: 68 total cpu time spent up to now is 108.7 secs Computing kpt #: 69 total cpu time spent up to now is 110.3 secs Computing kpt #: 70 total cpu time spent up to now is 111.8 secs Computing kpt #: 71 total cpu time spent up to now is 113.4 secs Computing kpt #: 72 total cpu time spent up to now is 115.1 secs Computing kpt #: 73 total cpu time spent up to now is 116.9 secs Computing kpt #: 74 total cpu time spent up to now is 118.7 secs Computing kpt #: 75 total cpu time spent up to now is 120.5 secs Computing kpt #: 76 total cpu time spent up to now is 122.2 secs Computing kpt #: 77 total cpu time spent up to now is 123.8 secs Computing kpt #: 78 total cpu time spent up to now is 125.3 secs Computing kpt #: 79 total cpu time spent up to now is 126.7 secs Computing kpt #: 80 total cpu time spent up to now is 128.1 secs Computing kpt #: 81 total cpu time spent up to now is 129.5 secs Computing kpt #: 82 total cpu time spent up to now is 130.9 secs Computing kpt #: 83 total cpu time spent up to now is 132.3 secs Computing kpt #: 84 total cpu time spent up to now is 133.7 secs Computing kpt #: 85 total cpu time spent up to now is 135.0 secs Computing kpt #: 86 total cpu time spent up to now is 136.3 secs Computing kpt #: 87 total cpu time spent up to now is 137.7 secs Computing kpt #: 88 total cpu time spent up to now is 139.0 secs Computing kpt #: 89 total cpu time spent up to now is 140.2 secs Computing kpt #: 90 total cpu time spent up to now is 141.5 secs Computing kpt #: 91 total cpu time spent up to now is 142.8 secs Computing kpt #: 92 total cpu time spent up to now is 144.1 secs Computing kpt #: 93 total cpu time spent up to now is 145.3 secs Computing kpt #: 94 total cpu time spent up to now is 146.5 secs Computing kpt #: 95 total cpu time spent up to now is 147.8 secs Computing kpt #: 96 total cpu time spent up to now is 148.9 secs Computing kpt #: 97 total cpu time spent up to now is 150.1 secs Computing kpt #: 98 total cpu time spent up to now is 151.2 secs Computing kpt #: 99 total cpu time spent up to now is 152.4 secs Computing kpt #: 100 total cpu time spent up to now is 153.6 secs Computing kpt #: 101 total cpu time spent up to now is 154.8 secs Computing kpt #: 102 total cpu time spent up to now is 156.0 secs Computing kpt #: 103 total cpu time spent up to now is 157.3 secs Computing kpt #: 104 total cpu time spent up to now is 158.5 secs Computing kpt #: 105 total cpu time spent up to now is 159.8 secs Computing kpt #: 106 total cpu time spent up to now is 161.1 secs Computing kpt #: 107 total cpu time spent up to now is 162.4 secs Computing kpt #: 108 total cpu time spent up to now is 163.7 secs Computing kpt #: 109 total cpu time spent up to now is 164.9 secs Computing kpt #: 110 total cpu time spent up to now is 166.2 secs Computing kpt #: 111 total cpu time spent up to now is 167.6 secs Computing kpt #: 112 total cpu time spent up to now is 168.9 secs Computing kpt #: 113 total cpu time spent up to now is 170.2 secs Computing kpt #: 114 total cpu time spent up to now is 171.6 secs Computing kpt #: 115 total cpu time spent up to now is 172.9 secs Computing kpt #: 116 total cpu time spent up to now is 174.3 secs Computing kpt #: 117 total cpu time spent up to now is 175.8 secs Computing kpt #: 118 total cpu time spent up to now is 177.2 secs Computing kpt #: 119 total cpu time spent up to now is 178.7 secs Computing kpt #: 120 total cpu time spent up to now is 180.2 secs Computing kpt #: 121 total cpu time spent up to now is 181.7 secs Computing kpt #: 122 total cpu time spent up to now is 183.2 secs Computing kpt #: 123 total cpu time spent up to now is 185.0 secs Computing kpt #: 124 total cpu time spent up to now is 186.8 secs Computing kpt #: 125 total cpu time spent up to now is 188.5 secs Computing kpt #: 126 total cpu time spent up to now is 190.3 secs Computing kpt #: 127 total cpu time spent up to now is 192.1 secs Computing kpt #: 128 total cpu time spent up to now is 193.7 secs Computing kpt #: 129 total cpu time spent up to now is 195.3 secs Computing kpt #: 130 total cpu time spent up to now is 196.8 secs Computing kpt #: 131 total cpu time spent up to now is 198.3 secs Computing kpt #: 132 total cpu time spent up to now is 199.9 secs Computing kpt #: 133 total cpu time spent up to now is 201.4 secs Computing kpt #: 134 total cpu time spent up to now is 203.0 secs Computing kpt #: 135 total cpu time spent up to now is 204.7 secs Computing kpt #: 136 total cpu time spent up to now is 206.3 secs Computing kpt #: 137 total cpu time spent up to now is 208.0 secs Computing kpt #: 138 total cpu time spent up to now is 209.6 secs Computing kpt #: 139 total cpu time spent up to now is 211.2 secs Computing kpt #: 140 total cpu time spent up to now is 212.7 secs Computing kpt #: 141 total cpu time spent up to now is 214.2 secs Computing kpt #: 142 total cpu time spent up to now is 215.7 secs Computing kpt #: 143 total cpu time spent up to now is 217.0 secs Computing kpt #: 144 total cpu time spent up to now is 218.4 secs Computing kpt #: 145 total cpu time spent up to now is 219.7 secs Computing kpt #: 146 total cpu time spent up to now is 221.0 secs Computing kpt #: 147 total cpu time spent up to now is 222.2 secs Computing kpt #: 148 total cpu time spent up to now is 223.5 secs Computing kpt #: 149 total cpu time spent up to now is 224.9 secs Computing kpt #: 150 total cpu time spent up to now is 226.2 secs Computing kpt #: 151 total cpu time spent up to now is 227.6 secs Computing kpt #: 152 total cpu time spent up to now is 229.1 secs Computing kpt #: 153 total cpu time spent up to now is 230.6 secs Computing kpt #: 154 total cpu time spent up to now is 232.1 secs Computing kpt #: 155 total cpu time spent up to now is 233.6 secs Computing kpt #: 156 total cpu time spent up to now is 235.2 secs Computing kpt #: 157 total cpu time spent up to now is 236.8 secs Computing kpt #: 158 total cpu time spent up to now is 238.4 secs Computing kpt #: 159 total cpu time spent up to now is 240.2 secs Computing kpt #: 160 total cpu time spent up to now is 242.0 secs Computing kpt #: 161 total cpu time spent up to now is 243.9 secs Computing kpt #: 162 total cpu time spent up to now is 245.7 secs Computing kpt #: 163 total cpu time spent up to now is 247.5 secs Computing kpt #: 164 total cpu time spent up to now is 249.4 secs Computing kpt #: 165 total cpu time spent up to now is 251.0 secs Computing kpt #: 166 total cpu time spent up to now is 252.7 secs Computing kpt #: 167 total cpu time spent up to now is 254.3 secs Computing kpt #: 168 total cpu time spent up to now is 255.8 secs Computing kpt #: 169 total cpu time spent up to now is 257.4 secs Computing kpt #: 170 total cpu time spent up to now is 258.9 secs Computing kpt #: 171 total cpu time spent up to now is 260.4 secs Computing kpt #: 172 total cpu time spent up to now is 262.0 secs Computing kpt #: 173 total cpu time spent up to now is 263.8 secs Computing kpt #: 174 total cpu time spent up to now is 265.6 secs Computing kpt #: 175 total cpu time spent up to now is 267.4 secs Computing kpt #: 176 total cpu time spent up to now is 269.1 secs Computing kpt #: 177 total cpu time spent up to now is 270.9 secs Computing kpt #: 178 total cpu time spent up to now is 272.7 secs Computing kpt #: 179 total cpu time spent up to now is 274.2 secs Computing kpt #: 180 total cpu time spent up to now is 276.0 secs Computing kpt #: 181 total cpu time spent up to now is 277.7 secs Computing kpt #: 182 total cpu time spent up to now is 279.4 secs Computing kpt #: 183 total cpu time spent up to now is 281.2 secs Computing kpt #: 184 total cpu time spent up to now is 282.9 secs Computing kpt #: 185 total cpu time spent up to now is 284.6 secs Computing kpt #: 186 total cpu time spent up to now is 286.3 secs Computing kpt #: 187 total cpu time spent up to now is 288.1 secs Computing kpt #: 188 total cpu time spent up to now is 289.9 secs Computing kpt #: 189 total cpu time spent up to now is 291.7 secs Computing kpt #: 190 total cpu time spent up to now is 293.6 secs Computing kpt #: 191 total cpu time spent up to now is 295.4 secs Computing kpt #: 192 total cpu time spent up to now is 297.1 secs Computing kpt #: 193 total cpu time spent up to now is 298.8 secs Computing kpt #: 194 total cpu time spent up to now is 300.4 secs Computing kpt #: 195 total cpu time spent up to now is 302.3 secs Computing kpt #: 196 total cpu time spent up to now is 304.1 secs Computing kpt #: 197 total cpu time spent up to now is 305.9 secs Computing kpt #: 198 total cpu time spent up to now is 307.8 secs Computing kpt #: 199 total cpu time spent up to now is 309.6 secs Computing kpt #: 200 total cpu time spent up to now is 311.4 secs Computing kpt #: 201 total cpu time spent up to now is 313.3 secs Computing kpt #: 202 total cpu time spent up to now is 315.2 secs Computing kpt #: 203 total cpu time spent up to now is 317.0 secs Computing kpt #: 204 total cpu time spent up to now is 318.5 secs Computing kpt #: 205 total cpu time spent up to now is 320.0 secs Computing kpt #: 206 total cpu time spent up to now is 321.4 secs Computing kpt #: 207 total cpu time spent up to now is 322.8 secs Computing kpt #: 208 total cpu time spent up to now is 324.2 secs Computing kpt #: 209 total cpu time spent up to now is 325.7 secs Computing kpt #: 210 total cpu time spent up to now is 327.1 secs Computing kpt #: 211 total cpu time spent up to now is 328.4 secs Computing kpt #: 212 total cpu time spent up to now is 329.7 secs Computing kpt #: 213 total cpu time spent up to now is 331.1 secs Computing kpt #: 214 total cpu time spent up to now is 332.4 secs Computing kpt #: 215 total cpu time spent up to now is 333.6 secs ethr = 1.09E-08, avg # of iterations = 17.7 total cpu time spent up to now is 333.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6763 PWs) bands (ev): -4.9919 -4.9919 -3.3657 -3.3657 -3.3641 -3.3641 -3.3641 -3.3641 -0.5573 -0.5573 -0.5573 -0.5573 -0.2545 -0.2545 -0.2545 -0.2545 -0.1477 -0.1477 -0.1477 -0.1477 -0.1429 -0.1429 -0.0485 -0.0485 0.0363 0.0363 0.0980 0.0980 0.2270 0.2270 0.2270 0.2270 0.2936 0.2936 0.2936 0.2936 0.3496 0.3496 0.3690 0.3690 0.4512 0.4512 0.4577 0.4577 0.4577 0.4577 0.4649 0.4649 0.5213 0.5213 0.5213 0.5213 0.5902 0.5902 0.5902 0.5902 0.6292 0.6292 0.6292 0.6292 0.6901 0.6901 0.7096 0.7096 0.7096 0.7096 0.8351 0.8351 1.6872 1.6872 1.6872 1.6872 4.0642 4.0642 4.1336 4.1336 4.1336 4.1336 4.2092 4.2092 5.5759 5.5759 5.5759 5.5759 5.6618 5.6618 6.8761 6.8761 6.8761 6.8761 7.6939 7.6939 7.9025 7.9025 8.1746 8.1746 8.1746 8.1746 8.7370 8.7370 8.7591 8.7591 8.7591 8.7591 11.3026 11.3026 11.4292 11.4292 11.4292 11.4292 k = 0.0000 0.0179-0.0000 ( 6763 PWs) bands (ev): -4.9910 -4.9910 -3.3668 -3.3668 -3.3648 -3.3648 -3.3641 -3.3641 -0.5569 -0.5569 -0.5564 -0.5564 -0.2546 -0.2546 -0.2542 -0.2542 -0.1478 -0.1478 -0.1474 -0.1474 -0.1427 -0.1427 -0.0484 -0.0484 0.0362 0.0362 0.0980 0.0980 0.2255 0.2255 0.2266 0.2266 0.2935 0.2935 0.2948 0.2948 0.3491 0.3491 0.3688 0.3688 0.4511 0.4511 0.4576 0.4576 0.4577 0.4577 0.4648 0.4648 0.5215 0.5215 0.5217 0.5217 0.5897 0.5897 0.5904 0.5904 0.6291 0.6291 0.6292 0.6292 0.6901 0.6901 0.7092 0.7092 0.7099 0.7099 0.8347 0.8347 1.6878 1.6878 1.6909 1.6909 4.0621 4.0621 4.1287 4.1287 4.1333 4.1333 4.2098 4.2098 5.5698 5.5698 5.5745 5.5745 5.6580 5.6580 6.8824 6.8824 6.8867 6.8867 7.6644 7.6644 7.9140 7.9140 8.1680 8.1680 8.1899 8.1899 8.7429 8.7429 8.7635 8.7635 8.7665 8.7665 11.3034 11.3034 11.4254 11.4254 11.4344 11.4344 k = 0.0000 0.0357-0.0000 ( 6743 PWs) bands (ev): -4.9881 -4.9881 -3.3720 -3.3720 -3.3650 -3.3650 -3.3640 -3.3640 -0.5557 -0.5557 -0.5537 -0.5537 -0.2549 -0.2549 -0.2534 -0.2534 -0.1479 -0.1479 -0.1466 -0.1466 -0.1422 -0.1422 -0.0481 -0.0481 0.0363 0.0363 0.0981 0.0981 0.2215 0.2215 0.2256 0.2256 0.2933 0.2933 0.2980 0.2980 0.3476 0.3476 0.3683 0.3683 0.4504 0.4504 0.4571 0.4571 0.4574 0.4574 0.4648 0.4648 0.5219 0.5219 0.5230 0.5230 0.5884 0.5884 0.5909 0.5909 0.6289 0.6289 0.6292 0.6292 0.6899 0.6899 0.7083 0.7083 0.7109 0.7109 0.8334 0.8334 1.6894 1.6894 1.7018 1.7018 4.0535 4.0535 4.1159 4.1159 4.1323 4.1323 4.2121 4.2121 5.5505 5.5505 5.5707 5.5707 5.6483 5.6483 6.9005 6.9005 6.9181 6.9181 7.5982 7.5982 7.9264 7.9264 8.1490 8.1490 8.2368 8.2368 8.7553 8.7553 8.7815 8.7815 8.7884 8.7884 11.3011 11.3011 11.4189 11.4189 11.4497 11.4497 k = 0.0000 0.0536-0.0000 ( 6755 PWs) bands (ev): -4.9833 -4.9833 -3.3810 -3.3810 -3.3650 -3.3650 -3.3639 -3.3639 -0.5539 -0.5539 -0.5493 -0.5493 -0.2554 -0.2554 -0.2521 -0.2521 -0.1481 -0.1481 -0.1452 -0.1452 -0.1412 -0.1412 -0.0476 -0.0476 0.0362 0.0362 0.0982 0.0982 0.2156 0.2156 0.2238 0.2238 0.2928 0.2928 0.3026 0.3026 0.3449 0.3449 0.3676 0.3676 0.4493 0.4493 0.4563 0.4563 0.4571 0.4571 0.4645 0.4645 0.5226 0.5226 0.5248 0.5248 0.5863 0.5863 0.5918 0.5918 0.6284 0.6284 0.6293 0.6293 0.6895 0.6895 0.7071 0.7071 0.7126 0.7126 0.8315 0.8315 1.6920 1.6920 1.7196 1.7196 4.0319 4.0319 4.1022 4.1022 4.1305 4.1305 4.2167 4.2167 5.5166 5.5166 5.5645 5.5645 5.6362 5.6362 6.9273 6.9273 6.9694 6.9694 7.5203 7.5203 7.9212 7.9212 8.1191 8.1191 8.3107 8.3107 8.7684 8.7684 8.8174 8.8174 8.8241 8.8241 11.2829 11.2829 11.4238 11.4238 11.4751 11.4751 k = 0.0000 0.0714-0.0000 ( 6755 PWs) bands (ev): -4.9766 -4.9766 -3.3936 -3.3936 -3.3649 -3.3649 -3.3638 -3.3638 -0.5514 -0.5514 -0.5432 -0.5432 -0.2562 -0.2562 -0.2503 -0.2503 -0.1484 -0.1484 -0.1436 -0.1436 -0.1396 -0.1396 -0.0468 -0.0468 0.0361 0.0361 0.0983 0.0983 0.2083 0.2083 0.2213 0.2213 0.2922 0.2922 0.3081 0.3081 0.3411 0.3411 0.3668 0.3668 0.4476 0.4476 0.4556 0.4556 0.4566 0.4566 0.4641 0.4641 0.5235 0.5235 0.5270 0.5270 0.5835 0.5835 0.5929 0.5929 0.6276 0.6276 0.6294 0.6294 0.6885 0.6885 0.7059 0.7059 0.7150 0.7150 0.8290 0.8290 1.6958 1.6958 1.7442 1.7442 3.9926 3.9926 4.0936 4.0936 4.1279 4.1279 4.2237 4.2237 5.4686 5.4686 5.5564 5.5564 5.6239 5.6239 6.9571 6.9571 7.0390 7.0390 7.4436 7.4436 7.8992 7.8992 8.0801 8.0801 8.4022 8.4022 8.7838 8.7838 8.8677 8.8677 8.8725 8.8725 11.2420 11.2420 11.4486 11.4486 11.5099 11.5099 k = 0.0000 0.0893-0.0000 ( 6771 PWs) bands (ev): -4.9679 -4.9679 -3.4096 -3.4096 -3.3647 -3.3647 -3.3637 -3.3637 -0.5482 -0.5482 -0.5354 -0.5354 -0.2572 -0.2572 -0.2481 -0.2481 -0.1487 -0.1487 -0.1419 -0.1419 -0.1373 -0.1373 -0.0459 -0.0459 0.0359 0.0359 0.0985 0.0985 0.2003 0.2003 0.2181 0.2181 0.2915 0.2915 0.3139 0.3139 0.3363 0.3363 0.3659 0.3659 0.4454 0.4454 0.4549 0.4549 0.4560 0.4560 0.4636 0.4636 0.5245 0.5245 0.5294 0.5294 0.5802 0.5802 0.5943 0.5943 0.6265 0.6265 0.6295 0.6295 0.6866 0.6866 0.7054 0.7054 0.7183 0.7183 0.8260 0.8260 1.7006 1.7006 1.7750 1.7750 3.9385 3.9385 4.0885 4.0885 4.1244 4.1244 4.2333 4.2333 5.4089 5.4089 5.5471 5.5471 5.6118 5.6118 6.9803 6.9803 7.1252 7.1252 7.3792 7.3792 7.8653 7.8653 8.0336 8.0336 8.5039 8.5039 8.8026 8.8026 8.9299 8.9299 8.9326 8.9326 11.1836 11.1836 11.4896 11.4896 11.5539 11.5539 k = 0.0000 0.1071-0.0000 ( 6771 PWs) bands (ev): -4.9574 -4.9574 -3.4288 -3.4288 -3.3645 -3.3645 -3.3635 -3.3635 -0.5443 -0.5443 -0.5260 -0.5260 -0.2584 -0.2584 -0.2453 -0.2453 -0.1492 -0.1492 -0.1402 -0.1402 -0.1340 -0.1340 -0.0446 -0.0446 0.0357 0.0357 0.0986 0.0986 0.1918 0.1918 0.2142 0.2142 0.2905 0.2905 0.3197 0.3197 0.3309 0.3309 0.3650 0.3650 0.4428 0.4428 0.4542 0.4542 0.4553 0.4553 0.4631 0.4631 0.5256 0.5256 0.5318 0.5318 0.5765 0.5765 0.5958 0.5958 0.6253 0.6253 0.6296 0.6296 0.6834 0.6834 0.7057 0.7057 0.7224 0.7224 0.8228 0.8228 1.7066 1.7066 1.8117 1.8117 3.8738 3.8738 4.0846 4.0846 4.1199 4.1199 4.2456 4.2456 5.3400 5.3400 5.5370 5.5370 5.6002 5.6002 6.9817 6.9817 7.2261 7.2261 7.3418 7.3418 7.8226 7.8226 7.9809 7.9809 8.6119 8.6119 8.8251 8.8251 9.0025 9.0025 9.0034 9.0034 11.1138 11.1138 11.5427 11.5427 11.6062 11.6062 k = 0.0000 0.1250-0.0000 ( 6767 PWs) bands (ev): -4.9450 -4.9450 -3.4513 -3.4513 -3.3643 -3.3643 -3.3633 -3.3633 -0.5399 -0.5399 -0.5151 -0.5151 -0.2599 -0.2599 -0.2421 -0.2421 -0.1496 -0.1496 -0.1383 -0.1383 -0.1300 -0.1300 -0.0432 -0.0432 0.0355 0.0355 0.0987 0.0987 0.1832 0.1832 0.2098 0.2098 0.2893 0.2893 0.3252 0.3252 0.3254 0.3254 0.3639 0.3639 0.4398 0.4398 0.4535 0.4535 0.4545 0.4545 0.4624 0.4624 0.5268 0.5268 0.5339 0.5339 0.5726 0.5726 0.5972 0.5972 0.6236 0.6236 0.6296 0.6296 0.6793 0.6793 0.7069 0.7069 0.7273 0.7273 0.8194 0.8194 1.7137 1.7137 1.8536 1.8536 3.8013 3.8013 4.0805 4.0805 4.1142 4.1142 4.2606 4.2606 5.2643 5.2643 5.5270 5.5270 5.5893 5.5893 6.9491 6.9491 7.3400 7.3400 7.3428 7.3428 7.7733 7.7733 7.9231 7.9231 8.7241 8.7241 8.8512 8.8512 9.0839 9.0839 9.0845 9.0845 11.0363 11.0363 11.6053 11.6053 11.6663 11.6663 k = 0.0000 0.1429-0.0000 ( 6775 PWs) bands (ev): -4.9307 -4.9307 -3.4767 -3.4767 -3.3641 -3.3641 -3.3631 -3.3631 -0.5348 -0.5348 -0.5027 -0.5027 -0.2616 -0.2616 -0.2383 -0.2383 -0.1503 -0.1503 -0.1363 -0.1363 -0.1255 -0.1255 -0.0413 -0.0413 0.0352 0.0352 0.0985 0.0985 0.1747 0.1747 0.2047 0.2047 0.2873 0.2873 0.3196 0.3196 0.3309 0.3309 0.3626 0.3626 0.4365 0.4365 0.4527 0.4527 0.4536 0.4536 0.4617 0.4617 0.5281 0.5281 0.5355 0.5355 0.5687 0.5687 0.5985 0.5985 0.6217 0.6217 0.6298 0.6298 0.6744 0.6744 0.7084 0.7084 0.7331 0.7331 0.8163 0.8163 1.7220 1.7220 1.9005 1.9005 3.7232 3.7232 4.0757 4.0757 4.1072 4.1072 4.2783 4.2783 5.1835 5.1835 5.5177 5.5177 5.5796 5.5796 6.8873 6.8873 7.3762 7.3762 7.4653 7.4653 7.7187 7.7187 7.8610 7.8610 8.8393 8.8393 8.8808 8.8808 9.1736 9.1736 9.1753 9.1753 10.9537 10.9537 11.6761 11.6761 11.7333 11.7333 k = 0.0000 0.1607-0.0000 ( 6767 PWs) bands (ev): -4.9146 -4.9146 -3.5049 -3.5049 -3.3638 -3.3638 -3.3628 -3.3628 -0.5293 -0.5293 -0.4889 -0.4889 -0.2636 -0.2636 -0.2341 -0.2341 -0.1509 -0.1509 -0.1339 -0.1339 -0.1204 -0.1204 -0.0392 -0.0392 0.0348 0.0348 0.0981 0.0981 0.1665 0.1665 0.1992 0.1992 0.2844 0.2844 0.3146 0.3146 0.3360 0.3360 0.3611 0.3611 0.4331 0.4331 0.4519 0.4519 0.4526 0.4526 0.4610 0.4610 0.5294 0.5294 0.5363 0.5363 0.5649 0.5649 0.5997 0.5997 0.6195 0.6195 0.6299 0.6299 0.6690 0.6690 0.7100 0.7100 0.7399 0.7399 0.8136 0.8136 1.7315 1.7315 1.9517 1.9517 3.6410 3.6410 4.0697 4.0697 4.0988 4.0988 4.2988 4.2988 5.0988 5.0988 5.5097 5.5097 5.5716 5.5716 6.8093 6.8093 7.4286 7.4286 7.6005 7.6005 7.6601 7.6601 7.7954 7.7954 8.9137 8.9137 8.9566 8.9566 9.2717 9.2717 9.2742 9.2742 10.8679 10.8679 11.7537 11.7537 11.8067 11.8067 k = 0.0000 0.1786-0.0000 ( 6767 PWs) bands (ev): -4.8967 -4.8967 -3.5357 -3.5357 -3.3635 -3.3635 -3.3626 -3.3626 -0.5232 -0.5232 -0.4740 -0.4740 -0.2657 -0.2657 -0.2294 -0.2294 -0.1517 -0.1517 -0.1312 -0.1312 -0.1147 -0.1147 -0.0368 -0.0368 0.0344 0.0344 0.0972 0.0972 0.1590 0.1590 0.1931 0.1931 0.2801 0.2801 0.3105 0.3105 0.3407 0.3407 0.3594 0.3594 0.4297 0.4297 0.4510 0.4510 0.4516 0.4516 0.4602 0.4602 0.5308 0.5308 0.5362 0.5362 0.5614 0.5614 0.6006 0.6006 0.6169 0.6169 0.6300 0.6300 0.6634 0.6634 0.7112 0.7112 0.7474 0.7474 0.8117 0.8117 1.7423 1.7423 2.0069 2.0069 3.5560 3.5560 4.0624 4.0624 4.0891 4.0891 4.3220 4.3220 5.0113 5.0113 5.5038 5.5038 5.5657 5.5657 6.7234 6.7234 7.4900 7.4900 7.5990 7.5990 7.7267 7.7267 7.7445 7.7445 8.9494 8.9494 9.0755 9.0755 9.3776 9.3776 9.3807 9.3807 10.7806 10.7806 11.8374 11.8374 11.8857 11.8857 k = 0.0000 0.1964-0.0000 ( 6759 PWs) bands (ev): -4.8769 -4.8769 -3.5688 -3.5688 -3.3632 -3.3632 -3.3623 -3.3623 -0.5167 -0.5167 -0.4579 -0.4579 -0.2682 -0.2682 -0.2243 -0.2243 -0.1525 -0.1525 -0.1282 -0.1282 -0.1087 -0.1087 -0.0341 -0.0341 0.0339 0.0339 0.0955 0.0955 0.1524 0.1524 0.1867 0.1867 0.2744 0.2744 0.3075 0.3075 0.3451 0.3451 0.3576 0.3576 0.4262 0.4262 0.4500 0.4500 0.4505 0.4505 0.4595 0.4595 0.5322 0.5322 0.5349 0.5349 0.5582 0.5582 0.6012 0.6012 0.6140 0.6140 0.6302 0.6302 0.6576 0.6576 0.7117 0.7117 0.7557 0.7557 0.8110 0.8110 1.7543 1.7543 2.0657 2.0657 3.4694 3.4694 4.0536 4.0536 4.0778 4.0778 4.3481 4.3481 4.9217 4.9217 5.5005 5.5005 5.5625 5.5625 6.6338 6.6338 7.5243 7.5243 7.5678 7.5678 7.6560 7.6560 7.8961 7.8961 8.9876 8.9876 9.1954 9.1954 9.4908 9.4908 9.4943 9.4943 10.6931 10.6931 11.9261 11.9261 11.9695 11.9695 k = 0.0000 0.2143-0.0000 ( 6759 PWs) bands (ev): -4.8554 -4.8554 -3.6042 -3.6042 -3.3628 -3.3628 -3.3620 -3.3620 -0.5098 -0.5098 -0.4411 -0.4411 -0.2708 -0.2708 -0.2188 -0.2188 -0.1534 -0.1534 -0.1247 -0.1247 -0.1023 -0.1023 -0.0310 -0.0310 0.0333 0.0333 0.0929 0.0929 0.1470 0.1470 0.1800 0.1800 0.2677 0.2677 0.3052 0.3052 0.3491 0.3491 0.3558 0.3558 0.4229 0.4229 0.4490 0.4490 0.4494 0.4494 0.4588 0.4588 0.5326 0.5326 0.5336 0.5336 0.5554 0.5554 0.6015 0.6015 0.6107 0.6107 0.6304 0.6304 0.6518 0.6518 0.7110 0.7110 0.7647 0.7647 0.8117 0.8117 1.7678 1.7678 2.1278 2.1278 3.3821 3.3821 4.0433 4.0433 4.0652 4.0652 4.3769 4.3769 4.8306 4.8306 5.5002 5.5002 5.5623 5.5623 6.5425 6.5425 7.4629 7.4629 7.5835 7.5835 7.6335 7.6335 8.0547 8.0547 9.0277 9.0277 9.3158 9.3158 9.6108 9.6108 9.6146 9.6146 10.6068 10.6068 12.0190 12.0190 12.0574 12.0574 k = 0.0000 0.2321-0.0000 ( 6767 PWs) bands (ev): -4.8321 -4.8321 -3.6416 -3.6416 -3.3625 -3.3625 -3.3617 -3.3617 -0.5025 -0.5025 -0.4236 -0.4236 -0.2736 -0.2736 -0.2129 -0.2129 -0.1545 -0.1545 -0.1208 -0.1208 -0.0955 -0.0955 -0.0277 -0.0277 0.0327 0.0327 0.0892 0.0892 0.1430 0.1430 0.1729 0.1729 0.2603 0.2603 0.3031 0.3031 0.3527 0.3527 0.3540 0.3540 0.4198 0.4198 0.4478 0.4478 0.4482 0.4482 0.4581 0.4581 0.5293 0.5293 0.5351 0.5351 0.5526 0.5526 0.6015 0.6015 0.6072 0.6072 0.6306 0.6306 0.6461 0.6461 0.7089 0.7089 0.7741 0.7741 0.8140 0.8140 1.7826 1.7826 2.1927 2.1927 3.2948 3.2948 4.0317 4.0317 4.0512 4.0512 4.4084 4.4084 4.7386 4.7386 5.5033 5.5033 5.5653 5.5653 6.4507 6.4507 7.3951 7.3951 7.5099 7.5099 7.7058 7.7058 8.2194 8.2194 9.0688 9.0688 9.4361 9.4361 9.7371 9.7371 9.7412 9.7412 10.5230 10.5230 12.1155 12.1155 12.1488 12.1488 k = 0.0000 0.2500-0.0000 ( 6743 PWs) bands (ev): -4.8071 -4.8071 -3.6807 -3.6807 -3.3621 -3.3621 -3.3614 -3.3614 -0.4949 -0.4949 -0.4057 -0.4057 -0.2764 -0.2764 -0.2067 -0.2067 -0.1555 -0.1555 -0.1163 -0.1163 -0.0885 -0.0885 -0.0241 -0.0241 0.0320 0.0320 0.0846 0.0846 0.1405 0.1405 0.1657 0.1657 0.2525 0.2525 0.3008 0.3008 0.3525 0.3525 0.3559 0.3559 0.4170 0.4170 0.4465 0.4465 0.4471 0.4471 0.4576 0.4576 0.5254 0.5254 0.5367 0.5367 0.5497 0.5497 0.6012 0.6012 0.6034 0.6034 0.6309 0.6309 0.6406 0.6406 0.7056 0.7056 0.7841 0.7841 0.8179 0.8179 1.7990 1.7990 2.2602 2.2602 3.2082 3.2082 4.0188 4.0188 4.0361 4.0361 4.4428 4.4428 4.6459 4.6459 5.5099 5.5099 5.5718 5.5718 6.3591 6.3591 7.3260 7.3260 7.4356 7.4356 7.7797 7.7797 8.3897 8.3897 9.1099 9.1099 9.5555 9.5555 9.8694 9.8694 9.8735 9.8735 10.4431 10.4431 12.2147 12.2147 12.2430 12.2430 k = 0.0000 0.2679-0.0000 ( 6747 PWs) bands (ev): -4.7804 -4.7804 -3.7213 -3.7213 -3.3618 -3.3618 -3.3611 -3.3611 -0.4871 -0.4871 -0.3881 -0.3881 -0.2791 -0.2791 -0.2002 -0.2002 -0.1565 -0.1565 -0.1113 -0.1113 -0.0812 -0.0812 -0.0203 -0.0203 0.0311 0.0311 0.0792 0.0792 0.1393 0.1393 0.1582 0.1582 0.2444 0.2444 0.2978 0.2978 0.3514 0.3514 0.3586 0.3586 0.4146 0.4146 0.4452 0.4452 0.4461 0.4461 0.4571 0.4571 0.5209 0.5209 0.5382 0.5382 0.5465 0.5465 0.5993 0.5993 0.6006 0.6006 0.6313 0.6313 0.6354 0.6354 0.7011 0.7011 0.7942 0.7942 0.8230 0.8230 1.8169 1.8169 2.3300 2.3300 3.1226 3.1226 4.0049 4.0049 4.0200 4.0200 4.4798 4.4798 4.5529 4.5529 5.5202 5.5202 5.5816 5.5816 6.2679 6.2679 7.2564 7.2564 7.3611 7.3611 7.8542 7.8542 8.5650 8.5650 9.1495 9.1495 9.6732 9.6732 10.0073 10.0073 10.0109 10.0109 10.3691 10.3691 12.3160 12.3160 12.3392 12.3392 k = 0.0000 0.2857-0.0000 ( 6760 PWs) bands (ev): -4.7521 -4.7521 -3.7633 -3.7633 -3.3615 -3.3615 -3.3608 -3.3608 -0.4790 -0.4790 -0.3711 -0.3711 -0.2815 -0.2815 -0.1937 -0.1937 -0.1574 -0.1574 -0.1056 -0.1056 -0.0739 -0.0739 -0.0165 -0.0165 0.0301 0.0301 0.0735 0.0735 0.1392 0.1392 0.1505 0.1505 0.2363 0.2363 0.2940 0.2940 0.3508 0.3508 0.3610 0.3610 0.4128 0.4128 0.4438 0.4438 0.4450 0.4450 0.4567 0.4567 0.5159 0.5159 0.5398 0.5398 0.5428 0.5428 0.5951 0.5951 0.5999 0.5999 0.6305 0.6305 0.6316 0.6316 0.6958 0.6958 0.8044 0.8044 0.8291 0.8291 1.8364 1.8364 2.4019 2.4019 3.0387 3.0387 3.9902 3.9902 4.0032 4.0032 4.4599 4.4599 4.5195 4.5195 5.5340 5.5340 5.5948 5.5948 6.1776 6.1776 7.1871 7.1871 7.2870 7.2870 7.9291 7.9291 8.7449 8.7449 9.1857 9.1857 9.7883 9.7883 10.1503 10.1503 10.1514 10.1514 10.3047 10.3047 12.4184 12.4184 12.4366 12.4366 k = 0.0000 0.3036-0.0000 ( 6752 PWs) bands (ev): -4.7222 -4.7222 -3.8064 -3.8064 -3.3612 -3.3612 -3.3605 -3.3605 -0.4707 -0.4707 -0.3558 -0.3558 -0.2826 -0.2826 -0.1872 -0.1872 -0.1580 -0.1580 -0.0994 -0.0994 -0.0663 -0.0663 -0.0128 -0.0128 0.0290 0.0290 0.0682 0.0682 0.1400 0.1400 0.1426 0.1426 0.2282 0.2282 0.2891 0.2891 0.3509 0.3509 0.3631 0.3631 0.4116 0.4116 0.4423 0.4423 0.4440 0.4440 0.4564 0.4564 0.5105 0.5105 0.5385 0.5385 0.5414 0.5414 0.5910 0.5910 0.5990 0.5990 0.6259 0.6259 0.6320 0.6320 0.6900 0.6900 0.8145 0.8145 0.8358 0.8358 1.8577 1.8577 2.4757 2.4757 2.9567 2.9567 3.9750 3.9750 3.9860 3.9860 4.3670 4.3670 4.5619 4.5619 5.5514 5.5514 5.6110 5.6110 6.0884 6.0884 7.1186 7.1186 7.2136 7.2136 8.0041 8.0041 8.9289 8.9289 9.2160 9.2160 9.8996 9.8996 10.2315 10.2315 10.2983 10.2983 10.3153 10.3153 12.5211 12.5211 12.5343 12.5343 k = 0.0000 0.3214-0.0000 ( 6756 PWs) bands (ev): -4.6907 -4.6907 -3.8505 -3.8505 -3.3608 -3.3608 -3.3603 -3.3603 -0.4623 -0.4623 -0.3436 -0.3436 -0.2816 -0.2816 -0.1813 -0.1813 -0.1578 -0.1578 -0.0926 -0.0926 -0.0587 -0.0587 -0.0095 -0.0095 0.0278 0.0278 0.0636 0.0636 0.1346 0.1346 0.1415 0.1415 0.2200 0.2200 0.2832 0.2832 0.3516 0.3516 0.3647 0.3647 0.4110 0.4110 0.4408 0.4408 0.4431 0.4431 0.4563 0.4563 0.5048 0.5048 0.5335 0.5335 0.5431 0.5431 0.5869 0.5869 0.5979 0.5979 0.6216 0.6216 0.6326 0.6326 0.6841 0.6841 0.8244 0.8244 0.8429 0.8429 1.8808 1.8808 2.5512 2.5512 2.8769 2.8769 3.9596 3.9596 3.9687 3.9687 4.2744 4.2744 4.6070 4.6070 5.5719 5.5719 5.6298 5.6298 6.0005 6.0005 7.0514 7.0514 7.1416 7.1416 8.0792 8.0792 9.1165 9.1165 9.2377 9.2377 10.0056 10.0056 10.1941 10.1941 10.4509 10.4509 10.4608 10.4608 12.6231 12.6231 12.6312 12.6312 k = 0.0000 0.3393-0.0000 ( 6736 PWs) bands (ev): -4.6578 -4.6578 -3.8952 -3.8952 -3.3605 -3.3605 -3.3600 -3.3600 -0.4538 -0.4538 -0.3360 -0.3360 -0.2770 -0.2770 -0.1770 -0.1770 -0.1559 -0.1559 -0.0853 -0.0853 -0.0510 -0.0510 -0.0068 -0.0068 0.0264 0.0264 0.0605 0.0605 0.1265 0.1265 0.1437 0.1437 0.2118 0.2118 0.2763 0.2763 0.3528 0.3528 0.3661 0.3661 0.4111 0.4111 0.4394 0.4394 0.4422 0.4422 0.4563 0.4563 0.4987 0.4987 0.5279 0.5279 0.5448 0.5448 0.5830 0.5830 0.5969 0.5969 0.6176 0.6176 0.6332 0.6332 0.6782 0.6782 0.8340 0.8340 0.8500 0.8500 1.9059 1.9059 2.6282 2.6282 2.7997 2.7997 3.9445 3.9445 3.9514 3.9514 4.1824 4.1824 4.6547 4.6547 5.5953 5.5953 5.6504 5.6504 5.9145 5.9145 6.9863 6.9863 7.0714 7.0714 8.1543 8.1543 9.2444 9.2444 9.3108 9.3108 10.1048 10.1048 10.1656 10.1656 10.6078 10.6078 10.6169 10.6169 12.7228 12.7228 12.7254 12.7254 k = 0.0000 0.3571-0.0000 ( 6716 PWs) bands (ev): -4.6234 -4.6234 -3.9406 -3.9406 -3.3602 -3.3602 -3.3598 -3.3598 -0.4452 -0.4452 -0.3335 -0.3335 -0.2688 -0.2688 -0.1751 -0.1751 -0.1515 -0.1515 -0.0780 -0.0780 -0.0432 -0.0432 -0.0049 -0.0049 0.0248 0.0248 0.0596 0.0596 0.1184 0.1184 0.1463 0.1463 0.2035 0.2035 0.2684 0.2684 0.3544 0.3544 0.3673 0.3673 0.4118 0.4118 0.4381 0.4381 0.4413 0.4413 0.4564 0.4564 0.4923 0.4923 0.5217 0.5217 0.5466 0.5466 0.5794 0.5794 0.5958 0.5958 0.6137 0.6137 0.6339 0.6339 0.6726 0.6726 0.8431 0.8431 0.8569 0.8569 1.9330 1.9330 2.7059 2.7059 2.7257 2.7257 3.9299 3.9299 3.9342 3.9342 4.0915 4.0915 4.7050 4.7050 5.6210 5.6210 5.6709 5.6709 5.8317 5.8317 6.9240 6.9240 7.0037 7.0037 8.2294 8.2294 9.2409 9.2409 9.5046 9.5046 10.1535 10.1535 10.1953 10.1953 10.7687 10.7687 10.7778 10.7778 12.8123 12.8123 12.8180 12.8180 k = 0.0000 0.3750-0.0000 ( 6736 PWs) bands (ev): -4.5876 -4.5876 -3.9863 -3.9863 -3.3600 -3.3600 -3.3596 -3.3596 -0.4366 -0.4366 -0.3348 -0.3348 -0.2586 -0.2586 -0.1754 -0.1754 -0.1451 -0.1451 -0.0712 -0.0712 -0.0355 -0.0355 -0.0036 -0.0036 0.0230 0.0230 0.0612 0.0612 0.1100 0.1100 0.1495 0.1495 0.1951 0.1951 0.2595 0.2595 0.3563 0.3563 0.3682 0.3682 0.4132 0.4132 0.4368 0.4368 0.4403 0.4403 0.4568 0.4568 0.4857 0.4857 0.5149 0.5149 0.5484 0.5484 0.5762 0.5762 0.5946 0.5946 0.6100 0.6100 0.6347 0.6347 0.6674 0.6674 0.8515 0.8515 0.8633 0.8633 1.9622 1.9622 2.6531 2.6531 2.7864 2.7864 3.9158 3.9158 3.9161 3.9161 4.0031 4.0031 4.7579 4.7579 5.6484 5.6484 5.6829 5.6829 5.7598 5.7598 6.8652 6.8652 6.9390 6.9390 8.3044 8.3044 9.2213 9.2213 9.7026 9.7026 10.1584 10.1584 10.2751 10.2751 10.9334 10.9334 10.9428 10.9428 12.7091 12.7091 12.8996 12.8996 k = 0.0000 0.3929-0.0000 ( 6740 PWs) bands (ev): -4.5504 -4.5504 -4.0323 -4.0323 -3.3597 -3.3597 -3.3594 -3.3594 -0.4279 -0.4279 -0.3384 -0.3384 -0.2477 -0.2477 -0.1769 -0.1769 -0.1375 -0.1375 -0.0660 -0.0660 -0.0280 -0.0280 -0.0020 -0.0020 0.0210 0.0210 0.0654 0.0654 0.1016 0.1016 0.1532 0.1532 0.1865 0.1865 0.2500 0.2500 0.3584 0.3584 0.3690 0.3690 0.4151 0.4151 0.4357 0.4357 0.4394 0.4394 0.4573 0.4573 0.4789 0.4789 0.5078 0.5078 0.5502 0.5502 0.5733 0.5733 0.5937 0.5937 0.6066 0.6066 0.6356 0.6356 0.6627 0.6627 0.8592 0.8592 0.8691 0.8691 1.9936 1.9936 2.5843 2.5843 2.8671 2.8671 3.8833 3.8833 3.9036 3.9036 3.9308 3.9308 4.8133 4.8133 5.6434 5.6434 5.6769 5.6769 5.7410 5.7410 6.8111 6.8111 6.8782 6.8782 8.3793 8.3793 9.1877 9.1877 9.9037 9.9037 10.1785 10.1785 10.3420 10.3420 11.1015 11.1015 11.1114 11.1114 12.4877 12.4877 12.9567 12.9567 k = 0.0000 0.4107-0.0000 ( 6756 PWs) bands (ev): -4.5121 -4.5121 -4.0783 -4.0783 -3.3595 -3.3595 -3.3592 -3.3592 -0.4194 -0.4194 -0.3434 -0.3434 -0.2373 -0.2373 -0.1792 -0.1792 -0.1293 -0.1293 -0.0634 -0.0634 -0.0212 -0.0212 0.0016 0.0016 0.0187 0.0187 0.0719 0.0719 0.0930 0.0930 0.1575 0.1575 0.1776 0.1776 0.2398 0.2398 0.3606 0.3606 0.3696 0.3696 0.4176 0.4176 0.4350 0.4350 0.4384 0.4384 0.4582 0.4582 0.4721 0.4721 0.5005 0.5005 0.5520 0.5520 0.5707 0.5707 0.5928 0.5928 0.6034 0.6034 0.6366 0.6366 0.6584 0.6584 0.8660 0.8660 0.8742 0.8742 2.0275 2.0275 2.5185 2.5185 2.9489 2.9489 3.8082 3.8082 3.8925 3.8925 3.9032 3.9032 4.8712 4.8712 5.5695 5.5695 5.7054 5.7054 5.7573 5.7573 6.7628 6.7628 6.8222 6.8222 8.4541 8.4541 9.1426 9.1426 10.1073 10.1073 10.2109 10.2109 10.3942 10.3942 11.2726 11.2726 11.2833 11.2833 12.2657 12.2657 12.9620 12.9620 k = 0.0000 0.4286-0.0000 ( 6756 PWs) bands (ev): -4.4725 -4.4725 -4.1242 -4.1242 -3.3594 -3.3594 -3.3591 -3.3591 -0.4108 -0.4108 -0.3493 -0.3493 -0.2277 -0.2277 -0.1821 -0.1821 -0.1208 -0.1208 -0.0637 -0.0637 -0.0155 -0.0155 0.0081 0.0081 0.0161 0.0161 0.0804 0.0804 0.0842 0.0842 0.1625 0.1625 0.1683 0.1683 0.2293 0.2293 0.3628 0.3628 0.3701 0.3701 0.4205 0.4205 0.4347 0.4347 0.4373 0.4373 0.4595 0.4595 0.4654 0.4654 0.4934 0.4934 0.5538 0.5538 0.5685 0.5685 0.5922 0.5922 0.6006 0.6006 0.6378 0.6378 0.6547 0.6547 0.8719 0.8719 0.8783 0.8783 2.0638 2.0638 2.4558 2.4558 3.0316 3.0316 3.7213 3.7213 3.8832 3.8832 3.8898 3.8898 4.9315 4.9315 5.4922 5.4922 5.7329 5.7329 5.7762 5.7762 6.7217 6.7217 6.7720 6.7720 8.5287 8.5287 9.0884 9.0884 10.2497 10.2497 10.3150 10.3150 10.4303 10.4303 11.4457 11.4457 11.4582 11.4582 12.0452 12.0452 12.8784 12.8784 k = 0.0000 0.4464-0.0000 ( 6760 PWs) bands (ev): -4.4318 -4.4318 -4.1698 -4.1698 -3.3592 -3.3592 -3.3590 -3.3590 -0.4024 -0.4024 -0.3558 -0.3558 -0.2191 -0.2191 -0.1854 -0.1854 -0.1121 -0.1121 -0.0670 -0.0670 -0.0106 -0.0106 0.0132 0.0132 0.0169 0.0169 0.0753 0.0753 0.0904 0.0904 0.1585 0.1585 0.1681 0.1681 0.2188 0.2188 0.3648 0.3648 0.3704 0.3704 0.4237 0.4237 0.4349 0.4349 0.4361 0.4361 0.4588 0.4588 0.4613 0.4613 0.4867 0.4867 0.5556 0.5556 0.5664 0.5664 0.5919 0.5919 0.5981 0.5981 0.6391 0.6391 0.6515 0.6515 0.8767 0.8767 0.8815 0.8815 2.1027 2.1027 2.3963 2.3963 3.1153 3.1153 3.6333 3.6333 3.8759 3.8759 3.8803 3.8803 4.9941 4.9941 5.4156 5.4156 5.7581 5.7581 5.7923 5.7923 6.6892 6.6892 6.7290 6.7290 8.6031 8.6031 9.0277 9.0277 10.2945 10.2945 10.4496 10.4496 10.5233 10.5233 11.6152 11.6152 11.6356 11.6356 11.8318 11.8318 12.7295 12.7295 k = 0.0000 0.4643-0.0000 ( 6764 PWs) bands (ev): -4.3901 -4.3901 -4.2151 -4.2151 -3.3591 -3.3591 -3.3590 -3.3590 -0.3941 -0.3941 -0.3629 -0.3629 -0.2114 -0.2114 -0.1893 -0.1893 -0.1034 -0.1034 -0.0723 -0.0723 -0.0059 -0.0059 0.0100 0.0100 0.0267 0.0267 0.0661 0.0661 0.1014 0.1014 0.1480 0.1480 0.1744 0.1744 0.2085 0.2085 0.3666 0.3666 0.3703 0.3703 0.4269 0.4269 0.4349 0.4349 0.4360 0.4360 0.4527 0.4527 0.4636 0.4636 0.4805 0.4805 0.5574 0.5574 0.5645 0.5645 0.5919 0.5919 0.5960 0.5960 0.6406 0.6406 0.6487 0.6487 0.8804 0.8804 0.8836 0.8836 2.1444 2.1444 2.3398 2.3398 3.1998 3.1998 3.5454 3.5454 3.8707 3.8707 3.8735 3.8735 5.0591 5.0591 5.3405 5.3405 5.7795 5.7795 5.8034 5.8034 6.6668 6.6668 6.6946 6.6946 8.6771 8.6771 8.9623 8.9623 10.3392 10.3392 10.4525 10.4525 10.7343 10.7343 11.5887 11.5887 11.8147 11.8147 11.8175 11.8175 12.5535 12.5535 k = 0.0000 0.4821-0.0000 ( 6780 PWs) bands (ev): -4.3475 -4.3475 -4.2599 -4.2599 -3.3590 -3.3590 -3.3589 -3.3589 -0.3859 -0.3859 -0.3703 -0.3703 -0.2048 -0.2048 -0.1938 -0.1938 -0.0949 -0.0949 -0.0791 -0.0791 -0.0015 -0.0015 0.0065 0.0065 0.0368 0.0368 0.0566 0.0566 0.1132 0.1132 0.1368 0.1368 0.1816 0.1816 0.1987 0.1987 0.3680 0.3680 0.3700 0.3700 0.4297 0.4297 0.4335 0.4335 0.4384 0.4384 0.4471 0.4471 0.4666 0.4666 0.4751 0.4751 0.5592 0.5592 0.5627 0.5627 0.5923 0.5923 0.5943 0.5943 0.6422 0.6422 0.6463 0.6463 0.8830 0.8830 0.8846 0.8846 2.1888 2.1888 2.2864 2.2864 3.2852 3.2852 3.4580 3.4580 3.8678 3.8678 3.8691 3.8691 5.1263 5.1263 5.2671 5.2671 5.7958 5.7958 5.8081 5.8081 6.6559 6.6559 6.6701 6.6701 8.7504 8.7504 8.8936 8.8936 10.3807 10.3807 10.4403 10.4403 10.9472 10.9472 11.3772 11.3772 11.9888 11.9888 11.9928 11.9928 12.3741 12.3741 k = 0.0000 0.5000-0.0000 ( 6816 PWs) bands (ev): -4.3041 -4.3041 -4.3041 -4.3041 -3.3590 -3.3590 -3.3590 -3.3590 -0.3780 -0.3780 -0.3780 -0.3780 -0.1990 -0.1990 -0.1990 -0.1990 -0.0867 -0.0867 -0.0867 -0.0867 0.0026 0.0026 0.0026 0.0026 0.0468 0.0468 0.0468 0.0468 0.1251 0.1251 0.1251 0.1251 0.1897 0.1897 0.1897 0.1897 0.3692 0.3692 0.3692 0.3692 0.4318 0.4318 0.4318 0.4318 0.4421 0.4421 0.4421 0.4421 0.4704 0.4704 0.4704 0.4704 0.5609 0.5609 0.5609 0.5609 0.5931 0.5931 0.5931 0.5931 0.6441 0.6441 0.6441 0.6441 0.8843 0.8843 0.8843 0.8843 2.2361 2.2361 2.2361 2.2361 3.3712 3.3712 3.3712 3.3712 3.8672 3.8672 3.8672 3.8672 5.1957 5.1957 5.1957 5.1957 5.8055 5.8055 5.8055 5.8055 6.6570 6.6570 6.6570 6.6570 8.8228 8.8228 8.8228 8.8228 10.4155 10.4155 10.4155 10.4155 11.1618 11.1618 11.1618 11.1618 12.1250 12.1250 12.1250 12.1250 12.2414 12.2414 k = 0.0000 0.5000-0.0000 ( 6816 PWs) bands (ev): -4.3041 -4.3041 -4.3041 -4.3041 -3.3590 -3.3590 -3.3590 -3.3590 -0.3780 -0.3780 -0.3780 -0.3780 -0.1990 -0.1990 -0.1990 -0.1990 -0.0867 -0.0867 -0.0867 -0.0867 0.0026 0.0026 0.0026 0.0026 0.0468 0.0468 0.0468 0.0468 0.1251 0.1251 0.1251 0.1251 0.1897 0.1897 0.1897 0.1897 0.3692 0.3692 0.3692 0.3692 0.4318 0.4318 0.4318 0.4318 0.4421 0.4421 0.4421 0.4421 0.4704 0.4704 0.4704 0.4704 0.5609 0.5609 0.5609 0.5609 0.5931 0.5931 0.5931 0.5931 0.6441 0.6441 0.6441 0.6441 0.8843 0.8843 0.8843 0.8843 2.2361 2.2361 2.2361 2.2361 3.3712 3.3712 3.3712 3.3712 3.8672 3.8672 3.8672 3.8672 5.1957 5.1957 5.1957 5.1957 5.8055 5.8055 5.8055 5.8055 6.6570 6.6570 6.6570 6.6570 8.8228 8.8228 8.8228 8.8228 10.4155 10.4155 10.4155 10.4155 11.1618 11.1618 11.1618 11.1618 12.1250 12.1250 12.1250 12.1250 12.2414 12.2414 k = 0.0179 0.5000-0.0000 ( 6782 PWs) bands (ev): -4.3034 -4.3034 -4.3034 -4.3034 -3.3597 -3.3597 -3.3597 -3.3597 -0.3778 -0.3778 -0.3774 -0.3774 -0.1993 -0.1993 -0.1981 -0.1981 -0.0868 -0.0868 -0.0865 -0.0865 0.0013 0.0013 0.0039 0.0039 0.0447 0.0447 0.0490 0.0490 0.1246 0.1246 0.1258 0.1258 0.1897 0.1897 0.1898 0.1898 0.3679 0.3679 0.3703 0.3703 0.4312 0.4312 0.4320 0.4320 0.4416 0.4416 0.4428 0.4428 0.4702 0.4702 0.4706 0.4706 0.5596 0.5596 0.5619 0.5619 0.5929 0.5929 0.5930 0.5930 0.6439 0.6439 0.6441 0.6441 0.8814 0.8814 0.8862 0.8862 2.2330 2.2330 2.2387 2.2387 3.3601 3.3601 3.3667 3.3667 3.8779 3.8779 3.8806 3.8806 5.1819 5.1819 5.1912 5.1912 5.8036 5.8036 5.8210 5.8210 6.6523 6.6523 6.6559 6.6559 8.8290 8.8290 8.8322 8.8322 10.4159 10.4159 10.4176 10.4176 11.1459 11.1459 11.1596 11.1596 12.1233 12.1233 12.1347 12.1347 12.2413 12.2413 k = 0.0357 0.5000-0.0000 ( 6774 PWs) bands (ev): -4.3014 -4.3014 -4.3014 -4.3014 -3.3619 -3.3619 -3.3618 -3.3618 -0.3768 -0.3768 -0.3759 -0.3759 -0.1994 -0.1994 -0.1970 -0.1970 -0.0868 -0.0868 -0.0861 -0.0861 0.0000 0.0000 0.0050 0.0050 0.0427 0.0427 0.0513 0.0513 0.1244 0.1244 0.1267 0.1267 0.1898 0.1898 0.1900 0.1900 0.3663 0.3663 0.3711 0.3711 0.4302 0.4302 0.4317 0.4317 0.4410 0.4410 0.4436 0.4436 0.4699 0.4699 0.4708 0.4708 0.5579 0.5579 0.5627 0.5627 0.5924 0.5924 0.5926 0.5926 0.6434 0.6434 0.6438 0.6438 0.8773 0.8773 0.8869 0.8869 2.2294 2.2294 2.2407 2.2407 3.3360 3.3360 3.3481 3.3481 3.9109 3.9109 3.9149 3.9149 5.1524 5.1524 5.1690 5.1690 5.8146 5.8146 5.8473 5.8473 6.6422 6.6422 6.6495 6.6495 8.8505 8.8505 8.8568 8.8568 10.4187 10.4187 10.4222 10.4222 11.1140 11.1140 11.1399 11.1399 12.1302 12.1302 12.1496 12.1496 12.2457 12.2457 k = 0.0536 0.5000-0.0000 ( 6770 PWs) bands (ev): -4.2981 -4.2981 -4.2981 -4.2981 -3.3656 -3.3656 -3.3655 -3.3655 -0.3750 -0.3750 -0.3737 -0.3737 -0.1990 -0.1990 -0.1954 -0.1954 -0.0866 -0.0866 -0.0857 -0.0857 -0.0013 -0.0013 0.0061 0.0061 0.0410 0.0410 0.0537 0.0537 0.1244 0.1244 0.1277 0.1277 0.1899 0.1899 0.1903 0.1903 0.3645 0.3645 0.3716 0.3716 0.4288 0.4288 0.4311 0.4311 0.4405 0.4405 0.4444 0.4444 0.4696 0.4696 0.4708 0.4708 0.5559 0.5559 0.5632 0.5632 0.5915 0.5915 0.5920 0.5920 0.6426 0.6426 0.6432 0.6432 0.8721 0.8721 0.8864 0.8864 2.2254 2.2254 2.2421 2.2421 3.3041 3.3041 3.3203 3.3203 3.9610 3.9610 3.9649 3.9649 5.1114 5.1114 5.1325 5.1325 5.8345 5.8345 5.8799 5.8799 6.6283 6.6283 6.6392 6.6392 8.8865 8.8865 8.8958 8.8958 10.4230 10.4230 10.4281 10.4281 11.0700 11.0700 11.1059 11.1059 12.1439 12.1439 12.1664 12.1664 12.2528 12.2528 k = 0.0714 0.5000-0.0000 ( 6758 PWs) bands (ev): -4.2935 -4.2935 -4.2934 -4.2934 -3.3707 -3.3707 -3.3706 -3.3706 -0.3723 -0.3723 -0.3706 -0.3706 -0.1982 -0.1982 -0.1935 -0.1935 -0.0863 -0.0863 -0.0850 -0.0850 -0.0025 -0.0025 0.0069 0.0069 0.0395 0.0395 0.0562 0.0562 0.1247 0.1247 0.1288 0.1288 0.1901 0.1901 0.1906 0.1906 0.3625 0.3625 0.3719 0.3719 0.4271 0.4271 0.4302 0.4302 0.4399 0.4399 0.4452 0.4452 0.4693 0.4693 0.4708 0.4708 0.5536 0.5536 0.5634 0.5634 0.5902 0.5902 0.5912 0.5912 0.6416 0.6416 0.6424 0.6424 0.8657 0.8657 0.8845 0.8845 2.2214 2.2214 2.2430 2.2430 3.2689 3.2689 3.2879 3.2879 4.0228 4.0228 4.0249 4.0249 5.0634 5.0634 5.0860 5.0860 5.8581 5.8581 5.9136 5.9136 6.6131 6.6131 6.6276 6.6276 8.9361 8.9361 8.9483 8.9483 10.4270 10.4270 10.4336 10.4336 11.0190 11.0190 11.0624 11.0624 12.1617 12.1617 12.1831 12.1831 12.2599 12.2599 k = 0.0893 0.5000-0.0000 ( 6744 PWs) bands (ev): -4.2876 -4.2876 -4.2875 -4.2875 -3.3772 -3.3772 -3.3771 -3.3771 -0.3689 -0.3689 -0.3668 -0.3668 -0.1971 -0.1971 -0.1913 -0.1913 -0.0858 -0.0858 -0.0843 -0.0843 -0.0037 -0.0037 0.0075 0.0075 0.0383 0.0383 0.0589 0.0589 0.1254 0.1254 0.1299 0.1299 0.1903 0.1903 0.1912 0.1912 0.3602 0.3602 0.3719 0.3719 0.4252 0.4252 0.4289 0.4289 0.4393 0.4393 0.4459 0.4459 0.4689 0.4689 0.4707 0.4707 0.5510 0.5510 0.5634 0.5634 0.5885 0.5885 0.5903 0.5903 0.6403 0.6403 0.6413 0.6413 0.8581 0.8581 0.8812 0.8812 2.2174 2.2174 2.2436 2.2436 3.2336 3.2336 3.2544 3.2544 4.0906 4.0906 4.0917 4.0917 5.0125 5.0125 5.0341 5.0341 5.8802 5.8802 5.9431 5.9431 6.6000 6.6000 6.6174 6.6174 8.9978 8.9978 9.0126 9.0126 10.4282 10.4282 10.4356 10.4356 10.9670 10.9670 11.0154 11.0154 12.1815 12.1815 12.1995 12.1995 12.2629 12.2629 k = 0.1071 0.5000-0.0000 ( 6748 PWs) bands (ev): -4.2805 -4.2805 -4.2803 -4.2803 -3.3852 -3.3852 -3.3850 -3.3850 -0.3648 -0.3648 -0.3622 -0.3622 -0.1957 -0.1957 -0.1887 -0.1887 -0.0851 -0.0851 -0.0834 -0.0834 -0.0048 -0.0048 0.0076 0.0076 0.0376 0.0376 0.0616 0.0616 0.1263 0.1263 0.1309 0.1309 0.1905 0.1905 0.1918 0.1918 0.3577 0.3577 0.3716 0.3716 0.4231 0.4231 0.4275 0.4275 0.4385 0.4385 0.4465 0.4465 0.4685 0.4685 0.4706 0.4706 0.5480 0.5480 0.5632 0.5632 0.5865 0.5865 0.5894 0.5894 0.6388 0.6388 0.6400 0.6400 0.8490 0.8490 0.8763 0.8763 2.2139 2.2139 2.2440 2.2440 3.2002 3.2002 3.2220 3.2220 4.1576 4.1576 4.1636 4.1636 4.9629 4.9629 4.9811 4.9811 5.8962 5.8962 5.9639 5.9639 6.5930 6.5930 6.6120 6.6120 9.0702 9.0702 9.0873 9.0873 10.4227 10.4227 10.4294 10.4294 10.9208 10.9208 10.9715 10.9715 12.2016 12.2016 12.2156 12.2156 12.2575 12.2575 k = 0.1250 0.5000-0.0000 ( 6740 PWs) bands (ev): -4.2720 -4.2720 -4.2718 -4.2718 -3.3945 -3.3945 -3.3942 -3.3942 -0.3600 -0.3600 -0.3570 -0.3570 -0.1939 -0.1939 -0.1858 -0.1858 -0.0842 -0.0842 -0.0824 -0.0824 -0.0059 -0.0059 0.0074 0.0074 0.0374 0.0374 0.0644 0.0644 0.1275 0.1275 0.1318 0.1318 0.1909 0.1909 0.1926 0.1926 0.3550 0.3550 0.3710 0.3710 0.4208 0.4208 0.4258 0.4258 0.4375 0.4375 0.4471 0.4471 0.4681 0.4681 0.4703 0.4703 0.5448 0.5448 0.5628 0.5628 0.5840 0.5840 0.5883 0.5883 0.6371 0.6371 0.6385 0.6385 0.8385 0.8385 0.8698 0.8698 2.2110 2.2110 2.2445 2.2445 3.1699 3.1699 3.1920 3.1920 4.2208 4.2208 4.2339 4.2339 4.9194 4.9194 4.9317 4.9317 5.9025 5.9025 5.9722 5.9722 6.5956 6.5956 6.6144 6.6144 9.1516 9.1516 9.1708 9.1708 10.4058 10.4058 10.4096 10.4096 10.8875 10.8875 10.9374 10.9374 12.2162 12.2162 12.2286 12.2286 12.2454 12.2454 k = 0.1429 0.5000-0.0000 ( 6730 PWs) bands (ev): -4.2623 -4.2623 -4.2622 -4.2622 -3.4051 -3.4051 -3.4049 -3.4049 -0.3545 -0.3545 -0.3511 -0.3511 -0.1917 -0.1917 -0.1827 -0.1827 -0.0832 -0.0832 -0.0812 -0.0812 -0.0068 -0.0068 0.0067 0.0067 0.0379 0.0379 0.0674 0.0674 0.1289 0.1289 0.1326 0.1326 0.1912 0.1912 0.1936 0.1936 0.3521 0.3521 0.3701 0.3701 0.4185 0.4185 0.4240 0.4240 0.4365 0.4365 0.4476 0.4476 0.4677 0.4677 0.4700 0.4700 0.5415 0.5415 0.5622 0.5622 0.5814 0.5814 0.5871 0.5871 0.6353 0.6353 0.6368 0.6368 0.8266 0.8266 0.8614 0.8614 2.2093 2.2093 2.2454 2.2454 3.1432 3.1432 3.1650 3.1650 4.2736 4.2736 4.2964 4.2964 4.8889 4.8889 4.8923 4.8923 5.8973 5.8973 5.9660 5.9660 6.6100 6.6100 6.6264 6.6264 9.2407 9.2407 9.2615 9.2615 10.3724 10.3724 10.3743 10.3743 10.8719 10.8719 10.9181 10.9181 12.1959 12.1959 12.2144 12.2144 12.2554 12.2554 k = 0.1607 0.5000-0.0000 ( 6726 PWs) bands (ev): -4.2515 -4.2515 -4.2513 -4.2513 -3.4170 -3.4170 -3.4168 -3.4168 -0.3485 -0.3485 -0.3446 -0.3446 -0.1893 -0.1893 -0.1794 -0.1794 -0.0819 -0.0819 -0.0797 -0.0797 -0.0076 -0.0076 0.0056 0.0056 0.0390 0.0390 0.0704 0.0704 0.1305 0.1305 0.1333 0.1333 0.1917 0.1917 0.1948 0.1948 0.3491 0.3491 0.3688 0.3688 0.4160 0.4160 0.4221 0.4221 0.4353 0.4353 0.4479 0.4479 0.4672 0.4672 0.4696 0.4696 0.5380 0.5380 0.5612 0.5612 0.5784 0.5784 0.5859 0.5859 0.6333 0.6333 0.6348 0.6348 0.8131 0.8131 0.8512 0.8512 2.2090 2.2090 2.2469 2.2469 3.1205 3.1205 3.1413 3.1413 4.3078 4.3078 4.3423 4.3423 4.8719 4.8719 4.8794 4.8794 5.8803 5.8803 5.9458 5.9458 6.6360 6.6360 6.6484 6.6484 9.3357 9.3357 9.3574 9.3574 10.3180 10.3180 10.3276 10.3276 10.8741 10.8741 10.9148 10.9148 12.1521 12.1521 12.1686 12.1686 12.2784 12.2784 k = 0.1786 0.5000-0.0000 ( 6724 PWs) bands (ev): -4.2395 -4.2395 -4.2392 -4.2392 -3.4302 -3.4302 -3.4299 -3.4299 -0.3419 -0.3419 -0.3375 -0.3375 -0.1867 -0.1867 -0.1760 -0.1760 -0.0803 -0.0803 -0.0780 -0.0780 -0.0083 -0.0083 0.0042 0.0042 0.0406 0.0406 0.0736 0.0736 0.1323 0.1323 0.1337 0.1337 0.1922 0.1922 0.1961 0.1961 0.3459 0.3459 0.3672 0.3672 0.4134 0.4134 0.4200 0.4200 0.4341 0.4341 0.4481 0.4481 0.4667 0.4667 0.4691 0.4691 0.5345 0.5345 0.5600 0.5600 0.5753 0.5753 0.5845 0.5845 0.6311 0.6311 0.6327 0.6327 0.7980 0.7980 0.8391 0.8391 2.2104 2.2104 2.2494 2.2494 3.1017 3.1017 3.1211 3.1211 4.3168 4.3168 4.3619 4.3619 4.8799 4.8799 4.8975 4.8975 5.8529 5.8529 5.9139 5.9139 6.6717 6.6717 6.6793 6.6793 9.4350 9.4350 9.4565 9.4565 10.2508 10.2508 10.2690 10.2690 10.8902 10.8902 10.9252 10.9252 12.0993 12.0993 12.1137 12.1137 12.3044 12.3044 k = 0.1964 0.5000-0.0000 ( 6726 PWs) bands (ev): -4.2263 -4.2263 -4.2261 -4.2261 -3.4446 -3.4446 -3.4443 -3.4443 -0.3348 -0.3348 -0.3300 -0.3300 -0.1839 -0.1839 -0.1725 -0.1725 -0.0784 -0.0784 -0.0759 -0.0759 -0.0088 -0.0088 0.0026 0.0026 0.0427 0.0427 0.0769 0.0769 0.1338 0.1338 0.1343 0.1343 0.1928 0.1928 0.1977 0.1977 0.3426 0.3426 0.3652 0.3652 0.4107 0.4107 0.4177 0.4177 0.4327 0.4327 0.4482 0.4482 0.4662 0.4662 0.4686 0.4686 0.5311 0.5311 0.5583 0.5583 0.5722 0.5722 0.5830 0.5830 0.6289 0.6289 0.6304 0.6304 0.7816 0.7816 0.8252 0.8252 2.2139 2.2139 2.2533 2.2533 3.0866 3.0866 3.1041 3.1041 4.3006 4.3006 4.3524 4.3524 4.9194 4.9194 4.9431 4.9431 5.8172 5.8172 5.8734 5.8734 6.7146 6.7146 6.7174 6.7174 9.5362 9.5362 9.5553 9.5553 10.1763 10.1763 10.2043 10.2043 10.9148 10.9148 10.9449 10.9449 12.0436 12.0436 12.0573 12.0573 12.3323 12.3323 k = 0.2143 0.5000-0.0000 ( 6732 PWs) bands (ev): -4.2121 -4.2121 -4.2118 -4.2118 -3.4600 -3.4600 -3.4597 -3.4597 -0.3273 -0.3273 -0.3222 -0.3222 -0.1809 -0.1809 -0.1691 -0.1691 -0.0762 -0.0762 -0.0733 -0.0733 -0.0091 -0.0091 0.0009 0.0009 0.0452 0.0452 0.0803 0.0803 0.1337 0.1337 0.1363 0.1363 0.1935 0.1935 0.1995 0.1995 0.3392 0.3392 0.3627 0.3627 0.4080 0.4080 0.4154 0.4154 0.4314 0.4314 0.4481 0.4481 0.4657 0.4657 0.4680 0.4680 0.5276 0.5276 0.5560 0.5560 0.5693 0.5693 0.5813 0.5813 0.6266 0.6266 0.6279 0.6279 0.7639 0.7639 0.8096 0.8096 2.2196 2.2196 2.2586 2.2586 3.0751 3.0751 3.0902 3.0902 4.2653 4.2653 4.3197 4.3197 4.9840 4.9840 5.0100 5.0100 5.7757 5.7757 5.8271 5.8271 6.7606 6.7606 6.7622 6.7622 9.6352 9.6352 9.6476 9.6476 10.1006 10.1006 10.1421 10.1421 10.9432 10.9432 10.9690 10.9690 11.9903 11.9903 12.0047 12.0047 12.3599 12.3599 k = 0.2321 0.5000-0.0000 ( 6740 PWs) bands (ev): -4.1968 -4.1968 -4.1966 -4.1966 -3.4766 -3.4766 -3.4763 -3.4763 -0.3195 -0.3195 -0.3140 -0.3140 -0.1779 -0.1779 -0.1659 -0.1659 -0.0736 -0.0736 -0.0701 -0.0701 -0.0093 -0.0093 -0.0006 -0.0006 0.0481 0.0481 0.0837 0.0837 0.1333 0.1333 0.1383 0.1383 0.1944 0.1944 0.2015 0.2015 0.3359 0.3359 0.3598 0.3598 0.4052 0.4052 0.4129 0.4129 0.4301 0.4301 0.4479 0.4479 0.4652 0.4652 0.4674 0.4674 0.5243 0.5243 0.5529 0.5529 0.5668 0.5668 0.5794 0.5794 0.6242 0.6242 0.6253 0.6253 0.7451 0.7451 0.7925 0.7925 2.2276 2.2276 2.2657 2.2657 3.0668 3.0668 3.0790 3.0790 4.2179 4.2179 4.2727 4.2727 5.0648 5.0648 5.0907 5.0907 5.7304 5.7304 5.7773 5.7773 6.8073 6.8073 6.8125 6.8125 9.7194 9.7194 9.7219 9.7219 10.0350 10.0350 10.0976 10.0976 10.9713 10.9713 10.9931 10.9931 11.9444 11.9444 11.9606 11.9606 12.3892 12.3892 k = 0.2500 0.5000-0.0000 ( 6754 PWs) bands (ev): -4.1806 -4.1806 -4.1804 -4.1804 -3.4941 -3.4941 -3.4938 -3.4938 -0.3115 -0.3115 -0.3057 -0.3057 -0.1749 -0.1749 -0.1630 -0.1630 -0.0706 -0.0706 -0.0663 -0.0663 -0.0093 -0.0093 -0.0020 -0.0020 0.0513 0.0513 0.0871 0.0871 0.1326 0.1326 0.1403 0.1403 0.1955 0.1955 0.2037 0.2037 0.3325 0.3325 0.3565 0.3565 0.4023 0.4023 0.4102 0.4102 0.4288 0.4288 0.4476 0.4476 0.4646 0.4646 0.4668 0.4668 0.5211 0.5211 0.5490 0.5490 0.5647 0.5647 0.5771 0.5771 0.6219 0.6219 0.6223 0.6223 0.7257 0.7257 0.7742 0.7742 2.2381 2.2381 2.2747 2.2747 3.0612 3.0612 3.0703 3.0703 4.1637 4.1637 4.2180 4.2180 5.1548 5.1548 5.1797 5.1797 5.6834 5.6834 5.7260 5.7260 6.8558 6.8558 6.8641 6.8641 9.7450 9.7450 9.7654 9.7654 10.0103 10.0103 10.0967 10.0967 10.9958 10.9958 11.0134 11.0134 11.9108 11.9108 11.9294 11.9294 12.4200 12.4200 k = 0.2679 0.5000-0.0000 ( 6746 PWs) bands (ev): -4.1635 -4.1635 -4.1633 -4.1633 -3.5125 -3.5125 -3.5123 -3.5123 -0.3033 -0.3033 -0.2973 -0.2973 -0.1720 -0.1720 -0.1605 -0.1605 -0.0670 -0.0670 -0.0617 -0.0617 -0.0091 -0.0091 -0.0031 -0.0031 0.0547 0.0547 0.0906 0.0906 0.1316 0.1316 0.1422 0.1422 0.1969 0.1969 0.2061 0.2061 0.3292 0.3292 0.3526 0.3526 0.3995 0.3995 0.4075 0.4075 0.4276 0.4276 0.4472 0.4472 0.4641 0.4641 0.4662 0.4662 0.5180 0.5180 0.5443 0.5443 0.5629 0.5629 0.5744 0.5744 0.6191 0.6191 0.6196 0.6196 0.7062 0.7062 0.7550 0.7550 2.2511 2.2511 2.2857 2.2857 3.0579 3.0579 3.0636 3.0636 4.1061 4.1061 4.1596 4.1596 5.2491 5.2491 5.2729 5.2729 5.6364 5.6364 5.6750 5.6750 6.9052 6.9052 6.9158 6.9158 9.7153 9.7153 9.7359 9.7359 10.0554 10.0554 10.1477 10.1477 11.0152 11.0152 11.0276 11.0276 11.8936 11.8936 11.9143 11.9143 12.4523 12.4523 k = 0.2857 0.5000-0.0000 ( 6744 PWs) bands (ev): -4.1456 -4.1456 -4.1453 -4.1453 -3.5318 -3.5318 -3.5315 -3.5315 -0.2951 -0.2951 -0.2889 -0.2889 -0.1694 -0.1694 -0.1585 -0.1585 -0.0628 -0.0628 -0.0563 -0.0563 -0.0085 -0.0085 -0.0037 -0.0037 0.0583 0.0583 0.0939 0.0939 0.1304 0.1304 0.1439 0.1439 0.1986 0.1986 0.2087 0.2087 0.3259 0.3259 0.3483 0.3483 0.3967 0.3967 0.4046 0.4046 0.4265 0.4265 0.4468 0.4468 0.4635 0.4635 0.4656 0.4656 0.5149 0.5149 0.5391 0.5391 0.5612 0.5612 0.5711 0.5711 0.6153 0.6153 0.6172 0.6172 0.6872 0.6872 0.7354 0.7354 2.2663 2.2663 2.2985 2.2985 3.0565 3.0565 3.0586 3.0586 4.0476 4.0476 4.1001 4.1001 5.3435 5.3435 5.3666 5.3666 5.5921 5.5921 5.6265 5.6265 6.9543 6.9543 6.9667 6.9667 9.6535 9.6535 9.6672 9.6672 10.1341 10.1341 10.2251 10.2251 11.0302 11.0302 11.0363 11.0363 11.8950 11.8950 11.9173 11.9173 12.4858 12.4858 k = 0.3036 0.5000-0.0000 ( 6742 PWs) bands (ev): -4.1270 -4.1270 -4.1267 -4.1267 -3.5517 -3.5517 -3.5514 -3.5514 -0.2869 -0.2869 -0.2807 -0.2807 -0.1670 -0.1670 -0.1570 -0.1570 -0.0581 -0.0581 -0.0503 -0.0503 -0.0075 -0.0075 -0.0038 -0.0038 0.0620 0.0620 0.0970 0.0970 0.1289 0.1289 0.1453 0.1453 0.2005 0.2005 0.2115 0.2115 0.3228 0.3228 0.3434 0.3434 0.3939 0.3939 0.4014 0.4014 0.4255 0.4255 0.4463 0.4463 0.4630 0.4630 0.4651 0.4651 0.5119 0.5119 0.5333 0.5333 0.5597 0.5597 0.5669 0.5669 0.6107 0.6107 0.6147 0.6147 0.6700 0.6700 0.7158 0.7158 2.2835 2.2835 2.3131 2.3131 3.0549 3.0549 3.0564 3.0564 3.9895 3.9895 4.0410 4.0410 5.4280 5.4280 5.4524 5.4524 5.5596 5.5596 5.5878 5.5878 7.0025 7.0025 7.0160 7.0160 9.5792 9.5792 9.5876 9.5876 10.2149 10.2149 10.3057 10.3057 11.0437 11.0437 11.0447 11.0447 11.9150 11.9150 11.9379 11.9379 12.5200 12.5200 k = 0.3214 0.5000-0.0000 ( 6742 PWs) bands (ev): -4.1078 -4.1078 -4.1075 -4.1075 -3.5721 -3.5721 -3.5719 -3.5719 -0.2789 -0.2789 -0.2727 -0.2727 -0.1651 -0.1651 -0.1561 -0.1561 -0.0530 -0.0530 -0.0438 -0.0438 -0.0058 -0.0058 -0.0032 -0.0032 0.0658 0.0658 0.0997 0.0997 0.1274 0.1274 0.1465 0.1465 0.2029 0.2029 0.2145 0.2145 0.3198 0.3198 0.3380 0.3380 0.3911 0.3911 0.3981 0.3981 0.4246 0.4246 0.4458 0.4458 0.4624 0.4624 0.4645 0.4645 0.5087 0.5087 0.5270 0.5270 0.5582 0.5582 0.5614 0.5614 0.6052 0.6052 0.6120 0.6120 0.6556 0.6556 0.6969 0.6969 2.3025 2.3025 2.3293 2.3293 3.0521 3.0521 3.0571 3.0571 3.9332 3.9332 3.9835 3.9835 5.4579 5.4579 5.4874 5.4874 5.5826 5.5826 5.6011 5.6011 7.0489 7.0489 7.0630 7.0630 9.5009 9.5009 9.5058 9.5058 10.2847 10.2847 10.3752 10.3752 11.0579 11.0579 11.0655 11.0655 11.9514 11.9514 11.9741 11.9741 12.5548 12.5548 k = 0.3393 0.5000-0.0000 ( 6750 PWs) bands (ev): -4.0881 -4.0881 -4.0878 -4.0878 -3.5930 -3.5930 -3.5928 -3.5928 -0.2712 -0.2712 -0.2651 -0.2651 -0.1636 -0.1636 -0.1558 -0.1558 -0.0477 -0.0477 -0.0374 -0.0374 -0.0030 -0.0030 -0.0016 -0.0016 0.0696 0.0696 0.1019 0.1019 0.1259 0.1259 0.1473 0.1473 0.2057 0.2057 0.2177 0.2177 0.3168 0.3168 0.3320 0.3320 0.3884 0.3884 0.3945 0.3945 0.4239 0.4239 0.4453 0.4453 0.4618 0.4618 0.4640 0.4640 0.5049 0.5049 0.5202 0.5202 0.5543 0.5543 0.5567 0.5567 0.5989 0.5989 0.6089 0.6089 0.6449 0.6449 0.6793 0.6793 2.3230 2.3230 2.3467 2.3467 3.0499 3.0499 3.0583 3.0583 3.8795 3.8795 3.9284 3.9284 5.4316 5.4316 5.4592 5.4592 5.6620 5.6620 5.6779 5.6779 7.0930 7.0930 7.1073 7.1073 9.4227 9.4227 9.4252 9.4252 10.3362 10.3362 10.4238 10.4238 11.0882 11.0882 11.0996 11.0996 12.0011 12.0011 12.0228 12.0228 12.5895 12.5895 k = 0.3571 0.5000-0.0000 ( 6744 PWs) bands (ev): -4.0681 -4.0681 -4.0678 -4.0678 -3.6141 -3.6141 -3.6140 -3.6140 -0.2638 -0.2638 -0.2580 -0.2580 -0.1626 -0.1626 -0.1559 -0.1559 -0.0426 -0.0426 -0.0319 -0.0319 0.0014 0.0014 0.0015 0.0015 0.0732 0.0732 0.1031 0.1031 0.1248 0.1248 0.1476 0.1476 0.2091 0.2091 0.2212 0.2212 0.3138 0.3138 0.3254 0.3254 0.3857 0.3857 0.3907 0.3907 0.4233 0.4233 0.4450 0.4450 0.4612 0.4612 0.4635 0.4635 0.4999 0.4999 0.5130 0.5130 0.5461 0.5461 0.5550 0.5550 0.5930 0.5930 0.6053 0.6053 0.6376 0.6376 0.6638 0.6638 2.3443 2.3443 2.3649 2.3649 3.0481 3.0481 3.0594 3.0594 3.8295 3.8295 3.8764 3.8764 5.3967 5.3967 5.4213 5.4213 5.7494 5.7494 5.7638 5.7638 7.1342 7.1342 7.1482 7.1482 9.3467 9.3467 9.3478 9.3478 10.3663 10.3663 10.4472 10.4472 11.1397 11.1397 11.1513 11.1513 12.0606 12.0606 12.0805 12.0805 12.6237 12.6237 k = 0.3750 0.5000-0.0000 ( 6750 PWs) bands (ev): -4.0480 -4.0480 -4.0477 -4.0477 -3.6352 -3.6352 -3.6351 -3.6351 -0.2568 -0.2568 -0.2514 -0.2514 -0.1621 -0.1621 -0.1565 -0.1565 -0.0379 -0.0379 -0.0277 -0.0277 0.0058 0.0058 0.0081 0.0081 0.0766 0.0766 0.1029 0.1029 0.1244 0.1244 0.1475 0.1475 0.2130 0.2130 0.2249 0.2249 0.3106 0.3106 0.3183 0.3183 0.3832 0.3832 0.3866 0.3866 0.4228 0.4228 0.4447 0.4447 0.4606 0.4606 0.4631 0.4631 0.4930 0.4930 0.5055 0.5055 0.5383 0.5383 0.5531 0.5531 0.5880 0.5880 0.6009 0.6009 0.6328 0.6328 0.6511 0.6511 2.3660 2.3660 2.3835 2.3835 3.0465 3.0465 3.0601 3.0601 3.7838 3.7838 3.8283 3.8283 5.3629 5.3629 5.3844 5.3844 5.8342 5.8342 5.8472 5.8472 7.1720 7.1720 7.1853 7.1853 9.2748 9.2748 9.2749 9.2749 10.3769 10.3769 10.4481 10.4481 11.2109 11.2109 11.2199 11.2199 12.1272 12.1272 12.1444 12.1444 12.6569 12.6569 k = 0.3929 0.5000-0.0000 ( 6742 PWs) bands (ev): -4.0281 -4.0281 -4.0278 -4.0278 -3.6560 -3.6560 -3.6559 -3.6559 -0.2503 -0.2503 -0.2454 -0.2454 -0.1619 -0.1619 -0.1573 -0.1573 -0.0341 -0.0341 -0.0251 -0.0251 0.0119 0.0119 0.0166 0.0166 0.0797 0.0797 0.1011 0.1011 0.1249 0.1249 0.1469 0.1469 0.2177 0.2177 0.2288 0.2288 0.3070 0.3070 0.3108 0.3108 0.3807 0.3807 0.3824 0.3824 0.4225 0.4225 0.4446 0.4446 0.4600 0.4600 0.4626 0.4626 0.4840 0.4840 0.4979 0.4979 0.5324 0.5324 0.5509 0.5509 0.5841 0.5841 0.5957 0.5957 0.6295 0.6295 0.6416 0.6416 2.3873 2.3873 2.4018 2.4018 3.0449 3.0449 3.0599 3.0599 3.7434 3.7434 3.7845 3.7845 5.3323 5.3323 5.3508 5.3508 5.9132 5.9132 5.9247 5.9247 7.2059 7.2059 7.2180 7.2180 9.2080 9.2080 9.2085 9.2085 10.3733 10.3733 10.4336 10.4336 11.2950 11.2950 11.3006 11.3006 12.1984 12.1984 12.2119 12.2119 12.6882 12.6882 k = 0.4107 0.5000-0.0000 ( 6734 PWs) bands (ev): -4.0088 -4.0088 -4.0086 -4.0086 -3.6761 -3.6761 -3.6760 -3.6760 -0.2445 -0.2445 -0.2402 -0.2402 -0.1621 -0.1621 -0.1584 -0.1584 -0.0311 -0.0311 -0.0235 -0.0235 0.0195 0.0195 0.0264 0.0264 0.0821 0.0821 0.0978 0.0978 0.1261 0.1261 0.1459 0.1459 0.2231 0.2231 0.2332 0.2332 0.3027 0.3027 0.3028 0.3028 0.3782 0.3782 0.3783 0.3783 0.4225 0.4225 0.4445 0.4445 0.4593 0.4593 0.4620 0.4620 0.4741 0.4741 0.4904 0.4904 0.5290 0.5290 0.5483 0.5483 0.5813 0.5813 0.5904 0.5904 0.6273 0.6273 0.6349 0.6349 2.4076 2.4076 2.4193 2.4193 3.0433 3.0433 3.0588 3.0588 3.7089 3.7089 3.7457 3.7457 5.3057 5.3057 5.3212 5.3212 5.9845 5.9845 5.9943 5.9943 7.2354 7.2354 7.2461 7.2461 9.1483 9.1483 9.1491 9.1491 10.3616 10.3616 10.4110 10.4110 11.3839 11.3839 11.3867 11.3867 12.2729 12.2729 12.2814 12.2814 12.7170 12.7170 k = 0.4286 0.5000-0.0000 ( 6750 PWs) bands (ev): -3.9906 -3.9906 -3.9904 -3.9904 -3.6949 -3.6949 -3.6948 -3.6948 -0.2394 -0.2394 -0.2358 -0.2358 -0.1625 -0.1625 -0.1597 -0.1597 -0.0288 -0.0288 -0.0228 -0.0228 0.0280 0.0280 0.0367 0.0367 0.0836 0.0836 0.0934 0.0934 0.1278 0.1278 0.1443 0.1443 0.2295 0.2295 0.2378 0.2378 0.2945 0.2945 0.2973 0.2973 0.3744 0.3744 0.3759 0.3759 0.4228 0.4228 0.4443 0.4443 0.4585 0.4585 0.4599 0.4599 0.4661 0.4661 0.4833 0.4833 0.5274 0.5274 0.5452 0.5452 0.5790 0.5790 0.5855 0.5855 0.6257 0.6257 0.6305 0.6305 2.4261 2.4261 2.4350 2.4350 3.0420 3.0420 3.0566 3.0566 3.6810 3.6810 3.7123 3.7123 5.2836 5.2836 5.2961 5.2961 6.0462 6.0462 6.0542 6.0542 7.2602 7.2602 7.2691 7.2691 9.0972 9.0972 9.0981 9.0981 10.3470 10.3470 10.3858 10.3858 11.4704 11.4704 11.4712 11.4712 12.3494 12.3494 12.3519 12.3519 12.7425 12.7425 k = 0.4464 0.5000-0.0000 ( 6746 PWs) bands (ev): -3.9744 -3.9744 -3.9743 -3.9743 -3.7116 -3.7116 -3.7116 -3.7116 -0.2352 -0.2352 -0.2324 -0.2324 -0.1629 -0.1629 -0.1609 -0.1609 -0.0270 -0.0270 -0.0225 -0.0225 0.0370 0.0370 0.0468 0.0468 0.0839 0.0839 0.0881 0.0881 0.1296 0.1296 0.1424 0.1424 0.2368 0.2368 0.2431 0.2431 0.2862 0.2862 0.2905 0.2905 0.3713 0.3713 0.3736 0.3736 0.4235 0.4235 0.4430 0.4430 0.4549 0.4549 0.4577 0.4577 0.4638 0.4638 0.4770 0.4770 0.5272 0.5272 0.5419 0.5419 0.5775 0.5775 0.5816 0.5816 0.6247 0.6247 0.6276 0.6276 2.4418 2.4418 2.4482 2.4482 3.0411 3.0411 3.0535 3.0535 3.6600 3.6600 3.6848 3.6848 5.2665 5.2665 5.2759 5.2759 6.0966 6.0966 6.1027 6.1027 7.2800 7.2800 7.2870 7.2870 9.0559 9.0559 9.0567 9.0567 10.3333 10.3333 10.3620 10.3620 11.5475 11.5475 11.5475 11.5475 12.4228 12.4228 12.4272 12.4272 12.7640 12.7640 k = 0.4643 0.5000-0.0000 ( 6752 PWs) bands (ev): -3.9613 -3.9613 -3.9612 -3.9612 -3.7251 -3.7251 -3.7251 -3.7251 -0.2319 -0.2319 -0.2300 -0.2300 -0.1633 -0.1633 -0.1619 -0.1619 -0.0257 -0.0257 -0.0226 -0.0226 0.0461 0.0461 0.0559 0.0559 0.0823 0.0823 0.0828 0.0828 0.1315 0.1315 0.1402 0.1402 0.2450 0.2450 0.2488 0.2488 0.2779 0.2779 0.2825 0.2825 0.3694 0.3694 0.3716 0.3716 0.4249 0.4249 0.4392 0.4392 0.4523 0.4523 0.4566 0.4566 0.4637 0.4637 0.4719 0.4719 0.5281 0.5281 0.5384 0.5384 0.5765 0.5765 0.5788 0.5788 0.6241 0.6241 0.6257 0.6257 2.4540 2.4540 2.4582 2.4582 3.0410 3.0410 3.0500 3.0500 3.6463 3.6463 3.6635 3.6635 5.2546 5.2546 5.2608 5.2608 6.1342 6.1342 6.1383 6.1383 7.2946 7.2946 7.2994 7.2994 9.0255 9.0255 9.0261 9.0261 10.3231 10.3231 10.3420 10.3420 11.6086 11.6086 11.6088 11.6088 12.4938 12.4938 12.5048 12.5048 12.7806 12.7806 k = 0.4821 0.5000-0.0000 ( 6748 PWs) bands (ev): -3.9525 -3.9525 -3.9525 -3.9525 -3.7341 -3.7341 -3.7341 -3.7341 -0.2296 -0.2296 -0.2287 -0.2287 -0.1634 -0.1634 -0.1628 -0.1628 -0.0245 -0.0245 -0.0230 -0.0230 0.0546 0.0546 0.0623 0.0623 0.0772 0.0772 0.0803 0.0803 0.1335 0.1335 0.1379 0.1379 0.2540 0.2540 0.2551 0.2551 0.2699 0.2699 0.2734 0.2734 0.3686 0.3686 0.3699 0.3699 0.4271 0.4271 0.4344 0.4344 0.4525 0.4525 0.4552 0.4552 0.4644 0.4644 0.4682 0.4682 0.5298 0.5298 0.5351 0.5351 0.5760 0.5760 0.5771 0.5771 0.6239 0.6239 0.6246 0.6246 2.4621 2.4621 2.4641 2.4641 3.0418 3.0418 3.0466 3.0466 3.6399 3.6399 3.6487 3.6487 5.2480 5.2480 5.2511 5.2511 6.1577 6.1577 6.1598 6.1598 7.3039 7.3039 7.3063 7.3063 9.0070 9.0070 9.0073 9.0073 10.3182 10.3182 10.3276 10.3276 11.6484 11.6484 11.6485 11.6485 12.5611 12.5611 12.5744 12.5744 12.7909 12.7909 k = 0.5000 0.5000-0.0000 ( 6728 PWs) bands (ev): -3.9494 -3.9494 -3.9494 -3.9494 -3.7372 -3.7372 -3.7372 -3.7372 -0.2285 -0.2285 -0.2285 -0.2285 -0.1632 -0.1632 -0.1632 -0.1632 -0.0236 -0.0236 -0.0236 -0.0236 0.0615 0.0615 0.0615 0.0615 0.0770 0.0770 0.0770 0.0770 0.1357 0.1357 0.1357 0.1357 0.2616 0.2616 0.2616 0.2616 0.2644 0.2644 0.2644 0.2644 0.3688 0.3688 0.3688 0.3688 0.4303 0.4303 0.4303 0.4303 0.4537 0.4537 0.4537 0.4537 0.4658 0.4658 0.4658 0.4658 0.5322 0.5322 0.5322 0.5322 0.5762 0.5762 0.5762 0.5762 0.6240 0.6240 0.6240 0.6240 2.4654 2.4654 2.4654 2.4654 3.0438 3.0438 3.0438 3.0438 3.6408 3.6408 3.6408 3.6408 5.2468 5.2468 5.2468 5.2468 6.1663 6.1663 6.1663 6.1663 7.3078 7.3078 7.3078 7.3078 9.0008 9.0008 9.0008 9.0008 10.3196 10.3196 10.3196 10.3196 11.6622 11.6622 11.6622 11.6622 12.6028 12.6028 12.6028 12.6028 12.7864 12.7864 k = 0.5000 0.5000-0.0000 ( 6728 PWs) bands (ev): -3.9494 -3.9494 -3.9494 -3.9494 -3.7372 -3.7372 -3.7372 -3.7372 -0.2285 -0.2285 -0.2285 -0.2285 -0.1632 -0.1632 -0.1632 -0.1632 -0.0236 -0.0236 -0.0236 -0.0236 0.0615 0.0615 0.0615 0.0615 0.0770 0.0770 0.0770 0.0770 0.1357 0.1357 0.1357 0.1357 0.2616 0.2616 0.2616 0.2616 0.2644 0.2644 0.2644 0.2644 0.3688 0.3688 0.3688 0.3688 0.4303 0.4303 0.4303 0.4303 0.4537 0.4537 0.4537 0.4537 0.4658 0.4658 0.4658 0.4658 0.5322 0.5322 0.5322 0.5322 0.5762 0.5762 0.5762 0.5762 0.6240 0.6240 0.6240 0.6240 2.4654 2.4654 2.4654 2.4654 3.0438 3.0438 3.0438 3.0438 3.6408 3.6408 3.6408 3.6408 5.2468 5.2468 5.2468 5.2468 6.1663 6.1663 6.1663 6.1663 7.3078 7.3078 7.3078 7.3078 9.0008 9.0008 9.0008 9.0008 10.3196 10.3196 10.3196 10.3196 11.6622 11.6622 11.6622 11.6622 12.6028 12.6028 12.6028 12.6028 12.7864 12.7864 k = 0.4872 0.4872-0.0000 ( 6750 PWs) bands (ev): -3.9565 -3.9565 -3.9486 -3.9486 -3.7367 -3.7367 -3.7313 -3.7313 -0.2299 -0.2299 -0.2285 -0.2285 -0.1637 -0.1637 -0.1625 -0.1625 -0.0246 -0.0246 -0.0230 -0.0230 0.0540 0.0540 0.0636 0.0636 0.0748 0.0748 0.0818 0.0818 0.1334 0.1334 0.1380 0.1380 0.2509 0.2509 0.2606 0.2606 0.2659 0.2659 0.2751 0.2751 0.3683 0.3683 0.3702 0.3702 0.4271 0.4271 0.4345 0.4345 0.4524 0.4524 0.4552 0.4552 0.4646 0.4646 0.4681 0.4681 0.5298 0.5298 0.5352 0.5352 0.5760 0.5760 0.5771 0.5771 0.6239 0.6239 0.6246 0.6246 2.4603 2.4603 2.4658 2.4658 3.0360 3.0360 3.0525 3.0525 3.6390 3.6390 3.6497 3.6497 5.2476 5.2476 5.2516 5.2516 6.1539 6.1539 6.1632 6.1632 7.2992 7.2992 7.3109 7.3109 8.9979 8.9979 9.0167 9.0167 10.3152 10.3152 10.3308 10.3308 11.6343 11.6343 11.6621 11.6621 12.5494 12.5494 12.5831 12.5831 12.7794 12.7794 k = 0.4744 0.4744-0.0000 ( 6750 PWs) bands (ev): -3.9756 -3.9756 -3.9463 -3.9463 -3.7351 -3.7351 -3.7156 -3.7156 -0.2330 -0.2330 -0.2288 -0.2288 -0.1647 -0.1647 -0.1606 -0.1606 -0.0260 -0.0260 -0.0224 -0.0224 0.0440 0.0440 0.0616 0.0616 0.0718 0.0718 0.0893 0.0893 0.1309 0.1309 0.1408 0.1408 0.2390 0.2390 0.2598 0.2598 0.2696 0.2696 0.2857 0.2857 0.3677 0.3677 0.3732 0.3732 0.4251 0.4251 0.4394 0.4394 0.4520 0.4520 0.4562 0.4562 0.4653 0.4653 0.4711 0.4711 0.5279 0.5279 0.5387 0.5387 0.5761 0.5761 0.5792 0.5792 0.6241 0.6241 0.6258 0.6258 2.4462 2.4462 2.4662 2.4662 3.0148 3.0148 3.0767 3.0767 3.6405 3.6405 3.6688 3.6688 5.2522 5.2522 5.2640 5.2640 6.1179 6.1179 6.1533 6.1533 7.2741 7.2741 7.3196 7.3196 8.9891 8.9891 9.0635 9.0635 10.3067 10.3067 10.3592 10.3592 11.5573 11.5573 11.6621 11.6621 12.4457 12.4457 12.5379 12.5379 12.7391 12.7391 k = 0.4615 0.4615-0.0000 ( 6734 PWs) bands (ev): -4.0030 -4.0030 -3.9423 -3.9423 -3.7325 -3.7325 -3.6940 -3.6940 -0.2379 -0.2379 -0.2295 -0.2295 -0.1663 -0.1663 -0.1578 -0.1578 -0.0280 -0.0280 -0.0217 -0.0217 0.0332 0.0332 0.0570 0.0570 0.0681 0.0681 0.0969 0.0969 0.1279 0.1279 0.1444 0.1444 0.2276 0.2276 0.2600 0.2600 0.2741 0.2741 0.2949 0.2949 0.3670 0.3670 0.3778 0.3778 0.4243 0.4243 0.4434 0.4434 0.4529 0.4529 0.4576 0.4576 0.4683 0.4683 0.4747 0.4747 0.5267 0.5267 0.5425 0.5425 0.5766 0.5766 0.5826 0.5826 0.6248 0.6248 0.6277 0.6277 2.4256 2.4256 2.4669 2.4669 2.9823 2.9823 3.1145 3.1145 3.6438 3.6438 3.6971 3.6971 5.2600 5.2600 5.2842 5.2842 6.0605 6.0605 6.1374 6.1374 7.2337 7.2337 7.3336 7.3336 8.9747 8.9747 9.1389 9.1389 10.2924 10.2924 10.4041 10.4041 11.4454 11.4454 11.6629 11.6629 12.3243 12.3243 12.4912 12.4912 12.6735 12.6735 k = 0.4487 0.4487-0.0000 ( 6748 PWs) bands (ev): -4.0356 -4.0356 -3.9369 -3.9369 -3.7288 -3.7288 -3.6694 -3.6694 -0.2441 -0.2441 -0.2304 -0.2304 -0.1685 -0.1685 -0.1547 -0.1547 -0.0310 -0.0310 -0.0211 -0.0211 0.0221 0.0221 0.0502 0.0502 0.0642 0.0642 0.1035 0.1035 0.1243 0.1243 0.1484 0.1484 0.2171 0.2171 0.2610 0.2610 0.2787 0.2787 0.3025 0.3025 0.3661 0.3661 0.3829 0.3829 0.4246 0.4246 0.4451 0.4451 0.4536 0.4536 0.4627 0.4627 0.4728 0.4728 0.4789 0.4789 0.5262 0.5262 0.5465 0.5465 0.5772 0.5772 0.5872 0.5872 0.6259 0.6259 0.6311 0.6311 2.4011 2.4011 2.4678 2.4678 2.9414 2.9414 3.1631 3.1631 3.6485 3.6485 3.7321 3.7321 5.2710 5.2710 5.3123 5.3123 5.9852 5.9852 6.1160 6.1160 7.1797 7.1797 7.3524 7.3524 8.9549 8.9549 9.2392 9.2392 10.2721 10.2721 10.4630 10.4630 11.3114 11.3114 11.6656 11.6656 12.1950 12.1950 12.4496 12.4496 12.5877 12.5877 k = 0.4359 0.4359-0.0000 ( 6750 PWs) bands (ev): -4.0714 -4.0714 -3.9299 -3.9299 -3.7240 -3.7240 -3.6438 -3.6438 -0.2514 -0.2514 -0.2315 -0.2315 -0.1712 -0.1712 -0.1515 -0.1515 -0.0351 -0.0351 -0.0205 -0.0205 0.0113 0.0113 0.0420 0.0420 0.0607 0.0607 0.1088 0.1088 0.1202 0.1202 0.1530 0.1530 0.2080 0.2080 0.2626 0.2626 0.2834 0.2834 0.3085 0.3085 0.3654 0.3654 0.3879 0.3879 0.4260 0.4260 0.4455 0.4455 0.4537 0.4537 0.4705 0.4705 0.4783 0.4783 0.4840 0.4840 0.5263 0.5263 0.5505 0.5505 0.5781 0.5781 0.5926 0.5926 0.6273 0.6273 0.6368 0.6368 2.3753 2.3753 2.4687 2.4687 2.8945 2.8945 3.2201 3.2201 3.6547 3.6547 3.7712 3.7712 5.2853 5.2853 5.3479 5.3479 5.8956 5.8956 6.0897 6.0897 7.1143 7.1143 7.3752 7.3752 8.9301 8.9301 9.3609 9.3609 10.2455 10.2455 10.5317 10.5317 11.1639 11.1639 11.6721 11.6721 12.0616 12.0616 12.4154 12.4154 12.4868 12.4868 k = 0.4231 0.4231-0.0000 ( 6750 PWs) bands (ev): -4.1093 -4.1093 -3.9213 -3.9213 -3.7183 -3.7183 -3.6181 -3.6181 -0.2595 -0.2595 -0.2330 -0.2330 -0.1743 -0.1743 -0.1488 -0.1488 -0.0405 -0.0405 -0.0202 -0.0202 0.0010 0.0010 0.0330 0.0330 0.0575 0.0575 0.1117 0.1117 0.1166 0.1166 0.1576 0.1576 0.2005 0.2005 0.2647 0.2647 0.2879 0.2879 0.3136 0.3136 0.3649 0.3649 0.3921 0.3921 0.4282 0.4282 0.4458 0.4458 0.4541 0.4541 0.4781 0.4781 0.4850 0.4850 0.4904 0.4904 0.5274 0.5274 0.5543 0.5543 0.5793 0.5793 0.5978 0.5978 0.6291 0.6291 0.6462 0.6462 2.3503 2.3503 2.4695 2.4695 2.8437 2.8437 3.2838 3.2838 3.6622 3.6622 3.8127 3.8127 5.3028 5.3028 5.3906 5.3906 5.7953 5.7953 6.0594 6.0594 7.0399 7.0399 7.4014 7.4014 8.9007 8.9007 9.5000 9.5000 10.2124 10.2124 10.6057 10.6057 11.0082 11.0082 11.6848 11.6848 11.9265 11.9265 12.3733 12.3733 12.3914 12.3914 k = 0.4103 0.4103-0.0000 ( 6754 PWs) bands (ev): -4.1485 -4.1485 -3.9114 -3.9114 -3.7116 -3.7116 -3.5932 -3.5932 -0.2683 -0.2683 -0.2346 -0.2346 -0.1778 -0.1778 -0.1468 -0.1468 -0.0469 -0.0469 -0.0207 -0.0207 -0.0081 -0.0081 0.0238 0.0238 0.0549 0.0549 0.1091 0.1091 0.1168 0.1168 0.1617 0.1617 0.1953 0.1953 0.2670 0.2670 0.2920 0.2920 0.3179 0.3179 0.3646 0.3646 0.3954 0.3954 0.4306 0.4306 0.4461 0.4461 0.4551 0.4551 0.4841 0.4841 0.4927 0.4927 0.4977 0.4977 0.5296 0.5296 0.5578 0.5578 0.5810 0.5810 0.6021 0.6021 0.6312 0.6312 0.6602 0.6602 2.3277 2.3277 2.4702 2.4702 2.7905 2.7905 3.3528 3.3528 3.6710 3.6710 3.8552 3.8552 5.3236 5.3236 5.4396 5.4396 5.6881 5.6881 6.0259 6.0259 6.9587 6.9587 7.4301 7.4301 8.8672 8.8672 9.6529 9.6529 10.1728 10.1728 10.6791 10.6791 10.8477 10.8477 11.7058 11.7058 11.7913 11.7913 12.2571 12.2571 12.3724 12.3724 k = 0.3974 0.3974-0.0000 ( 6744 PWs) bands (ev): -4.1886 -4.1886 -3.9000 -3.9000 -3.7039 -3.7039 -3.5693 -3.5693 -0.2777 -0.2777 -0.2366 -0.2366 -0.1816 -0.1816 -0.1460 -0.1460 -0.0540 -0.0540 -0.0240 -0.0240 -0.0143 -0.0143 0.0147 0.0147 0.0528 0.0528 0.1042 0.1042 0.1175 0.1175 0.1647 0.1647 0.1931 0.1931 0.2695 0.2695 0.2957 0.2957 0.3218 0.3218 0.3648 0.3648 0.3980 0.3980 0.4329 0.4329 0.4466 0.4466 0.4567 0.4567 0.4892 0.4892 0.5010 0.5010 0.5046 0.5046 0.5333 0.5333 0.5609 0.5609 0.5831 0.5831 0.6052 0.6052 0.6337 0.6337 0.6783 0.6783 2.3089 2.3089 2.4704 2.4704 2.7358 2.7358 3.4259 3.4259 3.6812 3.6812 3.8978 3.8978 5.3477 5.3477 5.4904 5.4904 5.5804 5.5804 5.9899 5.9899 6.8729 6.8729 7.4607 7.4607 8.8299 8.8299 9.8160 9.8160 10.1268 10.1268 10.6824 10.6824 10.7485 10.7485 11.6579 11.6579 11.7360 11.7360 12.1405 12.1405 12.3623 12.3623 k = 0.3846 0.3846-0.0000 ( 6738 PWs) bands (ev): -4.2292 -4.2292 -3.8871 -3.8871 -3.6954 -3.6954 -3.5466 -3.5466 -0.2875 -0.2875 -0.2387 -0.2387 -0.1858 -0.1858 -0.1468 -0.1468 -0.0613 -0.0613 -0.0313 -0.0313 -0.0164 -0.0164 0.0062 0.0062 0.0512 0.0512 0.0992 0.0992 0.1170 0.1170 0.1661 0.1661 0.1942 0.1942 0.2720 0.2720 0.2989 0.2989 0.3253 0.3253 0.3656 0.3656 0.4002 0.4002 0.4347 0.4347 0.4474 0.4474 0.4591 0.4591 0.4941 0.4941 0.5095 0.5095 0.5102 0.5102 0.5388 0.5388 0.5637 0.5637 0.5858 0.5858 0.6075 0.6075 0.6364 0.6364 0.6996 0.6996 2.2951 2.2951 2.4700 2.4700 2.6805 2.6805 3.5025 3.5025 3.6926 3.6926 3.9398 3.9398 5.3750 5.3750 5.4499 5.4499 5.5669 5.5669 5.9520 5.9520 6.7846 6.7846 7.4926 7.4926 8.7894 8.7894 9.9848 9.9848 10.0746 10.0746 10.5194 10.5194 10.8027 10.8027 11.5283 11.5283 11.7658 11.7658 12.0407 12.0407 12.3590 12.3590 k = 0.3718 0.3718-0.0000 ( 6746 PWs) bands (ev): -4.2701 -4.2701 -3.8730 -3.8730 -3.6859 -3.6859 -3.5254 -3.5254 -0.2978 -0.2978 -0.2413 -0.2413 -0.1904 -0.1904 -0.1495 -0.1495 -0.0680 -0.0680 -0.0398 -0.0398 -0.0177 -0.0177 -0.0014 -0.0014 0.0499 0.0499 0.0943 0.0943 0.1154 0.1154 0.1666 0.1666 0.1977 0.1977 0.2744 0.2744 0.3018 0.3018 0.3287 0.3287 0.3668 0.3668 0.4021 0.4021 0.4361 0.4361 0.4482 0.4482 0.4620 0.4620 0.4988 0.4988 0.5143 0.5143 0.5182 0.5182 0.5455 0.5455 0.5661 0.5661 0.5891 0.5891 0.6092 0.6092 0.6396 0.6396 0.7224 0.7224 2.2872 2.2872 2.4686 2.4686 2.6252 2.6252 3.5819 3.5819 3.7053 3.7053 3.9808 3.9808 5.3363 5.3363 5.4066 5.4066 5.6295 5.6295 5.9129 5.9129 6.6961 6.6961 7.5252 7.5252 8.7459 8.7459 10.0169 10.0169 10.1504 10.1504 10.3598 10.3598 10.8415 10.8415 11.4062 11.4062 11.7517 11.7517 12.0062 12.0062 12.3611 12.3611 k = 0.3590 0.3590-0.0000 ( 6758 PWs) bands (ev): -4.3109 -4.3109 -3.8576 -3.8576 -3.6756 -3.6756 -3.5056 -3.5056 -0.3084 -0.3084 -0.2442 -0.2442 -0.1956 -0.1956 -0.1543 -0.1543 -0.0737 -0.0737 -0.0484 -0.0484 -0.0200 -0.0200 -0.0074 -0.0074 0.0488 0.0488 0.0896 0.0896 0.1130 0.1130 0.1669 0.1669 0.2025 0.2025 0.2767 0.2767 0.3044 0.3044 0.3318 0.3318 0.3685 0.3685 0.4039 0.4039 0.4371 0.4371 0.4492 0.4492 0.4654 0.4654 0.5036 0.5036 0.5174 0.5174 0.5269 0.5269 0.5531 0.5531 0.5681 0.5681 0.5929 0.5929 0.6107 0.6107 0.6432 0.6432 0.7455 0.7455 2.2862 2.2862 2.4660 2.4660 2.5702 2.5702 3.6636 3.6636 3.7192 3.7192 4.0206 4.0206 5.2214 5.2214 5.4409 5.4409 5.6978 5.6978 5.8732 5.8732 6.6097 6.6097 7.5579 7.5579 8.6999 8.6999 9.9541 9.9541 10.1704 10.1704 10.3395 10.3395 10.8616 10.8616 11.2985 11.2985 11.6683 11.6683 12.0652 12.0652 12.3667 12.3667 k = 0.3462 0.3462-0.0000 ( 6740 PWs) bands (ev): -4.3516 -4.3516 -3.8409 -3.8409 -3.6646 -3.6646 -3.4874 -3.4874 -0.3194 -0.3194 -0.2475 -0.2475 -0.2013 -0.2013 -0.1607 -0.1607 -0.0785 -0.0785 -0.0567 -0.0567 -0.0245 -0.0245 -0.0106 -0.0106 0.0478 0.0478 0.0855 0.0855 0.1104 0.1104 0.1675 0.1675 0.2079 0.2079 0.2788 0.2788 0.3069 0.3069 0.3348 0.3348 0.3709 0.3709 0.4057 0.4057 0.4379 0.4379 0.4501 0.4501 0.4690 0.4690 0.5085 0.5085 0.5201 0.5201 0.5355 0.5355 0.5610 0.5610 0.5701 0.5701 0.5973 0.5973 0.6121 0.6121 0.6472 0.6472 0.7677 0.7677 2.2927 2.2927 2.4618 2.4618 2.5161 2.5161 3.7342 3.7342 3.7471 3.7471 4.0589 4.0589 5.1080 5.1080 5.4788 5.4788 5.7670 5.7670 5.8335 5.8335 6.5287 6.5287 7.5904 7.5904 8.6515 8.6515 9.8870 9.8870 10.0141 10.0141 10.4725 10.4725 10.8623 10.8623 11.2207 11.2207 11.5609 11.5609 12.1732 12.1732 12.3736 12.3736 k = 0.3333 0.3333-0.0000 ( 6740 PWs) bands (ev): -4.3919 -4.3919 -3.8231 -3.8231 -3.6528 -3.6528 -3.4707 -3.4707 -0.3306 -0.3306 -0.2517 -0.2517 -0.2079 -0.2079 -0.1680 -0.1680 -0.0827 -0.0827 -0.0643 -0.0643 -0.0307 -0.0307 -0.0119 -0.0119 0.0466 0.0466 0.0818 0.0818 0.1080 0.1080 0.1683 0.1683 0.2136 0.2136 0.2806 0.2806 0.3092 0.3092 0.3376 0.3376 0.3737 0.3737 0.4076 0.4076 0.4386 0.4386 0.4511 0.4511 0.4727 0.4727 0.5134 0.5134 0.5225 0.5225 0.5438 0.5438 0.5683 0.5683 0.5726 0.5726 0.6020 0.6020 0.6136 0.6136 0.6516 0.6516 0.7879 0.7879 2.3071 2.3071 2.4556 2.4556 2.4634 2.4634 3.7503 3.7503 3.8321 3.8321 4.0956 4.0956 4.9978 4.9978 5.5202 5.5202 5.7942 5.7942 5.8325 5.8325 6.4579 6.4579 7.6223 7.6223 8.6011 8.6011 9.8157 9.8157 9.8524 9.8524 10.5563 10.5563 10.8435 10.8435 11.2032 11.2032 11.4542 11.4542 12.3048 12.3048 12.3780 12.3780 k = 0.3205 0.3205-0.0000 ( 6742 PWs) bands (ev): -4.4318 -4.4318 -3.8042 -3.8042 -3.6404 -3.6404 -3.4556 -3.4556 -0.3421 -0.3421 -0.2571 -0.2571 -0.2151 -0.2151 -0.1753 -0.1753 -0.0869 -0.0869 -0.0709 -0.0709 -0.0374 -0.0374 -0.0123 -0.0123 0.0451 0.0451 0.0789 0.0789 0.1061 0.1061 0.1694 0.1694 0.2194 0.2194 0.2821 0.2821 0.3116 0.3116 0.3401 0.3401 0.3769 0.3769 0.4095 0.4095 0.4392 0.4392 0.4520 0.4520 0.4763 0.4763 0.5183 0.5183 0.5249 0.5249 0.5518 0.5518 0.5717 0.5717 0.5788 0.5788 0.6069 0.6069 0.6154 0.6154 0.6565 0.6565 0.8054 0.8054 2.3290 2.3290 2.4127 2.4127 2.4474 2.4474 3.7674 3.7674 3.9181 3.9181 4.1305 4.1305 4.8920 4.8920 5.5647 5.5647 5.7563 5.7563 5.8864 5.8864 6.4054 6.4054 7.6532 7.6532 8.5487 8.5487 9.6896 9.6896 9.7433 9.7433 10.5571 10.5571 10.8048 10.8048 11.2676 11.2676 11.3610 11.3610 12.3453 12.3453 12.4486 12.4486 k = 0.3077 0.3077-0.0000 ( 6756 PWs) bands (ev): -4.4709 -4.4709 -3.7844 -3.7844 -3.6273 -3.6273 -3.4419 -3.4419 -0.3538 -0.3538 -0.2644 -0.2644 -0.2225 -0.2225 -0.1821 -0.1821 -0.0917 -0.0917 -0.0766 -0.0766 -0.0442 -0.0442 -0.0124 -0.0124 0.0435 0.0435 0.0766 0.0766 0.1047 0.1047 0.1707 0.1707 0.2251 0.2251 0.2834 0.2834 0.3140 0.3140 0.3426 0.3426 0.3806 0.3806 0.4115 0.4115 0.4397 0.4397 0.4529 0.4529 0.4799 0.4799 0.5232 0.5232 0.5272 0.5272 0.5592 0.5592 0.5734 0.5734 0.5865 0.5865 0.6116 0.6116 0.6179 0.6179 0.6619 0.6619 0.8198 0.8198 2.3434 2.3434 2.3800 2.3800 2.4365 2.4365 3.7855 3.7855 4.0048 4.0048 4.1635 4.1635 4.7914 4.7914 5.6108 5.6108 5.7216 5.7216 5.9173 5.9173 6.3831 6.3831 7.6829 7.6829 8.4946 8.4946 9.5300 9.5300 9.6671 9.6671 10.4937 10.4937 10.7447 10.7447 11.2679 11.2679 11.4098 11.4098 12.2092 12.2092 12.4201 12.4201 k = 0.2949 0.2949-0.0000 ( 6750 PWs) bands (ev): -4.5093 -4.5093 -3.7637 -3.7637 -3.6138 -3.6138 -3.4297 -3.4297 -0.3656 -0.3656 -0.2741 -0.2741 -0.2292 -0.2292 -0.1881 -0.1881 -0.0970 -0.0970 -0.0813 -0.0813 -0.0508 -0.0508 -0.0124 -0.0124 0.0417 0.0417 0.0751 0.0751 0.1039 0.1039 0.1722 0.1722 0.2308 0.2308 0.2843 0.2843 0.3165 0.3165 0.3448 0.3448 0.3845 0.3845 0.4136 0.4136 0.4402 0.4402 0.4537 0.4537 0.4834 0.4834 0.5280 0.5280 0.5297 0.5297 0.5660 0.5660 0.5749 0.5749 0.5941 0.5941 0.6158 0.6158 0.6217 0.6217 0.6677 0.6677 0.8307 0.8307 2.3048 2.3048 2.4086 2.4086 2.4244 2.4244 3.8043 3.8043 4.0918 4.0918 4.1942 4.1942 4.6971 4.6971 5.6461 5.6461 5.7024 5.7024 5.9165 5.9165 6.4002 6.4002 7.7111 7.7111 8.4386 8.4386 9.3725 9.3725 9.5896 9.5896 10.3996 10.3996 10.6644 10.6644 11.2054 11.2054 11.5600 11.5600 12.0252 12.0252 12.4087 12.4087 k = 0.2821 0.2821-0.0000 ( 6747 PWs) bands (ev): -4.5468 -4.5468 -3.7421 -3.7421 -3.5997 -3.5997 -3.4189 -3.4189 -0.3775 -0.3775 -0.2865 -0.2865 -0.2346 -0.2346 -0.1934 -0.1934 -0.1025 -0.1025 -0.0856 -0.0856 -0.0573 -0.0573 -0.0126 -0.0126 0.0399 0.0399 0.0745 0.0745 0.1037 0.1037 0.1739 0.1739 0.2365 0.2365 0.2850 0.2850 0.3190 0.3190 0.3468 0.3468 0.3887 0.3887 0.4159 0.4159 0.4408 0.4408 0.4544 0.4544 0.4868 0.4868 0.5314 0.5314 0.5334 0.5334 0.5717 0.5717 0.5769 0.5769 0.6008 0.6008 0.6197 0.6197 0.6266 0.6266 0.6741 0.6741 0.8380 0.8380 2.2581 2.2581 2.4033 2.4033 2.4613 2.4613 3.8239 3.8239 4.1786 4.1786 4.2227 4.2227 4.6097 4.6097 5.6339 5.6339 5.7346 5.7346 5.8900 5.8900 6.4526 6.4526 7.7376 7.7376 8.3809 8.3809 9.2177 9.2177 9.5113 9.5113 10.2929 10.2929 10.5680 10.5680 11.1565 11.1565 11.7002 11.7002 11.8327 11.8327 12.4033 12.4033 k = 0.2692 0.2692-0.0000 ( 6743 PWs) bands (ev): -4.5833 -4.5833 -3.7199 -3.7199 -3.5853 -3.5853 -3.4093 -3.4093 -0.3895 -0.3895 -0.3011 -0.3011 -0.2389 -0.2389 -0.1981 -0.1981 -0.1079 -0.1079 -0.0898 -0.0898 -0.0635 -0.0635 -0.0131 -0.0131 0.0382 0.0382 0.0748 0.0748 0.1039 0.1039 0.1758 0.1758 0.2422 0.2422 0.2854 0.2854 0.3216 0.3216 0.3486 0.3486 0.3931 0.3931 0.4183 0.4183 0.4414 0.4414 0.4551 0.4551 0.4900 0.4900 0.5339 0.5339 0.5379 0.5379 0.5751 0.5751 0.5806 0.5806 0.6062 0.6062 0.6243 0.6243 0.6321 0.6321 0.6809 0.6809 0.8421 0.8421 2.2120 2.2120 2.3822 2.3822 2.5196 2.5196 3.8440 3.8440 4.2461 4.2461 4.2671 4.2671 4.5300 4.5300 5.6052 5.6052 5.7780 5.7780 5.8599 5.8599 6.5277 6.5277 7.7619 7.7619 8.3214 8.3214 9.0660 9.0660 9.4327 9.4327 10.1815 10.1815 10.4606 10.4606 11.1197 11.1197 11.6371 11.6371 11.8000 11.8000 12.3921 12.3921 k = 0.2564 0.2564-0.0000 ( 6747 PWs) bands (ev): -4.6187 -4.6187 -3.6972 -3.6972 -3.5706 -3.5706 -3.4010 -3.4010 -0.4014 -0.4014 -0.3172 -0.3172 -0.2422 -0.2422 -0.2025 -0.2025 -0.1130 -0.1130 -0.0939 -0.0939 -0.0697 -0.0697 -0.0139 -0.0139 0.0367 0.0367 0.0762 0.0762 0.1044 0.1044 0.1780 0.1780 0.2478 0.2478 0.2856 0.2856 0.3242 0.3242 0.3503 0.3503 0.3977 0.3977 0.4207 0.4207 0.4420 0.4420 0.4557 0.4557 0.4930 0.4930 0.5362 0.5362 0.5424 0.5424 0.5767 0.5767 0.5855 0.5855 0.6102 0.6102 0.6301 0.6301 0.6377 0.6377 0.6880 0.6880 0.8429 0.8429 2.1672 2.1672 2.3570 2.3570 2.5864 2.5864 3.8645 3.8645 4.2685 4.2685 4.3520 4.3520 4.4589 4.4589 5.5762 5.5762 5.7695 5.7695 5.8830 5.8830 6.6160 6.6160 7.7838 7.7838 8.2600 8.2600 8.9179 8.9179 9.3543 9.3543 10.0692 10.0692 10.3467 10.3467 11.0919 11.0919 11.4400 11.4400 11.8456 11.8456 12.3703 12.3703 k = 0.2436 0.2436-0.0000 ( 6747 PWs) bands (ev): -4.6529 -4.6529 -3.6740 -3.6740 -3.5558 -3.5558 -3.3938 -3.3938 -0.4134 -0.4134 -0.3342 -0.3342 -0.2448 -0.2448 -0.2066 -0.2066 -0.1177 -0.1177 -0.0982 -0.0982 -0.0757 -0.0757 -0.0153 -0.0153 0.0356 0.0356 0.0785 0.0785 0.1051 0.1051 0.1804 0.1804 0.2535 0.2535 0.2858 0.2858 0.3267 0.3267 0.3517 0.3517 0.4022 0.4022 0.4231 0.4231 0.4427 0.4427 0.4562 0.4562 0.4960 0.4960 0.5385 0.5385 0.5466 0.5466 0.5780 0.5780 0.5903 0.5903 0.6130 0.6130 0.6366 0.6366 0.6433 0.6433 0.6954 0.6954 0.8412 0.8412 2.1240 2.1240 2.3278 2.3278 2.6605 2.6605 3.8852 3.8852 4.2850 4.2850 4.3950 4.3950 4.4396 4.4396 5.5492 5.5492 5.7264 5.7264 5.9461 5.9461 6.7115 6.7115 7.8027 7.8027 8.1965 8.1965 8.7743 8.7743 9.2769 9.2769 9.9578 9.9578 10.2296 10.2296 11.0712 11.0712 11.2429 11.2429 11.8489 11.8489 12.3397 12.3397 k = 0.2308 0.2308-0.0000 ( 6751 PWs) bands (ev): -4.6858 -4.6858 -3.6505 -3.6505 -3.5408 -3.5408 -3.3877 -3.3877 -0.4252 -0.4252 -0.3518 -0.3518 -0.2469 -0.2469 -0.2106 -0.2106 -0.1220 -0.1220 -0.1024 -0.1024 -0.0816 -0.0816 -0.0171 -0.0171 0.0348 0.0348 0.0817 0.0817 0.1060 0.1060 0.1830 0.1830 0.2591 0.2591 0.2858 0.2858 0.3290 0.3290 0.3531 0.3531 0.4068 0.4068 0.4256 0.4256 0.4434 0.4434 0.4568 0.4568 0.4988 0.4988 0.5408 0.5408 0.5506 0.5506 0.5792 0.5792 0.5948 0.5948 0.6152 0.6152 0.6435 0.6435 0.6488 0.6488 0.7029 0.7029 0.8373 0.8373 2.0825 2.0825 2.2946 2.2946 2.7411 2.7411 3.9060 3.9060 4.2902 4.2902 4.3501 4.3501 4.5226 4.5226 5.5249 5.5249 5.6815 5.6815 6.0190 6.0190 6.8111 6.8111 7.8179 7.8179 8.1309 8.1309 8.6360 8.6360 9.2007 9.2007 9.8485 9.8485 10.1117 10.1117 11.0408 11.0408 11.0620 11.0620 11.8285 11.8285 12.3012 12.3012 k = 0.2179 0.2179-0.0000 ( 6759 PWs) bands (ev): -4.7173 -4.7173 -3.6269 -3.6269 -3.5257 -3.5257 -3.3825 -3.3825 -0.4369 -0.4369 -0.3696 -0.3696 -0.2487 -0.2487 -0.2145 -0.2145 -0.1259 -0.1259 -0.1066 -0.1066 -0.0873 -0.0873 -0.0193 -0.0193 0.0343 0.0343 0.0856 0.0856 0.1072 0.1072 0.1858 0.1858 0.2648 0.2648 0.2859 0.2859 0.3312 0.3312 0.3542 0.3542 0.4113 0.4113 0.4280 0.4280 0.4442 0.4442 0.4572 0.4572 0.5014 0.5014 0.5430 0.5430 0.5541 0.5541 0.5804 0.5804 0.5989 0.5989 0.6170 0.6170 0.6503 0.6503 0.6541 0.6541 0.7104 0.7104 0.8319 0.8319 2.0427 2.0427 2.2579 2.2579 2.8273 2.8273 3.9265 3.9265 4.2689 4.2689 4.3344 4.3344 4.6053 4.6053 5.5038 5.5038 5.6407 5.6407 6.0976 6.0976 6.9127 6.9127 7.8279 7.8279 8.0631 8.0631 8.5048 8.5048 9.1263 9.1263 9.7422 9.7422 9.9944 9.9944 10.8502 10.8502 11.0481 11.0481 11.7966 11.7966 12.2556 12.2556 k = 0.2051 0.2051-0.0000 ( 6761 PWs) bands (ev): -4.7474 -4.7474 -3.6033 -3.6033 -3.5108 -3.5108 -3.3782 -3.3782 -0.4484 -0.4484 -0.3874 -0.3874 -0.2501 -0.2501 -0.2182 -0.2182 -0.1293 -0.1293 -0.1106 -0.1106 -0.0929 -0.0929 -0.0218 -0.0218 0.0340 0.0340 0.0898 0.0898 0.1089 0.1089 0.1888 0.1888 0.2705 0.2705 0.2859 0.2859 0.3330 0.3330 0.3553 0.3553 0.4157 0.4157 0.4305 0.4305 0.4451 0.4451 0.4576 0.4576 0.5039 0.5039 0.5451 0.5451 0.5572 0.5572 0.5817 0.5817 0.6027 0.6027 0.6187 0.6187 0.6567 0.6567 0.6593 0.6593 0.7175 0.7175 0.8254 0.8254 2.0047 2.0047 2.2179 2.2179 2.9183 2.9183 3.9467 3.9467 4.2346 4.2346 4.3352 4.3352 4.6866 4.6866 5.4860 5.4860 5.6059 5.6059 6.1809 6.1809 7.0147 7.0147 7.8304 7.8304 7.9927 7.9927 8.3832 8.3832 9.0541 9.0541 9.6394 9.6394 9.8789 9.8789 10.6577 10.6577 11.0434 11.0434 11.7595 11.7595 12.2041 12.2041 k = 0.1923 0.1923-0.0000 ( 6757 PWs) bands (ev): -4.7760 -4.7760 -3.5799 -3.5799 -3.4961 -3.4961 -3.3747 -3.3747 -0.4596 -0.4596 -0.4050 -0.4050 -0.2513 -0.2513 -0.2219 -0.2219 -0.1323 -0.1323 -0.1146 -0.1146 -0.0984 -0.0984 -0.0245 -0.0245 0.0340 0.0340 0.0936 0.0936 0.1118 0.1118 0.1920 0.1920 0.2764 0.2764 0.2861 0.2861 0.3344 0.3344 0.3562 0.3562 0.4200 0.4200 0.4329 0.4329 0.4461 0.4461 0.4581 0.4581 0.5062 0.5062 0.5469 0.5469 0.5600 0.5600 0.5830 0.5830 0.6061 0.6061 0.6202 0.6202 0.6623 0.6623 0.6648 0.6648 0.7241 0.7241 0.8188 0.8188 1.9685 1.9685 2.1752 2.1752 3.0131 3.0131 3.9662 3.9662 4.2030 4.2030 4.3361 4.3361 4.7663 4.7663 5.4720 5.4720 5.5781 5.5781 6.2684 6.2684 7.1161 7.1161 7.8209 7.8209 7.9199 7.9199 8.2760 8.2760 8.9843 8.9843 9.5406 9.5406 9.7661 9.7661 10.4683 10.4683 11.0437 11.0437 11.7205 11.7205 12.1477 12.1477 k = 0.1795 0.1795-0.0000 ( 6769 PWs) bands (ev): -4.8029 -4.8029 -3.5568 -3.5568 -3.4816 -3.4816 -3.3718 -3.3718 -0.4705 -0.4705 -0.4221 -0.4221 -0.2523 -0.2523 -0.2255 -0.2255 -0.1350 -0.1350 -0.1183 -0.1183 -0.1037 -0.1037 -0.0273 -0.0273 0.0340 0.0340 0.0965 0.0965 0.1163 0.1163 0.1953 0.1953 0.2823 0.2823 0.2863 0.2863 0.3353 0.3353 0.3571 0.3571 0.4241 0.4241 0.4352 0.4352 0.4471 0.4471 0.4585 0.4585 0.5083 0.5083 0.5485 0.5485 0.5624 0.5624 0.5844 0.5844 0.6093 0.6093 0.6216 0.6216 0.6669 0.6669 0.6705 0.6705 0.7294 0.7294 0.8125 0.8125 1.9343 1.9343 2.1304 2.1304 3.1109 3.1109 3.9848 3.9848 4.1768 4.1768 4.3341 4.3341 4.8441 4.8441 5.4619 5.4619 5.5574 5.5574 6.3597 6.3597 7.2158 7.2158 7.7929 7.7929 7.8446 7.8446 8.1902 8.1902 8.9171 8.9171 9.4462 9.4462 9.6565 9.6565 10.2830 10.2830 11.0488 11.0488 11.6814 11.6814 12.0874 12.0874 k = 0.1667 0.1667-0.0000 ( 6777 PWs) bands (ev): -4.8283 -4.8283 -3.5342 -3.5342 -3.4676 -3.4676 -3.3696 -3.3696 -0.4811 -0.4811 -0.4388 -0.4388 -0.2531 -0.2531 -0.2290 -0.2290 -0.1373 -0.1373 -0.1219 -0.1219 -0.1089 -0.1089 -0.0300 -0.0300 0.0341 0.0341 0.0983 0.0983 0.1225 0.1225 0.1987 0.1987 0.2864 0.2864 0.2884 0.2884 0.3357 0.3357 0.3580 0.3580 0.4279 0.4279 0.4374 0.4374 0.4482 0.4482 0.4589 0.4589 0.5103 0.5103 0.5495 0.5495 0.5645 0.5645 0.5858 0.5858 0.6122 0.6122 0.6229 0.6229 0.6710 0.6710 0.6760 0.6760 0.7332 0.7332 0.8076 0.8076 1.9019 1.9019 2.0843 2.0843 3.2106 3.2106 4.0022 4.0022 4.1562 4.1562 4.3287 4.3287 4.9200 4.9200 5.4558 5.4558 5.5436 5.5436 6.4543 6.4543 7.3126 7.3126 7.7410 7.7410 7.7668 7.7668 8.1317 8.1317 8.8526 8.8526 9.3565 9.3565 9.5507 9.5507 10.1026 10.1026 11.0586 11.0586 11.6434 11.6434 12.0242 12.0242 k = 0.1538 0.1538-0.0000 ( 6757 PWs) bands (ev): -4.8520 -4.8520 -3.5123 -3.5123 -3.4540 -3.4540 -3.3678 -3.3678 -0.4912 -0.4912 -0.4547 -0.4547 -0.2537 -0.2537 -0.2323 -0.2323 -0.1393 -0.1393 -0.1252 -0.1252 -0.1137 -0.1137 -0.0327 -0.0327 0.0343 0.0343 0.0993 0.0993 0.1300 0.1300 0.2021 0.2021 0.2869 0.2869 0.2945 0.2945 0.3354 0.3354 0.3589 0.3589 0.4315 0.4315 0.4396 0.4396 0.4494 0.4494 0.4594 0.4594 0.5121 0.5121 0.5499 0.5499 0.5667 0.5667 0.5871 0.5871 0.6148 0.6148 0.6241 0.6241 0.6747 0.6747 0.6812 0.6812 0.7350 0.7350 0.8048 0.8048 1.8716 1.8716 2.0377 2.0377 3.3112 3.3112 4.0183 4.0183 4.1408 4.1408 4.3202 4.3202 4.9940 4.9940 5.4539 5.4539 5.5363 5.5363 6.5520 6.5520 7.4050 7.4050 7.6679 7.6679 7.6868 7.6868 8.0989 8.0989 8.7909 8.7909 9.2718 9.2718 9.4493 9.4493 9.9280 9.9280 11.0732 11.0732 11.6069 11.6069 11.9591 11.9591 k = 0.1410 0.1410-0.0000 ( 6765 PWs) bands (ev): -4.8739 -4.8739 -3.4912 -3.4912 -3.4411 -3.4411 -3.3665 -3.3665 -0.5008 -0.5008 -0.4698 -0.4698 -0.2542 -0.2542 -0.2356 -0.2356 -0.1410 -0.1410 -0.1282 -0.1282 -0.1184 -0.1184 -0.0352 -0.0352 0.0345 0.0345 0.0997 0.0997 0.1385 0.1385 0.2055 0.2055 0.2873 0.2873 0.3006 0.3006 0.3344 0.3344 0.3598 0.3598 0.4347 0.4347 0.4418 0.4418 0.4505 0.4505 0.4599 0.4599 0.5137 0.5137 0.5496 0.5496 0.5689 0.5689 0.5883 0.5883 0.6172 0.6172 0.6253 0.6253 0.6779 0.6779 0.6860 0.6860 0.7344 0.7344 0.8042 0.8042 1.8433 1.8433 1.9912 1.9912 3.4117 3.4117 4.0327 4.0327 4.1299 4.1299 4.3093 4.3093 5.0658 5.0658 5.4560 5.4560 5.5347 5.5347 6.6520 6.6520 7.4863 7.4863 7.5878 7.5878 7.6051 7.6051 8.0839 8.0839 8.7318 8.7318 9.1926 9.1926 9.3526 9.3526 9.7603 9.7603 11.0923 11.0923 11.5725 11.5725 11.8928 11.8928 k = 0.1282 0.1282-0.0000 ( 6763 PWs) bands (ev): -4.8941 -4.8941 -3.4713 -3.4713 -3.4288 -3.4288 -3.3656 -3.3656 -0.5099 -0.5099 -0.4840 -0.4840 -0.2545 -0.2545 -0.2386 -0.2386 -0.1424 -0.1424 -0.1311 -0.1311 -0.1227 -0.1227 -0.0375 -0.0375 0.0348 0.0348 0.0997 0.0997 0.1476 0.1476 0.2088 0.2088 0.2879 0.2879 0.3069 0.3069 0.3326 0.3326 0.3608 0.3608 0.4375 0.4375 0.4439 0.4439 0.4516 0.4516 0.4605 0.4605 0.5151 0.5151 0.5484 0.5484 0.5712 0.5712 0.5893 0.5893 0.6193 0.6193 0.6263 0.6263 0.6807 0.6807 0.6903 0.6903 0.7319 0.7319 0.8058 0.8058 1.8172 1.8172 1.9458 1.9458 3.5108 3.5108 4.0453 4.0453 4.1230 4.1230 4.2966 4.2966 5.1354 5.1354 5.4621 5.4621 5.5381 5.5381 6.7538 6.7538 7.4704 7.4704 7.5219 7.5219 7.5944 7.5944 8.0792 8.0792 8.6748 8.6748 9.1190 9.1190 9.2612 9.2612 9.6003 9.6003 11.1157 11.1157 11.5405 11.5405 11.8263 11.8263 k = 0.1154 0.1154-0.0000 ( 6761 PWs) bands (ev): -4.9125 -4.9125 -3.4525 -3.4525 -3.4174 -3.4174 -3.3650 -3.3650 -0.5183 -0.5183 -0.4972 -0.4972 -0.2547 -0.2547 -0.2414 -0.2414 -0.1436 -0.1436 -0.1337 -0.1337 -0.1267 -0.1267 -0.0396 -0.0396 0.0351 0.0351 0.0996 0.0996 0.1572 0.1572 0.2120 0.2120 0.2885 0.2885 0.3131 0.3131 0.3301 0.3301 0.3618 0.3618 0.4400 0.4400 0.4461 0.4461 0.4526 0.4526 0.4611 0.4611 0.5164 0.5164 0.5465 0.5465 0.5737 0.5737 0.5900 0.5900 0.6212 0.6212 0.6272 0.6272 0.6831 0.6831 0.6941 0.6941 0.7284 0.7284 0.8089 0.8089 1.7932 1.7932 1.9022 1.9022 3.6071 3.6071 4.0560 4.0560 4.1195 4.1195 4.2830 4.2830 5.2027 5.2027 5.4716 5.4716 5.5454 5.5454 6.8563 6.8563 7.3819 7.3819 7.4388 7.4388 7.6671 7.6671 8.0803 8.0803 8.6195 8.6195 9.0514 9.0514 9.1755 9.1755 9.4494 9.4494 11.1429 11.1429 11.5112 11.5112 11.7607 11.7607 k = 0.1026 0.1026-0.0000 ( 6761 PWs) bands (ev): -4.9290 -4.9290 -3.4352 -3.4352 -3.4069 -3.4069 -3.3646 -3.3646 -0.5260 -0.5260 -0.5093 -0.5093 -0.2549 -0.2549 -0.2440 -0.2440 -0.1447 -0.1447 -0.1361 -0.1361 -0.1303 -0.1303 -0.0415 -0.0415 0.0354 0.0354 0.0994 0.0994 0.1670 0.1670 0.2149 0.2149 0.2893 0.2893 0.3190 0.3190 0.3271 0.3271 0.3628 0.3628 0.4421 0.4421 0.4483 0.4483 0.4536 0.4536 0.4618 0.4618 0.5176 0.5176 0.5439 0.5439 0.5763 0.5763 0.5905 0.5905 0.6229 0.6229 0.6279 0.6279 0.6852 0.6852 0.6975 0.6975 0.7244 0.7244 0.8129 0.8129 1.7715 1.7715 1.8611 1.8611 3.6994 3.6994 4.0648 4.0648 4.1187 4.1187 4.2691 4.2691 5.2674 5.2674 5.4842 5.4842 5.5559 5.5559 6.9575 6.9575 7.2918 7.2918 7.3580 7.3580 7.7371 7.7371 8.0850 8.0850 8.5650 8.5650 8.9901 8.9901 9.0959 9.0959 9.3089 9.3089 11.1731 11.1731 11.4846 11.4846 11.6971 11.6971 k = 0.0897 0.0897-0.0000 ( 6757 PWs) bands (ev): -4.9437 -4.9437 -3.4194 -3.4194 -3.3974 -3.3974 -3.3644 -3.3644 -0.5330 -0.5330 -0.5202 -0.5202 -0.2549 -0.2549 -0.2464 -0.2464 -0.1455 -0.1455 -0.1384 -0.1384 -0.1335 -0.1335 -0.0432 -0.0432 0.0356 0.0356 0.0992 0.0992 0.1770 0.1770 0.2176 0.2176 0.2900 0.2900 0.3217 0.3217 0.3265 0.3265 0.3638 0.3638 0.4439 0.4439 0.4503 0.4503 0.4544 0.4544 0.4624 0.4624 0.5185 0.5185 0.5408 0.5408 0.5788 0.5788 0.5908 0.5908 0.6244 0.6244 0.6284 0.6284 0.6868 0.6868 0.7005 0.7005 0.7207 0.7207 0.8171 0.8171 1.7521 1.7521 1.8231 1.8231 3.7859 3.7859 4.0719 4.0719 4.1199 4.1199 4.2556 4.2556 5.3291 5.3291 5.4990 5.4990 5.5688 5.5688 7.0511 7.0511 7.2061 7.2061 7.2864 7.2864 7.7997 7.7997 8.0924 8.0924 8.5103 8.5103 8.9352 8.9352 9.0229 9.0229 9.1805 9.1805 11.2050 11.2050 11.4612 11.4612 11.6372 11.6372 k = 0.0769 0.0769-0.0000 ( 6749 PWs) bands (ev): -4.9564 -4.9564 -3.4054 -3.4054 -3.3889 -3.3889 -3.3643 -3.3643 -0.5393 -0.5393 -0.5298 -0.5298 -0.2548 -0.2548 -0.2485 -0.2485 -0.1462 -0.1462 -0.1404 -0.1404 -0.1362 -0.1362 -0.0446 -0.0446 0.0358 0.0358 0.0989 0.0989 0.1869 0.1869 0.2201 0.2201 0.2908 0.2908 0.3178 0.3178 0.3315 0.3315 0.3648 0.3648 0.4456 0.4456 0.4522 0.4522 0.4552 0.4552 0.4630 0.4630 0.5194 0.5194 0.5372 0.5372 0.5813 0.5813 0.5909 0.5909 0.6257 0.6257 0.6288 0.6288 0.6881 0.6881 0.7030 0.7030 0.7174 0.7174 0.8213 0.8213 1.7352 1.7352 1.7888 1.7888 3.8648 3.8648 4.0779 4.0779 4.1222 4.1222 4.2432 4.2432 5.3871 5.3871 5.5151 5.5151 5.5834 5.5834 7.1033 7.1033 7.1278 7.1278 7.2576 7.2576 7.8527 7.8527 8.1024 8.1024 8.4542 8.4542 8.8870 8.8870 8.9570 8.9570 9.0663 9.0663 11.2370 11.2370 11.4412 11.4412 11.5823 11.5823 k = 0.0641 0.0641-0.0000 ( 6749 PWs) bands (ev): -4.9672 -4.9672 -3.3932 -3.3932 -3.3816 -3.3816 -3.3643 -3.3643 -0.5446 -0.5446 -0.5380 -0.5380 -0.2547 -0.2547 -0.2503 -0.2503 -0.1467 -0.1467 -0.1424 -0.1424 -0.1384 -0.1384 -0.0458 -0.0458 0.0360 0.0360 0.0986 0.0986 0.1966 0.1966 0.2222 0.2222 0.2915 0.2915 0.3129 0.3129 0.3367 0.3367 0.3657 0.3657 0.4471 0.4471 0.4538 0.4538 0.4559 0.4559 0.4636 0.4636 0.5200 0.5200 0.5335 0.5335 0.5837 0.5837 0.5908 0.5908 0.6268 0.6268 0.6291 0.6291 0.6890 0.6890 0.7050 0.7050 0.7147 0.7147 0.8252 0.8252 1.7207 1.7207 1.7588 1.7588 3.9341 3.9341 4.0835 4.0835 4.1251 4.1251 4.2323 4.2323 5.4402 5.4402 5.5312 5.5312 5.5992 5.5992 7.0543 7.0543 7.0733 7.0733 7.3181 7.3181 7.8941 7.8941 8.1151 8.1151 8.3958 8.3958 8.8455 8.8455 8.8989 8.8989 8.9683 8.9683 11.2663 11.2663 11.4257 11.4257 11.5344 11.5344 k = 0.0513 0.0513-0.0000 ( 6743 PWs) bands (ev): -4.9761 -4.9761 -3.3831 -3.3831 -3.3756 -3.3756 -3.3644 -3.3644 -0.5491 -0.5491 -0.5448 -0.5448 -0.2547 -0.2547 -0.2518 -0.2518 -0.1471 -0.1471 -0.1442 -0.1442 -0.1401 -0.1401 -0.0468 -0.0468 0.0361 0.0361 0.0984 0.0984 0.2057 0.2057 0.2239 0.2239 0.2922 0.2922 0.3078 0.3078 0.3412 0.3412 0.3667 0.3667 0.4484 0.4484 0.4552 0.4552 0.4565 0.4565 0.4641 0.4641 0.5206 0.5206 0.5298 0.5298 0.5858 0.5858 0.5906 0.5906 0.6277 0.6277 0.6293 0.6293 0.6895 0.6895 0.7067 0.7067 0.7127 0.7127 0.8286 0.8286 1.7087 1.7087 1.7336 1.7336 3.9910 3.9910 4.0901 4.0901 4.1279 4.1279 4.2234 4.2234 5.4869 5.4869 5.5461 5.5461 5.6157 5.6157 6.9934 6.9934 7.0140 7.0140 7.4099 7.4099 7.9222 7.9222 8.1302 8.1302 8.3352 8.3352 8.8110 8.8110 8.8493 8.8493 8.8886 8.8886 11.2892 11.2892 11.4164 11.4164 11.4950 11.4950 k = 0.0385 0.0385-0.0000 ( 6757 PWs) bands (ev): -4.9830 -4.9830 -3.3752 -3.3752 -3.3708 -3.3708 -3.3644 -3.3644 -0.5526 -0.5526 -0.5502 -0.5502 -0.2546 -0.2546 -0.2529 -0.2529 -0.1474 -0.1474 -0.1457 -0.1457 -0.1413 -0.1413 -0.0475 -0.0475 0.0362 0.0362 0.0982 0.0982 0.2139 0.2139 0.2252 0.2252 0.2928 0.2928 0.3026 0.3026 0.3448 0.3448 0.3675 0.3675 0.4495 0.4495 0.4562 0.4562 0.4569 0.4569 0.4645 0.4645 0.5209 0.5209 0.5265 0.5265 0.5876 0.5876 0.5904 0.5904 0.6283 0.6283 0.6293 0.6293 0.6898 0.6898 0.7079 0.7079 0.7112 0.7112 0.8313 0.8313 1.6994 1.6994 1.7136 1.7136 4.0315 4.0315 4.1002 4.1002 4.1303 4.1303 4.2166 4.2166 5.5253 5.5253 5.5586 5.5586 5.6322 5.6322 6.9436 6.9436 6.9584 6.9584 7.5042 7.5042 7.9352 7.9352 8.1463 8.1463 8.2753 8.2753 8.7828 8.7828 8.8092 8.8092 8.8285 8.8285 11.3020 11.3020 11.4151 11.4151 11.4650 11.4650 k = 0.0256 0.0256-0.0000 ( 6759 PWs) bands (ev): -4.9880 -4.9880 -3.3695 -3.3695 -3.3673 -3.3673 -3.3644 -3.3644 -0.5552 -0.5552 -0.5541 -0.5541 -0.2545 -0.2545 -0.2538 -0.2538 -0.1476 -0.1476 -0.1468 -0.1468 -0.1422 -0.1422 -0.0481 -0.0481 0.0363 0.0363 0.0980 0.0980 0.2207 0.2207 0.2262 0.2262 0.2932 0.2932 0.2980 0.2980 0.3475 0.3475 0.3682 0.3682 0.4504 0.4504 0.4570 0.4570 0.4573 0.4573 0.4648 0.4648 0.5212 0.5212 0.5238 0.5238 0.5890 0.5890 0.5903 0.5903 0.6288 0.6288 0.6293 0.6293 0.6900 0.6900 0.7088 0.7088 0.7102 0.7102 0.8333 0.8333 1.6926 1.6926 1.6990 1.6990 4.0534 4.0534 4.1151 4.1151 4.1321 4.1321 4.2122 4.2122 5.5534 5.5534 5.5681 5.5681 5.6470 5.6470 6.9066 6.9066 6.9143 6.9143 7.5922 7.5922 7.9319 7.9319 8.1608 8.1608 8.2228 8.2228 8.7601 8.7601 8.7803 8.7803 8.7883 8.7883 11.3050 11.3050 11.4203 11.4203 11.4446 11.4446 k = 0.0128 0.0128-0.0000 ( 6757 PWs) bands (ev): -4.9910 -4.9910 -3.3664 -3.3664 -3.3650 -3.3650 -3.3643 -3.3643 -0.5568 -0.5568 -0.5565 -0.5565 -0.2545 -0.2545 -0.2543 -0.2543 -0.1477 -0.1477 -0.1475 -0.1475 -0.1427 -0.1427 -0.0484 -0.0484 0.0363 0.0363 0.0980 0.0980 0.2253 0.2253 0.2268 0.2268 0.2935 0.2935 0.2948 0.2948 0.3491 0.3491 0.3688 0.3688 0.4511 0.4511 0.4576 0.4576 0.4576 0.4576 0.4649 0.4649 0.5213 0.5213 0.5220 0.5220 0.5899 0.5899 0.5902 0.5902 0.6291 0.6291 0.6292 0.6292 0.6901 0.6901 0.7094 0.7094 0.7097 0.7097 0.8346 0.8346 1.6886 1.6886 1.6902 1.6902 4.0620 4.0620 4.1285 4.1285 4.1333 4.1333 4.2098 4.2098 5.5703 5.5703 5.5739 5.5739 5.6578 5.6578 6.8838 6.8838 6.8859 6.8859 7.6632 7.6632 7.9149 7.9149 8.1709 8.1709 8.1870 8.1870 8.7433 8.7433 8.7641 8.7641 8.7661 8.7661 11.3037 11.3037 11.4266 11.4266 11.4330 11.4330 k = 0.0000 0.0000 0.0000 ( 6763 PWs) bands (ev): -4.9919 -4.9919 -3.3657 -3.3657 -3.3641 -3.3641 -3.3641 -3.3641 -0.5573 -0.5573 -0.5573 -0.5573 -0.2545 -0.2545 -0.2545 -0.2545 -0.1477 -0.1477 -0.1477 -0.1477 -0.1429 -0.1429 -0.0485 -0.0485 0.0363 0.0363 0.0980 0.0980 0.2270 0.2270 0.2270 0.2270 0.2936 0.2936 0.2936 0.2936 0.3496 0.3496 0.3690 0.3690 0.4512 0.4512 0.4577 0.4577 0.4577 0.4577 0.4649 0.4649 0.5213 0.5213 0.5213 0.5213 0.5902 0.5902 0.5902 0.5902 0.6292 0.6292 0.6292 0.6292 0.6901 0.6901 0.7096 0.7096 0.7096 0.7096 0.8351 0.8351 1.6872 1.6872 1.6872 1.6872 4.0642 4.0642 4.1336 4.1336 4.1336 4.1336 4.2092 4.2092 5.5759 5.5759 5.5759 5.5759 5.6618 5.6618 6.8761 6.8761 6.8761 6.8761 7.6939 7.6939 7.9025 7.9025 8.1746 8.1746 8.1746 8.1746 8.7370 8.7370 8.7591 8.7591 8.7591 8.7591 11.3026 11.3026 11.4292 11.4292 11.4292 11.4292 k = 0.0000 0.0000 0.0000 ( 6763 PWs) bands (ev): -4.9919 -4.9919 -3.3657 -3.3657 -3.3641 -3.3641 -3.3641 -3.3641 -0.5573 -0.5573 -0.5573 -0.5573 -0.2545 -0.2545 -0.2545 -0.2545 -0.1477 -0.1477 -0.1477 -0.1477 -0.1429 -0.1429 -0.0485 -0.0485 0.0363 0.0363 0.0980 0.0980 0.2270 0.2270 0.2270 0.2270 0.2936 0.2936 0.2936 0.2936 0.3496 0.3496 0.3690 0.3690 0.4512 0.4512 0.4577 0.4577 0.4577 0.4577 0.4649 0.4649 0.5213 0.5213 0.5213 0.5213 0.5902 0.5902 0.5902 0.5902 0.6292 0.6292 0.6292 0.6292 0.6901 0.6901 0.7096 0.7096 0.7096 0.7096 0.8351 0.8351 1.6872 1.6872 1.6872 1.6872 4.0642 4.0642 4.1336 4.1336 4.1336 4.1336 4.2092 4.2092 5.5759 5.5759 5.5759 5.5759 5.6618 5.6618 6.8761 6.8761 6.8761 6.8761 7.6939 7.6939 7.9025 7.9025 8.1746 8.1746 8.1746 8.1746 8.7370 8.7370 8.7591 8.7591 8.7591 8.7591 11.3026 11.3026 11.4292 11.4292 11.4292 11.4292 k = 0.0106 0.0106 0.0106 ( 6763 PWs) bands (ev): -4.9909 -4.9909 -3.3664 -3.3664 -3.3649 -3.3649 -3.3645 -3.3645 -0.5566 -0.5566 -0.5566 -0.5566 -0.2544 -0.2544 -0.2544 -0.2544 -0.1476 -0.1476 -0.1475 -0.1475 -0.1427 -0.1427 -0.0484 -0.0484 0.0362 0.0362 0.0980 0.0980 0.2252 0.2252 0.2268 0.2268 0.2935 0.2935 0.2949 0.2949 0.3490 0.3490 0.3688 0.3688 0.4510 0.4510 0.4576 0.4576 0.4576 0.4576 0.4648 0.4648 0.5212 0.5212 0.5220 0.5220 0.5900 0.5900 0.5901 0.5901 0.6291 0.6291 0.6292 0.6292 0.6901 0.6901 0.7095 0.7095 0.7096 0.7096 0.8346 0.8346 1.6894 1.6894 1.6895 1.6895 4.0620 4.0620 4.1283 4.1283 4.1333 4.1333 4.2099 4.2099 5.5703 5.5703 5.5736 5.5736 5.6576 5.6576 6.8851 6.8851 6.8851 6.8851 7.6622 7.6622 7.9154 7.9154 8.1721 8.1721 8.1860 8.1860 8.7436 8.7436 8.7645 8.7645 8.7660 8.7660 11.3038 11.3038 11.4272 11.4272 11.4323 11.4323 k = 0.0213 0.0213 0.0213 ( 6751 PWs) bands (ev): -4.9878 -4.9878 -3.3686 -3.3686 -3.3673 -3.3673 -3.3656 -3.3656 -0.5546 -0.5546 -0.5545 -0.5545 -0.2542 -0.2542 -0.2541 -0.2541 -0.1474 -0.1474 -0.1469 -0.1469 -0.1422 -0.1422 -0.0481 -0.0481 0.0363 0.0363 0.0981 0.0981 0.2204 0.2204 0.2264 0.2264 0.2932 0.2932 0.2982 0.2982 0.3475 0.3475 0.3682 0.3682 0.4504 0.4504 0.4571 0.4571 0.4573 0.4573 0.4648 0.4648 0.5210 0.5210 0.5240 0.5240 0.5895 0.5895 0.5898 0.5898 0.6288 0.6288 0.6293 0.6293 0.6900 0.6900 0.7094 0.7094 0.7096 0.7096 0.8333 0.8333 1.6961 1.6961 1.6962 1.6962 4.0536 4.0536 4.1123 4.1123 4.1336 4.1336 4.2123 4.2123 5.5535 5.5535 5.5674 5.5674 5.6463 5.6463 6.9115 6.9115 6.9115 6.9115 7.5881 7.5881 7.9346 7.9346 8.1650 8.1650 8.2180 8.2180 8.7625 8.7625 8.7808 8.7808 8.7882 8.7882 11.3063 11.3063 11.4225 11.4225 11.4414 11.4414 k = 0.0319 0.0319 0.0319 ( 6757 PWs) bands (ev): -4.9827 -4.9827 -3.3724 -3.3724 -3.3712 -3.3712 -3.3673 -3.3673 -0.5513 -0.5513 -0.5512 -0.5512 -0.2538 -0.2538 -0.2537 -0.2537 -0.1470 -0.1470 -0.1460 -0.1460 -0.1413 -0.1413 -0.0475 -0.0475 0.0362 0.0362 0.0982 0.0982 0.2132 0.2132 0.2256 0.2256 0.2927 0.2927 0.3028 0.3028 0.3447 0.3447 0.3674 0.3674 0.4496 0.4496 0.4564 0.4564 0.4567 0.4567 0.4644 0.4644 0.5205 0.5205 0.5270 0.5270 0.5886 0.5886 0.5894 0.5894 0.6283 0.6283 0.6293 0.6293 0.6899 0.6899 0.7093 0.7093 0.7097 0.7097 0.8312 0.8312 1.7070 1.7070 1.7072 1.7072 4.0361 4.0361 4.0860 4.0860 4.1371 4.1371 4.2172 4.2172 5.5248 5.5248 5.5584 5.5584 5.6306 5.6306 6.9534 6.9534 6.9535 6.9535 7.4948 7.4948 7.9436 7.9436 8.1537 8.1537 8.2631 8.2631 8.7916 8.7916 8.8078 8.8078 8.8286 8.8286 11.3074 11.3074 11.4188 11.4188 11.4564 11.4564 k = 0.0426 0.0426 0.0426 ( 6760 PWs) bands (ev): -4.9756 -4.9756 -3.3778 -3.3778 -3.3767 -3.3767 -3.3694 -3.3694 -0.5468 -0.5468 -0.5465 -0.5465 -0.2533 -0.2533 -0.2531 -0.2531 -0.1464 -0.1464 -0.1446 -0.1446 -0.1402 -0.1402 -0.0468 -0.0468 0.0361 0.0361 0.0984 0.0984 0.2046 0.2046 0.2246 0.2246 0.2920 0.2920 0.3079 0.3079 0.3411 0.3411 0.3665 0.3665 0.4486 0.4486 0.4555 0.4555 0.4559 0.4559 0.4640 0.4640 0.5198 0.5198 0.5306 0.5306 0.5875 0.5875 0.5889 0.5889 0.6275 0.6275 0.6293 0.6293 0.6897 0.6897 0.7091 0.7091 0.7097 0.7097 0.8282 0.8282 1.7221 1.7221 1.7225 1.7225 4.0075 4.0075 4.0501 4.0501 4.1454 4.1454 4.2250 4.2250 5.4840 5.4840 5.5485 5.5485 5.6138 5.6138 7.0078 7.0078 7.0084 7.0084 7.3914 7.3914 7.9421 7.9421 8.1388 8.1388 8.3114 8.3114 8.8301 8.8301 8.8453 8.8453 8.8889 8.8889 11.3029 11.3029 11.4218 11.4218 11.4771 11.4771 k = 0.0532 0.0532 0.0532 ( 6769 PWs) bands (ev): -4.9664 -4.9664 -3.3848 -3.3848 -3.3837 -3.3837 -3.3722 -3.3722 -0.5410 -0.5410 -0.5406 -0.5406 -0.2526 -0.2526 -0.2523 -0.2523 -0.1456 -0.1456 -0.1429 -0.1429 -0.1388 -0.1388 -0.0458 -0.0458 0.0359 0.0359 0.0987 0.0987 0.1950 0.1950 0.2232 0.2232 0.2911 0.2911 0.3131 0.3131 0.3366 0.3366 0.3655 0.3655 0.4475 0.4475 0.4543 0.4543 0.4549 0.4549 0.4635 0.4635 0.5189 0.5189 0.5346 0.5346 0.5860 0.5860 0.5883 0.5883 0.6265 0.6265 0.6291 0.6291 0.6895 0.6895 0.7088 0.7088 0.7097 0.7097 0.8246 0.8246 1.7412 1.7412 1.7418 1.7418 3.9687 3.9687 4.0055 4.0055 4.1585 4.1585 4.2356 4.2356 5.4320 5.4320 5.5393 5.5393 5.5986 5.5986 7.0713 7.0713 7.0731 7.0731 7.2820 7.2820 7.9334 7.9334 8.1211 8.1211 8.3558 8.3558 8.8785 8.8785 8.8934 8.8934 8.9681 8.9681 11.2908 11.2908 11.4352 11.4352 11.5031 11.5031 k = 0.0638 0.0638 0.0638 ( 6775 PWs) bands (ev): -4.9553 -4.9553 -3.3931 -3.3931 -3.3921 -3.3921 -3.3755 -3.3755 -0.5341 -0.5341 -0.5335 -0.5335 -0.2518 -0.2518 -0.2513 -0.2513 -0.1446 -0.1446 -0.1408 -0.1408 -0.1371 -0.1371 -0.0446 -0.0446 0.0358 0.0358 0.0990 0.0990 0.1849 0.1849 0.2216 0.2216 0.2901 0.2901 0.3180 0.3180 0.3315 0.3315 0.3645 0.3645 0.4463 0.4463 0.4530 0.4530 0.4537 0.4537 0.4629 0.4629 0.5177 0.5177 0.5387 0.5387 0.5844 0.5844 0.5877 0.5877 0.6252 0.6252 0.6289 0.6289 0.6891 0.6891 0.7084 0.7084 0.7096 0.7096 0.8203 0.8203 1.7641 1.7641 1.7649 1.7649 3.9211 3.9211 3.9534 3.9534 4.1754 4.1754 4.2486 4.2486 5.3708 5.3708 5.5323 5.5323 5.5865 5.5865 7.1359 7.1359 7.1448 7.1448 7.1732 7.1732 7.9206 7.9206 8.1013 8.1013 8.3935 8.3935 8.9373 8.9373 8.9519 8.9519 9.0638 9.0638 11.2734 11.2734 11.4582 11.4582 11.5341 11.5341 k = 0.0745 0.0745 0.0745 ( 6775 PWs) bands (ev): -4.9421 -4.9421 -3.4028 -3.4028 -3.4017 -3.4017 -3.3793 -3.3793 -0.5261 -0.5261 -0.5253 -0.5253 -0.2507 -0.2507 -0.2502 -0.2502 -0.1434 -0.1434 -0.1383 -0.1383 -0.1351 -0.1351 -0.0431 -0.0431 0.0356 0.0356 0.0993 0.0993 0.1746 0.1746 0.2197 0.2197 0.2890 0.2890 0.3224 0.3224 0.3262 0.3262 0.3634 0.3634 0.4452 0.4452 0.4514 0.4514 0.4522 0.4522 0.4622 0.4622 0.5165 0.5165 0.5425 0.5425 0.5826 0.5826 0.5872 0.5872 0.6237 0.6237 0.6285 0.6285 0.6885 0.6885 0.7079 0.7079 0.7094 0.7094 0.8154 0.8154 1.7903 1.7903 1.7913 1.7913 3.8666 3.8666 3.8951 3.8951 4.1951 4.1951 4.2635 4.2635 5.3027 5.3027 5.5284 5.5284 5.5783 5.5783 7.0474 7.0474 7.2170 7.2170 7.2204 7.2204 7.9058 7.9058 8.0803 8.0803 8.4240 8.4240 9.0067 9.0067 9.0212 9.0212 9.1731 9.1731 11.2544 11.2544 11.4887 11.4887 11.5694 11.5694 k = 0.0851 0.0851 0.0851 ( 6778 PWs) bands (ev): -4.9270 -4.9270 -3.4137 -3.4137 -3.4127 -3.4127 -3.3836 -3.3836 -0.5170 -0.5170 -0.5159 -0.5159 -0.2494 -0.2494 -0.2488 -0.2488 -0.1420 -0.1420 -0.1355 -0.1355 -0.1329 -0.1329 -0.0414 -0.0414 0.0354 0.0354 0.0997 0.0997 0.1643 0.1643 0.2175 0.2175 0.2876 0.2876 0.3207 0.3207 0.3262 0.3262 0.3623 0.3623 0.4439 0.4439 0.4497 0.4497 0.4505 0.4505 0.4615 0.4615 0.5150 0.5150 0.5460 0.5460 0.5806 0.5806 0.5866 0.5866 0.6219 0.6219 0.6280 0.6280 0.6878 0.6878 0.7073 0.7073 0.7090 0.7090 0.8099 0.8099 1.8193 1.8193 1.8206 1.8206 3.8069 3.8069 3.8321 3.8321 4.2158 4.2158 4.2806 4.2806 5.2308 5.2308 5.5284 5.5284 5.5744 5.5744 6.9274 6.9274 7.2895 7.2895 7.2972 7.2972 7.8910 7.8910 8.0591 8.0591 8.4481 8.4481 9.0872 9.0872 9.1013 9.1013 9.2928 9.2928 11.2372 11.2372 11.5248 11.5248 11.6087 11.6087 k = 0.0957 0.0957 0.0957 ( 6772 PWs) bands (ev): -4.9100 -4.9100 -3.4257 -3.4257 -3.4247 -3.4247 -3.3884 -3.3884 -0.5070 -0.5070 -0.5056 -0.5056 -0.2478 -0.2478 -0.2472 -0.2472 -0.1403 -0.1403 -0.1324 -0.1324 -0.1305 -0.1305 -0.0395 -0.0395 0.0352 0.0352 0.1001 0.1001 0.1541 0.1541 0.2150 0.2150 0.2862 0.2862 0.3154 0.3154 0.3293 0.3293 0.3611 0.3611 0.4427 0.4427 0.4480 0.4480 0.4487 0.4487 0.4607 0.4607 0.5133 0.5133 0.5490 0.5490 0.5785 0.5785 0.5862 0.5862 0.6198 0.6198 0.6272 0.6272 0.6870 0.6870 0.7065 0.7065 0.7083 0.7083 0.8041 0.8041 1.8507 1.8507 1.8521 1.8521 3.7438 3.7438 3.7662 3.7662 4.2342 4.2342 4.3007 4.3007 5.1581 5.1581 5.5324 5.5324 5.5751 5.5751 6.8048 6.8048 7.3589 7.3589 7.3726 7.3726 7.8787 7.8787 8.0389 8.0389 8.4666 8.4666 9.1787 9.1787 9.1924 9.1924 9.4201 9.4201 11.2242 11.2242 11.5653 11.5653 11.6512 11.6512 k = 0.1064 0.1064 0.1064 ( 6766 PWs) bands (ev): -4.8911 -4.8911 -3.4387 -3.4387 -3.4378 -3.4378 -3.3937 -3.3937 -0.4960 -0.4960 -0.4943 -0.4943 -0.2460 -0.2460 -0.2454 -0.2454 -0.1384 -0.1384 -0.1289 -0.1289 -0.1279 -0.1279 -0.0374 -0.0374 0.0350 0.0350 0.1005 0.1005 0.1440 0.1440 0.2124 0.2124 0.2847 0.2847 0.3101 0.3101 0.3318 0.3318 0.3599 0.3599 0.4411 0.4411 0.4463 0.4463 0.4466 0.4466 0.4599 0.4599 0.5114 0.5114 0.5513 0.5513 0.5763 0.5763 0.5857 0.5857 0.6175 0.6175 0.6263 0.6263 0.6858 0.6858 0.7056 0.7056 0.7074 0.7074 0.7981 0.7981 1.8836 1.8836 1.8851 1.8851 3.6793 3.6793 3.6991 3.6991 4.2455 4.2455 4.3259 4.3259 5.0884 5.0884 5.5406 5.5406 5.5801 5.5801 6.6807 6.6807 7.4211 7.4211 7.4440 7.4440 7.8718 7.8718 8.0214 8.0214 8.4802 8.4802 9.2812 9.2812 9.2945 9.2945 9.5526 9.5526 11.2175 11.2175 11.6090 11.6090 11.6962 11.6962 k = 0.1170 0.1170 0.1170 ( 6772 PWs) bands (ev): -4.8703 -4.8703 -3.4527 -3.4527 -3.4518 -3.4518 -3.3994 -3.3994 -0.4843 -0.4843 -0.4822 -0.4822 -0.2439 -0.2439 -0.2435 -0.2435 -0.1363 -0.1363 -0.1252 -0.1252 -0.1251 -0.1251 -0.0351 -0.0351 0.0348 0.0348 0.1008 0.1008 0.1343 0.1343 0.2097 0.2097 0.2831 0.2831 0.3051 0.3051 0.3336 0.3336 0.3586 0.3586 0.4393 0.4393 0.4442 0.4442 0.4446 0.4446 0.4592 0.4592 0.5094 0.5094 0.5529 0.5529 0.5741 0.5741 0.5854 0.5854 0.6149 0.6149 0.6252 0.6252 0.6842 0.6842 0.7044 0.7044 0.7061 0.7061 0.7918 0.7918 1.9170 1.9170 1.9187 1.9187 3.6153 3.6153 3.6327 3.6327 4.2446 4.2446 4.3575 4.3575 5.0260 5.0260 5.5529 5.5529 5.5894 5.5894 6.5558 6.5558 7.4714 7.4714 7.5082 7.5082 7.8744 7.8744 8.0087 8.0087 8.4894 8.4894 9.3947 9.3947 9.4076 9.4076 9.6880 9.6880 11.2188 11.2188 11.6551 11.6551 11.7430 11.7430 k = 0.1277 0.1277 0.1277 ( 6766 PWs) bands (ev): -4.8478 -4.8478 -3.4675 -3.4675 -3.4666 -3.4666 -3.4055 -3.4055 -0.4718 -0.4718 -0.4693 -0.4693 -0.2416 -0.2416 -0.2412 -0.2412 -0.1339 -0.1339 -0.1222 -0.1222 -0.1212 -0.1212 -0.0326 -0.0326 0.0347 0.0347 0.1011 0.1011 0.1250 0.1250 0.2068 0.2068 0.2815 0.2815 0.3005 0.3005 0.3348 0.3348 0.3573 0.3573 0.4371 0.4371 0.4417 0.4417 0.4431 0.4431 0.4584 0.4584 0.5072 0.5072 0.5537 0.5537 0.5719 0.5719 0.5851 0.5851 0.6121 0.6121 0.6239 0.6239 0.6823 0.6823 0.7030 0.7030 0.7045 0.7045 0.7855 0.7855 1.9498 1.9498 1.9515 1.9515 3.5538 3.5538 3.5691 3.5691 4.2280 4.2280 4.3946 4.3946 4.9756 4.9756 5.5690 5.5690 5.6027 5.6027 6.4309 6.4309 7.5058 7.5058 7.5619 7.5619 7.8904 7.8904 8.0041 8.0041 8.4946 8.4946 9.5186 9.5186 9.5313 9.5313 9.8242 9.8242 11.2299 11.2299 11.7029 11.7029 11.7909 11.7909 k = 0.1383 0.1383 0.1383 ( 6766 PWs) bands (ev): -4.8235 -4.8235 -3.4830 -3.4830 -3.4821 -3.4821 -3.4119 -3.4119 -0.4586 -0.4586 -0.4556 -0.4556 -0.2389 -0.2389 -0.2388 -0.2388 -0.1314 -0.1314 -0.1191 -0.1191 -0.1169 -0.1169 -0.0299 -0.0299 0.0347 0.0347 0.1014 0.1014 0.1161 0.1161 0.2039 0.2039 0.2798 0.2798 0.2963 0.2963 0.3353 0.3353 0.3560 0.3560 0.4347 0.4347 0.4390 0.4390 0.4417 0.4417 0.4577 0.4577 0.5049 0.5049 0.5537 0.5537 0.5697 0.5697 0.5848 0.5848 0.6091 0.6091 0.6224 0.6224 0.6799 0.6799 0.7013 0.7013 0.7026 0.7026 0.7793 0.7793 1.9804 1.9804 1.9820 1.9820 3.4972 3.4972 3.5104 3.5104 4.1933 4.1933 4.4364 4.4364 4.9409 4.9409 5.5887 5.5887 5.6195 5.6195 6.3070 6.3070 7.5226 7.5226 7.6014 7.6014 7.9212 7.9212 8.0111 8.0111 8.4961 8.4961 9.6526 9.6526 9.6652 9.6652 9.9592 9.9592 11.2527 11.2527 11.7513 11.7513 11.8389 11.8389 k = 0.1489 0.1489 0.1489 ( 6754 PWs) bands (ev): -4.7975 -4.7975 -3.4991 -3.4991 -3.4982 -3.4982 -3.4186 -3.4186 -0.4449 -0.4449 -0.4414 -0.4414 -0.2362 -0.2362 -0.2359 -0.2359 -0.1285 -0.1285 -0.1158 -0.1158 -0.1123 -0.1123 -0.0272 -0.0272 0.0348 0.0348 0.1016 0.1016 0.1076 0.1076 0.2009 0.2009 0.2779 0.2779 0.2926 0.2926 0.3354 0.3354 0.3546 0.3546 0.4321 0.4321 0.4361 0.4361 0.4403 0.4403 0.4570 0.4570 0.5024 0.5024 0.5529 0.5529 0.5676 0.5676 0.5846 0.5846 0.6059 0.6059 0.6208 0.6208 0.6769 0.6769 0.6993 0.6993 0.7003 0.7003 0.7735 0.7735 2.0071 2.0071 2.0086 2.0086 3.4477 3.4477 3.4591 3.4591 4.1396 4.1396 4.4819 4.4819 4.9231 4.9231 5.6117 5.6117 5.6394 5.6394 6.1853 6.1853 7.5244 7.5244 7.6245 7.6245 7.9647 7.9647 8.0319 8.0319 8.4942 8.4942 9.7957 9.7957 9.8085 9.8085 10.0909 10.0909 11.2889 11.2889 11.7998 11.7998 11.8863 11.8863 k = 0.1596 0.1596 0.1596 ( 6754 PWs) bands (ev): -4.7699 -4.7699 -3.5156 -3.5156 -3.5148 -3.5148 -3.4255 -3.4255 -0.4307 -0.4307 -0.4266 -0.4266 -0.2333 -0.2333 -0.2325 -0.2325 -0.1254 -0.1254 -0.1124 -0.1124 -0.1075 -0.1075 -0.0243 -0.0243 0.0351 0.0351 0.0997 0.0997 0.1018 0.1018 0.1981 0.1981 0.2757 0.2757 0.2896 0.2896 0.3348 0.3348 0.3531 0.3531 0.4292 0.4292 0.4329 0.4329 0.4390 0.4390 0.4563 0.4563 0.4998 0.4998 0.5516 0.5516 0.5654 0.5654 0.5843 0.5843 0.6026 0.6026 0.6191 0.6191 0.6733 0.6733 0.6970 0.6970 0.6977 0.6977 0.7681 0.7681 2.0279 2.0279 2.0292 2.0292 3.4079 3.4079 3.4175 3.4175 4.0687 4.0687 4.5308 4.5308 4.9204 4.9204 5.6377 5.6377 5.6617 5.6617 6.0673 6.0673 7.5154 7.5154 7.6321 7.6321 8.0168 8.0168 8.0663 8.0663 8.4891 8.4891 9.9472 9.9472 9.9606 9.9606 10.2170 10.2170 11.3403 11.3403 11.8474 11.8474 11.9321 11.9321 k = 0.1702 0.1702 0.1702 ( 6754 PWs) bands (ev): -4.7407 -4.7407 -3.5325 -3.5325 -3.5317 -3.5317 -3.4327 -3.4327 -0.4161 -0.4161 -0.4114 -0.4114 -0.2302 -0.2302 -0.2287 -0.2287 -0.1221 -0.1221 -0.1090 -0.1090 -0.1026 -0.1026 -0.0215 -0.0215 0.0355 0.0355 0.0924 0.0924 0.1018 0.1018 0.1953 0.1953 0.2732 0.2732 0.2873 0.2873 0.3338 0.3338 0.3516 0.3516 0.4262 0.4262 0.4297 0.4297 0.4377 0.4377 0.4555 0.4555 0.4971 0.4971 0.5497 0.5497 0.5631 0.5631 0.5840 0.5840 0.5991 0.5991 0.6172 0.6172 0.6691 0.6691 0.6942 0.6942 0.6948 0.6948 0.7634 0.7634 2.0409 2.0409 2.0418 2.0418 3.3802 3.3802 3.3881 3.3881 3.9837 3.9837 4.5827 4.5827 4.9289 4.9289 5.6665 5.6665 5.6853 5.6853 5.9560 5.9560 7.4998 7.4998 7.6274 7.6274 8.0741 8.0741 8.1110 8.1110 8.4810 8.4810 10.1061 10.1061 10.1204 10.1204 10.3358 10.3358 11.4083 11.4083 11.8935 11.8935 11.9755 11.9755 k = 0.1809 0.1809 0.1809 ( 6754 PWs) bands (ev): -4.7101 -4.7101 -3.5497 -3.5497 -3.5489 -3.5489 -3.4401 -3.4401 -0.4011 -0.4011 -0.3958 -0.3958 -0.2268 -0.2268 -0.2245 -0.2245 -0.1185 -0.1185 -0.1054 -0.1054 -0.0975 -0.0975 -0.0187 -0.0187 0.0362 0.0362 0.0857 0.0857 0.1019 0.1019 0.1928 0.1928 0.2703 0.2703 0.2858 0.2858 0.3323 0.3323 0.3500 0.3500 0.4230 0.4230 0.4262 0.4262 0.4364 0.4364 0.4547 0.4547 0.4943 0.4943 0.5475 0.5475 0.5605 0.5605 0.5837 0.5837 0.5956 0.5956 0.6153 0.6153 0.6641 0.6641 0.6909 0.6909 0.6916 0.6916 0.7593 0.7593 2.0442 2.0442 2.0447 2.0447 3.3667 3.3667 3.3730 3.3730 3.8880 3.8880 4.6373 4.6373 4.9434 4.9434 5.6977 5.6977 5.7060 5.7060 5.8576 5.8576 7.4802 7.4802 7.6147 7.6147 8.1340 8.1340 8.1626 8.1626 8.4703 8.4703 10.2711 10.2711 10.2870 10.2870 10.4460 10.4460 11.4936 11.4936 11.9375 11.9375 12.0157 12.0157 k = 0.1915 0.1915 0.1915 ( 6745 PWs) bands (ev): -4.6781 -4.6781 -3.5670 -3.5670 -3.5663 -3.5663 -3.4475 -3.4475 -0.3859 -0.3859 -0.3800 -0.3800 -0.2231 -0.2231 -0.2197 -0.2197 -0.1146 -0.1146 -0.1017 -0.1017 -0.0923 -0.0923 -0.0160 -0.0160 0.0372 0.0372 0.0795 0.0795 0.1019 0.1019 0.1904 0.1904 0.2670 0.2670 0.2850 0.2850 0.3304 0.3304 0.3484 0.3484 0.4198 0.4198 0.4225 0.4225 0.4350 0.4350 0.4538 0.4538 0.4914 0.4914 0.5451 0.5451 0.5576 0.5576 0.5831 0.5831 0.5921 0.5921 0.6133 0.6133 0.6585 0.6585 0.6871 0.6871 0.6882 0.6882 0.7561 0.7561 2.0368 2.0368 2.0368 2.0368 3.3687 3.3687 3.3736 3.3736 3.7846 3.7846 4.6943 4.6943 4.9579 4.9579 5.7013 5.7013 5.7311 5.7311 5.7982 5.7982 7.4587 7.4587 7.5969 7.5969 8.1953 8.1953 8.2182 8.2182 8.4571 8.4571 10.4408 10.4408 10.4592 10.4592 10.5475 10.5475 11.5961 11.5961 11.9789 11.9789 12.0518 12.0518 k = 0.2021 0.2021 0.2021 ( 6739 PWs) bands (ev): -4.6447 -4.6447 -3.5844 -3.5844 -3.5837 -3.5837 -3.4550 -3.4550 -0.3706 -0.3706 -0.3639 -0.3639 -0.2191 -0.2191 -0.2146 -0.2146 -0.1105 -0.1105 -0.0979 -0.0979 -0.0870 -0.0870 -0.0135 -0.0135 0.0385 0.0385 0.0740 0.0740 0.1019 0.1019 0.1882 0.1882 0.2636 0.2636 0.2847 0.2847 0.3281 0.3281 0.3467 0.3467 0.4165 0.4165 0.4187 0.4187 0.4337 0.4337 0.4529 0.4529 0.4884 0.4884 0.5427 0.5427 0.5543 0.5543 0.5823 0.5823 0.5886 0.5886 0.6112 0.6112 0.6523 0.6523 0.6827 0.6827 0.6846 0.6846 0.7538 0.7538 2.0177 2.0177 2.0182 2.0182 3.3866 3.3866 3.3905 3.3905 3.6757 3.6757 4.7534 4.7534 4.9653 4.9653 5.6498 5.6498 5.7664 5.7664 5.8044 5.8044 7.4364 7.4364 7.5765 7.5765 8.2571 8.2571 8.2762 8.2762 8.4417 8.4417 10.6126 10.6126 10.6356 10.6356 10.6420 10.6420 11.7143 11.7143 12.0175 12.0175 12.0833 12.0833 k = 0.2128 0.2128 0.2128 ( 6736 PWs) bands (ev): -4.6102 -4.6102 -3.6017 -3.6017 -3.6011 -3.6011 -3.4626 -3.4626 -0.3552 -0.3552 -0.3478 -0.3478 -0.2147 -0.2147 -0.2089 -0.2089 -0.1062 -0.1062 -0.0940 -0.0940 -0.0816 -0.0816 -0.0112 -0.0112 0.0401 0.0401 0.0692 0.0692 0.1020 0.1020 0.1863 0.1863 0.2601 0.2601 0.2849 0.2849 0.3255 0.3255 0.3449 0.3449 0.4133 0.4133 0.4147 0.4147 0.4323 0.4323 0.4517 0.4517 0.4854 0.4854 0.5402 0.5402 0.5508 0.5508 0.5813 0.5813 0.5850 0.5850 0.6092 0.6092 0.6454 0.6454 0.6779 0.6779 0.6808 0.6808 0.7522 0.7522 1.9882 1.9882 1.9891 1.9891 3.4193 3.4193 3.4232 3.4232 3.5636 3.5636 4.8136 4.8136 4.9585 4.9585 5.6019 5.6019 5.8034 5.8034 5.8325 5.8325 7.4142 7.4142 7.5547 7.5547 8.3188 8.3188 8.3353 8.3353 8.4243 8.4243 10.7260 10.7260 10.7893 10.7893 10.8144 10.8144 11.8458 11.8458 12.0537 12.0537 12.1093 12.1093 k = 0.2234 0.2234 0.2234 ( 6736 PWs) bands (ev): -4.5746 -4.5746 -3.6189 -3.6189 -3.6183 -3.6183 -3.4701 -3.4701 -0.3398 -0.3398 -0.3317 -0.3317 -0.2100 -0.2100 -0.2027 -0.2027 -0.1015 -0.1015 -0.0900 -0.0900 -0.0762 -0.0762 -0.0092 -0.0092 0.0422 0.0422 0.0650 0.0650 0.1022 0.1022 0.1846 0.1846 0.2566 0.2566 0.2855 0.2855 0.3227 0.3227 0.3430 0.3430 0.4100 0.4100 0.4106 0.4106 0.4308 0.4308 0.4506 0.4506 0.4823 0.4823 0.5378 0.5378 0.5469 0.5469 0.5799 0.5799 0.5816 0.5816 0.6071 0.6071 0.6381 0.6381 0.6728 0.6728 0.6771 0.6771 0.7513 0.7513 1.9495 1.9495 1.9508 1.9508 3.4361 3.4361 3.4705 3.4705 3.4790 3.4790 4.8687 4.8687 4.9373 4.9373 5.5792 5.5792 5.8416 5.8416 5.8659 5.8659 7.3927 7.3927 7.5328 7.5328 8.3795 8.3795 8.3947 8.3947 8.4057 8.4057 10.8083 10.8083 10.9612 10.9612 10.9934 10.9934 11.9861 11.9861 12.0887 12.0887 12.1286 12.1286 k = 0.2340 0.2340 0.2340 ( 6743 PWs) bands (ev): -4.5380 -4.5380 -3.6360 -3.6360 -3.6354 -3.6354 -3.4775 -3.4775 -0.3245 -0.3245 -0.3159 -0.3159 -0.2048 -0.2048 -0.1959 -0.1959 -0.0967 -0.0967 -0.0859 -0.0859 -0.0709 -0.0709 -0.0077 -0.0077 0.0446 0.0446 0.0616 0.0616 0.1026 0.1026 0.1831 0.1831 0.2532 0.2532 0.2864 0.2864 0.3195 0.3195 0.3410 0.3410 0.4064 0.4064 0.4067 0.4067 0.4293 0.4293 0.4493 0.4493 0.4792 0.4792 0.5353 0.5353 0.5428 0.5428 0.5781 0.5781 0.5782 0.5782 0.6050 0.6050 0.6304 0.6304 0.6673 0.6673 0.6734 0.6734 0.7511 0.7511 1.9033 1.9033 1.9049 1.9049 3.3257 3.3257 3.5310 3.5310 3.5326 3.5326 4.8615 4.8615 4.9584 4.9584 5.5845 5.5845 5.8809 5.8809 5.9014 5.9014 7.3725 7.3725 7.5113 7.5113 8.3838 8.3838 8.4413 8.4413 8.4538 8.4538 10.8874 10.8874 11.1273 11.1273 11.1690 11.1690 12.0979 12.0979 12.1366 12.1366 12.1546 12.1546 k = 0.2447 0.2447 0.2447 ( 6746 PWs) bands (ev): -4.5007 -4.5007 -3.6527 -3.6527 -3.6522 -3.6522 -3.4848 -3.4848 -0.3095 -0.3095 -0.3004 -0.3004 -0.1990 -0.1990 -0.1885 -0.1885 -0.0915 -0.0915 -0.0815 -0.0815 -0.0657 -0.0657 -0.0064 -0.0064 0.0473 0.0473 0.0589 0.0589 0.1031 0.1031 0.1818 0.1818 0.2498 0.2498 0.2876 0.2876 0.3161 0.3161 0.3389 0.3389 0.4021 0.4021 0.4035 0.4035 0.4276 0.4276 0.4479 0.4479 0.4760 0.4760 0.5328 0.5328 0.5387 0.5387 0.5748 0.5748 0.5758 0.5758 0.6028 0.6028 0.6224 0.6224 0.6616 0.6616 0.6699 0.6699 0.7514 0.7514 1.8513 1.8513 1.8532 1.8532 3.2070 3.2070 3.6028 3.6028 3.6044 3.6044 4.7977 4.7977 5.0207 5.0207 5.6131 5.6131 5.9210 5.9210 5.9380 5.9380 7.3539 7.3539 7.4908 7.4908 8.3619 8.3619 8.5005 8.5005 8.5121 8.5121 10.9651 10.9651 11.2812 11.2812 11.3358 11.3358 12.1119 12.1119 12.1150 12.1150 12.2952 12.2952 k = 0.2553 0.2553 0.2553 ( 6746 PWs) bands (ev): -4.4626 -4.4626 -3.6692 -3.6692 -3.6686 -3.6686 -3.4918 -3.4918 -0.2947 -0.2947 -0.2854 -0.2854 -0.1924 -0.1924 -0.1805 -0.1805 -0.0861 -0.0861 -0.0770 -0.0770 -0.0606 -0.0606 -0.0054 -0.0054 0.0503 0.0503 0.0569 0.0569 0.1039 0.1039 0.1807 0.1807 0.2466 0.2466 0.2890 0.2890 0.3125 0.3125 0.3368 0.3368 0.3978 0.3978 0.4004 0.4004 0.4257 0.4257 0.4464 0.4464 0.4729 0.4729 0.5298 0.5298 0.5350 0.5350 0.5715 0.5715 0.5731 0.5731 0.6003 0.6003 0.6142 0.6142 0.6557 0.6557 0.6668 0.6668 0.7522 0.7522 1.7951 1.7951 1.7973 1.7973 3.0871 3.0871 3.6845 3.6845 3.6863 3.6863 4.7192 4.7192 5.0886 5.0886 5.6588 5.6588 5.9614 5.9614 5.9752 5.9752 7.3373 7.3373 7.4718 7.4718 8.3386 8.3386 8.5581 8.5581 8.5688 8.5688 11.0427 11.0427 11.4139 11.4139 11.4851 11.4851 12.0260 12.0260 12.0418 12.0418 12.3481 12.3481 k = 0.2660 0.2660 0.2660 ( 6734 PWs) bands (ev): -4.4240 -4.4240 -3.6852 -3.6852 -3.6847 -3.6847 -3.4987 -3.4987 -0.2805 -0.2805 -0.2713 -0.2713 -0.1849 -0.1849 -0.1718 -0.1718 -0.0804 -0.0804 -0.0723 -0.0723 -0.0556 -0.0556 -0.0048 -0.0048 0.0535 0.0535 0.0558 0.0558 0.1050 0.1050 0.1798 0.1798 0.2436 0.2436 0.2906 0.2906 0.3088 0.3088 0.3347 0.3347 0.3935 0.3935 0.3975 0.3975 0.4238 0.4238 0.4449 0.4449 0.4698 0.4698 0.5260 0.5260 0.5321 0.5321 0.5682 0.5682 0.5699 0.5699 0.5975 0.5975 0.6059 0.6059 0.6499 0.6499 0.6641 0.6641 0.7533 0.7533 1.7361 1.7361 1.7386 1.7386 2.9668 2.9668 3.7747 3.7747 3.7767 3.7767 4.6342 4.6342 5.1586 5.1586 5.7162 5.7162 6.0019 6.0019 6.0124 6.0124 7.3232 7.3232 7.4546 7.4546 8.3143 8.3143 8.6132 8.6132 8.6233 8.6233 11.1212 11.1212 11.5139 11.5139 11.6017 11.6017 11.8842 11.8842 11.8995 11.8995 12.3999 12.3999 k = 0.2766 0.2766 0.2766 ( 6728 PWs) bands (ev): -4.3851 -4.3851 -3.7008 -3.7008 -3.7003 -3.7003 -3.5052 -3.5052 -0.2667 -0.2667 -0.2583 -0.2583 -0.1763 -0.1763 -0.1624 -0.1624 -0.0744 -0.0744 -0.0672 -0.0672 -0.0509 -0.0509 -0.0043 -0.0043 0.0555 0.0555 0.0567 0.0567 0.1065 0.1065 0.1790 0.1790 0.2407 0.2407 0.2923 0.2923 0.3049 0.3049 0.3326 0.3326 0.3891 0.3891 0.3946 0.3946 0.4215 0.4215 0.4435 0.4435 0.4666 0.4666 0.5214 0.5214 0.5299 0.5299 0.5650 0.5650 0.5663 0.5663 0.5944 0.5944 0.5977 0.5977 0.6440 0.6440 0.6619 0.6619 0.7548 0.7548 1.6753 1.6753 1.6783 1.6783 2.8465 2.8465 3.8722 3.8722 3.8743 3.8743 4.5468 4.5468 5.2300 5.2300 5.7817 5.7817 6.0421 6.0421 6.0493 6.0493 7.3117 7.3117 7.4396 7.4396 8.2890 8.2890 8.6649 8.6649 8.6745 8.6745 11.2011 11.2011 11.5607 11.5607 11.6367 11.6367 11.7573 11.7573 11.7691 11.7691 12.4801 12.4801 k = 0.2872 0.2872 0.2872 ( 6737 PWs) bands (ev): -4.3461 -4.3461 -3.7158 -3.7158 -3.7153 -3.7153 -3.5114 -3.5114 -0.2537 -0.2537 -0.2466 -0.2466 -0.1664 -0.1664 -0.1523 -0.1523 -0.0682 -0.0682 -0.0618 -0.0618 -0.0465 -0.0465 -0.0041 -0.0041 0.0559 0.0559 0.0600 0.0600 0.1082 0.1082 0.1783 0.1783 0.2380 0.2380 0.2941 0.2941 0.3008 0.3008 0.3305 0.3305 0.3848 0.3848 0.3921 0.3921 0.4190 0.4190 0.4420 0.4420 0.4635 0.4635 0.5165 0.5165 0.5282 0.5282 0.5616 0.5616 0.5621 0.5621 0.5895 0.5895 0.5907 0.5907 0.6382 0.6382 0.6604 0.6604 0.7566 0.7566 1.6138 1.6138 1.6173 1.6173 2.7265 2.7265 3.9761 3.9761 3.9780 3.9780 4.4595 4.4595 5.3025 5.3025 5.8528 5.8528 6.0817 6.0817 6.0858 6.0858 7.3032 7.3032 7.4271 7.4271 8.2630 8.2630 8.7119 8.7119 8.7211 8.7211 11.2826 11.2826 11.4946 11.4946 11.5127 11.5127 11.6966 11.6966 11.7736 11.7736 12.5999 12.5999 k = 0.2979 0.2979 0.2979 ( 6737 PWs) bands (ev): -4.3071 -4.3071 -3.7304 -3.7304 -3.7299 -3.7299 -3.5171 -3.5171 -0.2416 -0.2416 -0.2364 -0.2364 -0.1552 -0.1552 -0.1414 -0.1414 -0.0617 -0.0617 -0.0559 -0.0559 -0.0423 -0.0423 -0.0039 -0.0039 0.0572 0.0572 0.0632 0.0632 0.1103 0.1103 0.1778 0.1778 0.2355 0.2355 0.2960 0.2960 0.2965 0.2965 0.3285 0.3285 0.3806 0.3806 0.3897 0.3897 0.4162 0.4162 0.4407 0.4407 0.4605 0.4605 0.5113 0.5113 0.5266 0.5266 0.5575 0.5575 0.5581 0.5581 0.5816 0.5816 0.5865 0.5865 0.6327 0.6327 0.6596 0.6596 0.7586 0.7586 1.5523 1.5523 1.5563 1.5563 2.6073 2.6073 4.0856 4.0856 4.0864 4.0864 4.3743 4.3743 5.3757 5.3757 5.9276 5.9276 6.1203 6.1203 6.1216 6.1216 7.2979 7.2979 7.4172 7.4172 8.2362 8.2362 8.7527 8.7527 8.7616 8.7616 11.3425 11.3425 11.3572 11.3572 11.3770 11.3770 11.6920 11.6920 11.7839 11.7839 12.5461 12.5461 k = 0.3085 0.3085 0.3085 ( 6755 PWs) bands (ev): -4.2684 -4.2684 -3.7443 -3.7443 -3.7439 -3.7439 -3.5224 -3.5224 -0.2305 -0.2305 -0.2276 -0.2276 -0.1427 -0.1427 -0.1297 -0.1297 -0.0549 -0.0549 -0.0497 -0.0497 -0.0384 -0.0384 -0.0038 -0.0038 0.0593 0.0593 0.0664 0.0664 0.1125 0.1125 0.1774 0.1774 0.2333 0.2333 0.2921 0.2921 0.2976 0.2976 0.3267 0.3267 0.3764 0.3764 0.3876 0.3876 0.4131 0.4131 0.4393 0.4393 0.4576 0.4576 0.5062 0.5062 0.5250 0.5250 0.5523 0.5523 0.5545 0.5545 0.5740 0.5740 0.5819 0.5819 0.6274 0.6274 0.6594 0.6594 0.7609 0.7609 1.4914 1.4914 1.4961 1.4961 2.4891 2.4891 4.1943 4.1943 4.2001 4.2001 4.2968 4.2968 5.4494 5.4494 6.0042 6.0042 6.1573 6.1573 6.1575 6.1575 7.2959 7.2959 7.4103 7.4103 8.2088 8.2088 8.7851 8.7851 8.7939 8.7939 11.2030 11.2030 11.2064 11.2064 11.4554 11.4554 11.6845 11.6845 11.7770 11.7770 12.3909 12.3909 k = 0.3191 0.3191 0.3191 ( 6746 PWs) bands (ev): -4.2301 -4.2301 -3.7576 -3.7576 -3.7572 -3.7572 -3.5271 -3.5271 -0.2206 -0.2206 -0.2201 -0.2201 -0.1291 -0.1291 -0.1171 -0.1171 -0.0476 -0.0476 -0.0430 -0.0430 -0.0347 -0.0347 -0.0035 -0.0035 0.0621 0.0621 0.0694 0.0694 0.1149 0.1149 0.1771 0.1771 0.2314 0.2314 0.2876 0.2876 0.2991 0.2991 0.3252 0.3252 0.3725 0.3725 0.3858 0.3858 0.4097 0.4097 0.4382 0.4382 0.4548 0.4548 0.5011 0.5011 0.5232 0.5232 0.5467 0.5467 0.5507 0.5507 0.5671 0.5671 0.5769 0.5769 0.6226 0.6226 0.6600 0.6600 0.7634 0.7634 1.4315 1.4315 1.4370 1.4370 2.3723 2.3723 4.1979 4.1979 4.3190 4.3190 4.3311 4.3311 5.5232 5.5232 6.0794 6.0794 6.1929 6.1929 6.1946 6.1946 7.2975 7.2975 7.4064 7.4064 8.1808 8.1808 8.8069 8.8069 8.8155 8.8155 11.0649 11.0649 11.0672 11.0672 11.5434 11.5434 11.6682 11.6682 11.7567 11.7567 12.2391 12.2391 k = 0.3298 0.3298 0.3298 ( 6749 PWs) bands (ev): -4.1926 -4.1926 -3.7703 -3.7703 -3.7699 -3.7699 -3.5313 -3.5313 -0.2138 -0.2138 -0.2118 -0.2118 -0.1148 -0.1148 -0.1037 -0.1037 -0.0401 -0.0401 -0.0358 -0.0358 -0.0312 -0.0312 -0.0031 -0.0031 0.0657 0.0657 0.0723 0.0723 0.1172 0.1172 0.1770 0.1770 0.2299 0.2299 0.2829 0.2829 0.3001 0.3001 0.3242 0.3242 0.3687 0.3687 0.3844 0.3844 0.4062 0.4062 0.4371 0.4371 0.4521 0.4521 0.4961 0.4961 0.5210 0.5210 0.5405 0.5405 0.5468 0.5468 0.5611 0.5611 0.5715 0.5715 0.6183 0.6183 0.6612 0.6612 0.7661 0.7661 1.3730 1.3730 1.3796 1.3796 2.2571 2.2571 4.1245 4.1245 4.4418 4.4418 4.4496 4.4496 5.5968 5.5968 6.1468 6.1468 6.2264 6.2264 6.2392 6.2392 7.3026 7.3026 7.4056 7.4056 8.1522 8.1522 8.8151 8.8151 8.8237 8.8237 10.9409 10.9409 10.9433 10.9433 11.6249 11.6249 11.6529 11.6529 11.7273 11.7273 12.0920 12.0920 k = 0.3404 0.3404 0.3404 ( 6743 PWs) bands (ev): -4.1562 -4.1562 -3.7823 -3.7823 -3.7819 -3.7819 -3.5347 -3.5347 -0.2083 -0.2083 -0.2043 -0.2043 -0.1000 -0.1000 -0.0895 -0.0895 -0.0325 -0.0325 -0.0281 -0.0281 -0.0278 -0.0278 -0.0022 -0.0022 0.0699 0.0699 0.0750 0.0750 0.1192 0.1192 0.1771 0.1771 0.2287 0.2287 0.2781 0.2781 0.3006 0.3006 0.3239 0.3239 0.3651 0.3651 0.3834 0.3834 0.4024 0.4024 0.4360 0.4360 0.4495 0.4495 0.4913 0.4913 0.5180 0.5180 0.5338 0.5338 0.5428 0.5428 0.5562 0.5562 0.5660 0.5660 0.6146 0.6146 0.6629 0.6629 0.7689 0.7689 1.3163 1.3163 1.3242 1.3242 2.1439 2.1439 4.0514 4.0514 4.5682 4.5682 4.5751 4.5751 5.6700 5.6700 6.1967 6.1967 6.2575 6.2575 6.3001 6.3001 7.3112 7.3112 7.4080 7.4080 8.1229 8.1229 8.8070 8.8070 8.8156 8.8156 10.8348 10.8348 10.8378 10.8378 11.6099 11.6099 11.6916 11.6916 11.7295 11.7295 11.9510 11.9510 k = 0.3511 0.3511 0.3511 ( 6737 PWs) bands (ev): -4.1210 -4.1210 -3.7936 -3.7936 -3.7932 -3.7932 -3.5374 -3.5374 -0.2035 -0.2035 -0.1981 -0.1981 -0.0851 -0.0851 -0.0747 -0.0747 -0.0253 -0.0253 -0.0245 -0.0245 -0.0198 -0.0198 -0.0003 -0.0003 0.0746 0.0746 0.0776 0.0776 0.1209 0.1209 0.1774 0.1774 0.2280 0.2280 0.2732 0.2732 0.3005 0.3005 0.3244 0.3244 0.3618 0.3618 0.3828 0.3828 0.3985 0.3985 0.4351 0.4351 0.4472 0.4472 0.4866 0.4866 0.5141 0.5141 0.5265 0.5265 0.5386 0.5386 0.5527 0.5527 0.5603 0.5603 0.6116 0.6116 0.6652 0.6652 0.7720 0.7720 1.2617 1.2617 1.2710 1.2710 2.0328 2.0328 3.9817 3.9817 4.6977 4.6977 4.7044 4.7044 5.7422 5.7422 6.2303 6.2303 6.2861 6.2861 6.3752 6.3752 7.3230 7.3230 7.4134 7.4134 8.0930 8.0930 8.7802 8.7802 8.7889 8.7889 10.7492 10.7492 10.7532 10.7532 11.5765 11.5765 11.6520 11.6520 11.7904 11.7904 11.8474 11.8474 k = 0.3617 0.3617 0.3617 ( 6749 PWs) bands (ev): -4.0874 -4.0874 -3.8041 -3.8041 -3.8038 -3.8038 -3.5394 -3.5394 -0.1995 -0.1995 -0.1931 -0.1931 -0.0704 -0.0704 -0.0595 -0.0595 -0.0209 -0.0209 -0.0195 -0.0195 -0.0109 -0.0109 0.0034 0.0034 0.0799 0.0799 0.0799 0.0799 0.1219 0.1219 0.1778 0.1778 0.2278 0.2278 0.2680 0.2680 0.2999 0.2999 0.3255 0.3255 0.3588 0.3588 0.3827 0.3827 0.3944 0.3944 0.4342 0.4342 0.4449 0.4449 0.4821 0.4821 0.5091 0.5091 0.5185 0.5185 0.5343 0.5343 0.5510 0.5510 0.5545 0.5545 0.6093 0.6093 0.6680 0.6680 0.7751 0.7751 1.2093 1.2093 1.2202 1.2202 1.9243 1.9243 3.9160 3.9160 4.8300 4.8300 4.8367 4.8367 5.8131 5.8131 6.2551 6.2551 6.3119 6.3119 6.4568 6.4568 7.3378 7.3378 7.4217 7.4217 8.0623 8.0623 8.7332 8.7332 8.7420 8.7420 10.6853 10.6853 10.6907 10.6907 11.5402 11.5402 11.6101 11.6101 11.6761 11.6761 11.9266 11.9266 k = 0.3723 0.3723 0.3723 ( 6740 PWs) bands (ev): -4.0556 -4.0556 -3.8139 -3.8139 -3.8136 -3.8136 -3.5405 -3.5405 -0.1959 -0.1959 -0.1890 -0.1890 -0.0564 -0.0564 -0.0442 -0.0442 -0.0168 -0.0168 -0.0155 -0.0155 -0.0013 -0.0013 0.0097 0.0097 0.0822 0.0822 0.0857 0.0857 0.1223 0.1223 0.1783 0.1783 0.2283 0.2283 0.2629 0.2629 0.2989 0.2989 0.3271 0.3271 0.3560 0.3560 0.3829 0.3829 0.3902 0.3902 0.4335 0.4335 0.4429 0.4429 0.4778 0.4778 0.5034 0.5034 0.5101 0.5101 0.5298 0.5298 0.5488 0.5488 0.5510 0.5510 0.6079 0.6079 0.6712 0.6712 0.7784 0.7784 1.1594 1.1594 1.1722 1.1722 1.8185 1.8185 3.8546 3.8546 4.9648 4.9648 4.9715 4.9715 5.8823 5.8823 6.2748 6.2748 6.3351 6.3351 6.5405 6.5405 7.3551 7.3551 7.4326 7.4326 8.0309 8.0309 8.6659 8.6659 8.6751 8.6751 10.6428 10.6428 10.6500 10.6500 11.5024 11.5024 11.5532 11.5532 11.5674 11.5674 12.0212 12.0212 k = 0.3830 0.3830 0.3830 ( 6764 PWs) bands (ev): -4.0258 -4.0258 -3.8230 -3.8230 -3.8227 -3.8227 -3.5408 -3.5408 -0.1928 -0.1928 -0.1860 -0.1860 -0.0440 -0.0440 -0.0295 -0.0295 -0.0133 -0.0133 -0.0114 -0.0114 0.0090 0.0090 0.0185 0.0185 0.0843 0.0843 0.0918 0.0918 0.1219 0.1219 0.1786 0.1786 0.2293 0.2293 0.2575 0.2575 0.2979 0.2979 0.3290 0.3290 0.3535 0.3535 0.3833 0.3833 0.3861 0.3861 0.4328 0.4328 0.4410 0.4410 0.4737 0.4737 0.4970 0.4970 0.5012 0.5012 0.5253 0.5253 0.5431 0.5431 0.5526 0.5526 0.6072 0.6072 0.6749 0.6749 0.7817 0.7817 1.1121 1.1121 1.1270 1.1270 1.7158 1.7158 3.7977 3.7977 5.1016 5.1016 5.1084 5.1084 5.9493 5.9493 6.2909 6.2909 6.3554 6.3554 6.6248 6.6248 7.3744 7.3744 7.4455 7.4455 7.9985 7.9985 8.5799 8.5799 8.5897 8.5897 10.6197 10.6197 10.6290 10.6290 11.4320 11.4320 11.4695 11.4695 11.5252 11.5252 12.1146 12.1146 k = 0.3936 0.3936 0.3936 ( 6752 PWs) bands (ev): -3.9984 -3.9984 -3.8313 -3.8313 -3.8310 -3.8310 -3.5403 -3.5403 -0.1901 -0.1901 -0.1837 -0.1837 -0.0341 -0.0341 -0.0160 -0.0160 -0.0117 -0.0117 -0.0040 -0.0040 0.0198 0.0198 0.0296 0.0296 0.0864 0.0864 0.0984 0.0984 0.1208 0.1208 0.1788 0.1788 0.2309 0.2309 0.2521 0.2521 0.2972 0.2972 0.3311 0.3311 0.3513 0.3513 0.3811 0.3811 0.3852 0.3852 0.4325 0.4325 0.4393 0.4393 0.4698 0.4698 0.4904 0.4904 0.4919 0.4919 0.5209 0.5209 0.5375 0.5375 0.5555 0.5555 0.6076 0.6076 0.6790 0.6790 0.7851 0.7851 1.0675 1.0675 1.0849 1.0849 1.6165 1.6165 3.7453 3.7453 5.2400 5.2400 5.2469 5.2469 6.0135 6.0135 6.3041 6.3041 6.3731 6.3731 6.7086 6.7086 7.3950 7.3950 7.4600 7.4600 7.9652 7.9652 8.4779 8.4779 8.4886 8.4886 10.6126 10.6126 10.6245 10.6245 11.3226 11.3226 11.4338 11.4338 11.4848 11.4848 12.2025 12.2025 k = 0.4043 0.4043 0.4043 ( 6764 PWs) bands (ev): -3.9735 -3.9735 -3.8389 -3.8389 -3.8385 -3.8385 -3.5390 -3.5390 -0.1878 -0.1878 -0.1820 -0.1820 -0.0272 -0.0272 -0.0117 -0.0117 -0.0030 -0.0030 0.0056 0.0056 0.0305 0.0305 0.0428 0.0428 0.0884 0.0884 0.1053 0.1053 0.1189 0.1189 0.1785 0.1785 0.2327 0.2327 0.2467 0.2467 0.2970 0.2970 0.3333 0.3333 0.3494 0.3494 0.3768 0.3768 0.3866 0.3866 0.4324 0.4324 0.4376 0.4376 0.4659 0.4659 0.4825 0.4825 0.4836 0.4836 0.5169 0.5169 0.5321 0.5321 0.5597 0.5597 0.6092 0.6092 0.6835 0.6835 0.7885 0.7885 1.0259 1.0259 1.0459 1.0459 1.5208 1.5208 3.6977 3.6977 5.3796 5.3796 5.3866 5.3866 6.0745 6.0745 6.3149 6.3149 6.3883 6.3883 6.7913 6.7913 7.4160 7.4160 7.4751 7.4751 7.9308 7.9308 8.3631 8.3631 8.3751 8.3751 10.6176 10.6176 10.6326 10.6326 11.2199 11.2199 11.4024 11.4024 11.4473 11.4473 12.2784 12.2784 k = 0.4149 0.4149 0.4149 ( 6764 PWs) bands (ev): -3.9513 -3.9513 -3.8456 -3.8456 -3.8453 -3.8453 -3.5369 -3.5369 -0.1859 -0.1859 -0.1808 -0.1808 -0.0225 -0.0225 -0.0112 -0.0112 0.0079 0.0079 0.0167 0.0167 0.0406 0.0406 0.0576 0.0576 0.0907 0.0907 0.1127 0.1127 0.1164 0.1164 0.1779 0.1779 0.2342 0.2342 0.2412 0.2412 0.2978 0.2978 0.3356 0.3356 0.3478 0.3478 0.3725 0.3725 0.3883 0.3883 0.4326 0.4326 0.4359 0.4359 0.4623 0.4623 0.4731 0.4731 0.4766 0.4766 0.5134 0.5134 0.5269 0.5269 0.5648 0.5648 0.6124 0.6124 0.6883 0.6883 0.7920 0.7920 0.9874 0.9874 1.0101 1.0101 1.4291 1.4291 3.6548 3.6548 5.5196 5.5196 5.5267 5.5267 6.1317 6.1317 6.3237 6.3237 6.4012 6.4012 6.8723 6.8723 7.4367 7.4367 7.4900 7.4900 7.8952 7.8952 8.2390 8.2390 8.2531 8.2531 10.6305 10.6305 10.6492 10.6492 11.1256 11.1256 11.3754 11.3754 11.4139 11.4139 12.3324 12.3324 k = 0.4255 0.4255 0.4255 ( 6764 PWs) bands (ev): -3.9319 -3.9319 -3.8516 -3.8516 -3.8513 -3.8513 -3.5343 -3.5343 -0.1842 -0.1842 -0.1801 -0.1801 -0.0192 -0.0192 -0.0110 -0.0110 0.0179 0.0179 0.0279 0.0279 0.0501 0.0501 0.0722 0.0722 0.0942 0.0942 0.1132 0.1132 0.1203 0.1203 0.1770 0.1770 0.2348 0.2348 0.2356 0.2356 0.2999 0.2999 0.3379 0.3379 0.3465 0.3465 0.3682 0.3682 0.3904 0.3904 0.4332 0.4332 0.4339 0.4339 0.4588 0.4588 0.4642 0.4642 0.4697 0.4697 0.5104 0.5104 0.5219 0.5219 0.5705 0.5705 0.6180 0.6180 0.6935 0.6935 0.7955 0.7955 0.9521 0.9521 0.9776 0.9776 1.3419 1.3419 3.6168 3.6168 5.6592 5.6592 5.6662 5.6662 6.1846 6.1846 6.3309 6.3309 6.4120 6.4120 6.9509 6.9509 7.4559 7.4559 7.5034 7.5034 7.8586 7.8586 8.1093 8.1093 8.1264 8.1264 10.6475 10.6475 10.6705 10.6705 11.0405 11.0405 11.3538 11.3538 11.3855 11.3855 12.3558 12.3558 k = 0.4362 0.4362 0.4362 ( 6770 PWs) bands (ev): -3.9152 -3.9152 -3.8568 -3.8568 -3.8565 -3.8565 -3.5314 -3.5314 -0.1828 -0.1828 -0.1796 -0.1796 -0.0167 -0.0167 -0.0108 -0.0108 0.0271 0.0271 0.0385 0.0385 0.0588 0.0588 0.0827 0.0827 0.1019 0.1019 0.1094 0.1094 0.1283 0.1283 0.1757 0.1757 0.2301 0.2301 0.2340 0.2340 0.3033 0.3033 0.3402 0.3402 0.3454 0.3454 0.3639 0.3639 0.3926 0.3926 0.4311 0.4311 0.4341 0.4341 0.4554 0.4554 0.4566 0.4566 0.4629 0.4629 0.5080 0.5080 0.5173 0.5173 0.5761 0.5761 0.6266 0.6266 0.6991 0.6991 0.7991 0.7991 0.9203 0.9203 0.9485 0.9485 1.2593 1.2593 3.5837 3.5837 5.7972 5.7972 5.8038 5.8038 6.2328 6.2328 6.3368 6.3368 6.4210 6.4210 7.0267 7.0267 7.4721 7.4721 7.5131 7.5131 7.8208 7.8208 7.9779 7.9779 7.9996 7.9996 10.6652 10.6652 10.6931 10.6931 10.9653 10.9653 11.3380 11.3380 11.3630 11.3630 12.3510 12.3510 k = 0.4468 0.4468 0.4468 ( 6770 PWs) bands (ev): -3.9014 -3.9014 -3.8612 -3.8612 -3.8609 -3.8609 -3.5282 -3.5282 -0.1817 -0.1817 -0.1794 -0.1794 -0.0147 -0.0147 -0.0106 -0.0106 0.0358 0.0358 0.0480 0.0480 0.0665 0.0665 0.0872 0.0872 0.1052 0.1052 0.1154 0.1154 0.1365 0.1365 0.1743 0.1743 0.2247 0.2247 0.2315 0.2315 0.3079 0.3079 0.3424 0.3424 0.3446 0.3446 0.3600 0.3600 0.3951 0.3951 0.4269 0.4269 0.4353 0.4353 0.4510 0.4510 0.4519 0.4519 0.4566 0.4566 0.5061 0.5061 0.5132 0.5132 0.5812 0.5812 0.6391 0.6391 0.7048 0.7048 0.8027 0.8027 0.8923 0.8923 0.9229 0.9229 1.1821 1.1821 3.5556 3.5556 5.9317 5.9317 5.9369 5.9369 6.2759 6.2759 6.3421 6.3421 6.4286 6.4286 7.0987 7.0987 7.4830 7.4830 7.5154 7.5154 7.7816 7.7816 7.8504 7.8504 7.8794 7.8794 10.6811 10.6811 10.7144 10.7144 10.9009 10.9009 11.3281 11.3281 11.3464 11.3464 12.3303 12.3303 k = 0.4574 0.4574 0.4574 ( 6752 PWs) bands (ev): -3.8902 -3.8902 -3.8648 -3.8648 -3.8645 -3.8645 -3.5252 -3.5252 -0.1808 -0.1808 -0.1792 -0.1792 -0.0131 -0.0131 -0.0105 -0.0105 0.0440 0.0440 0.0561 0.0561 0.0732 0.0732 0.0888 0.0888 0.1009 0.1009 0.1305 0.1305 0.1447 0.1447 0.1730 0.1730 0.2194 0.2194 0.2274 0.2274 0.3131 0.3131 0.3441 0.3441 0.3445 0.3445 0.3564 0.3564 0.3978 0.3978 0.4214 0.4214 0.4367 0.4367 0.4475 0.4475 0.4477 0.4477 0.4520 0.4520 0.5047 0.5047 0.5096 0.5096 0.5855 0.5855 0.6558 0.6558 0.7104 0.7104 0.8062 0.8062 0.8688 0.8688 0.9011 0.9011 1.1109 1.1109 3.5326 3.5326 6.0595 6.0595 6.0614 6.0614 6.3136 6.3136 6.3484 6.3484 6.4352 6.4352 7.1661 7.1661 7.4834 7.4834 7.5026 7.5026 7.7232 7.7232 7.7535 7.7535 7.7767 7.7767 10.6933 10.6933 10.7325 10.7325 10.8480 10.8480 11.3234 11.3234 11.3356 11.3356 12.3045 12.3045 k = 0.4681 0.4681 0.4681 ( 6755 PWs) bands (ev): -3.8817 -3.8817 -3.8676 -3.8676 -3.8673 -3.8673 -3.5225 -3.5225 -0.1801 -0.1801 -0.1792 -0.1792 -0.0119 -0.0119 -0.0105 -0.0105 0.0519 0.0519 0.0626 0.0626 0.0784 0.0784 0.0887 0.0887 0.0971 0.0971 0.1450 0.1450 0.1524 0.1524 0.1718 0.1718 0.2142 0.2142 0.2217 0.2217 0.3182 0.3182 0.3437 0.3437 0.3457 0.3457 0.3537 0.3537 0.4006 0.4006 0.4157 0.4157 0.4380 0.4380 0.4424 0.4424 0.4459 0.4459 0.4491 0.4491 0.5037 0.5037 0.5066 0.5066 0.5888 0.5888 0.6758 0.6758 0.7158 0.7158 0.8079 0.8079 0.8520 0.8520 0.8832 0.8832 1.0468 1.0468 3.5146 3.5146 6.1692 6.1692 6.1756 6.1756 6.3389 6.3389 6.3656 6.3656 6.4414 6.4414 7.2273 7.2273 7.4610 7.4610 7.4639 7.4639 7.6373 7.6373 7.7074 7.7074 7.7139 7.7139 10.7008 10.7008 10.7464 10.7464 10.8079 10.8079 11.3226 11.3226 11.3296 11.3296 12.2803 12.2803 k = 0.4787 0.4787 0.4787 ( 6770 PWs) bands (ev): -3.8757 -3.8757 -3.8696 -3.8696 -3.8693 -3.8693 -3.5204 -3.5204 -0.1796 -0.1796 -0.1792 -0.1792 -0.0111 -0.0111 -0.0104 -0.0104 0.0594 0.0594 0.0672 0.0672 0.0817 0.0817 0.0865 0.0865 0.0951 0.0951 0.1575 0.1575 0.1592 0.1592 0.1716 0.1716 0.2096 0.2096 0.2149 0.2149 0.3226 0.3226 0.3434 0.3434 0.3454 0.3454 0.3527 0.3527 0.4034 0.4034 0.4109 0.4109 0.4364 0.4364 0.4404 0.4404 0.4451 0.4451 0.4470 0.4470 0.5030 0.5030 0.5043 0.5043 0.5912 0.5912 0.6973 0.6973 0.7203 0.7203 0.8042 0.8042 0.8464 0.8464 0.8698 0.8698 0.9915 0.9915 3.5017 3.5017 6.2468 6.2468 6.2711 6.2711 6.3474 6.3474 6.4036 6.4036 6.4485 6.4485 7.2792 7.2792 7.4044 7.4044 7.4081 7.4081 7.5896 7.5896 7.6744 7.6744 7.6845 7.6845 10.7032 10.7032 10.7560 10.7560 10.7812 10.7812 11.3238 11.3238 11.3270 11.3270 12.2611 12.2611 k = 0.4894 0.4894 0.4894 ( 6776 PWs) bands (ev): -3.8722 -3.8722 -3.8707 -3.8707 -3.8705 -3.8705 -3.5191 -3.5191 -0.1793 -0.1793 -0.1792 -0.1792 -0.0106 -0.0106 -0.0104 -0.0104 0.0663 0.0663 0.0700 0.0700 0.0798 0.0798 0.0858 0.0858 0.0947 0.0947 0.1642 0.1642 0.1648 0.1648 0.1743 0.1743 0.2062 0.2062 0.2082 0.2082 0.3258 0.3258 0.3433 0.3433 0.3440 0.3440 0.3530 0.3530 0.4056 0.4056 0.4076 0.4076 0.4330 0.4330 0.4414 0.4414 0.4447 0.4447 0.4454 0.4454 0.5026 0.5026 0.5029 0.5029 0.5927 0.5927 0.7161 0.7161 0.7234 0.7234 0.7956 0.7956 0.8524 0.8524 0.8613 0.8613 0.9491 0.9491 3.4940 3.4940 6.2863 6.2863 6.3333 6.3333 6.3521 6.3521 6.4446 6.4446 6.4575 6.4575 7.3164 7.3164 7.3513 7.3513 7.3533 7.3533 7.5686 7.5686 7.6623 7.6623 7.6657 7.6657 10.7022 10.7022 10.7615 10.7615 10.7674 10.7674 11.3253 11.3253 11.3261 11.3261 12.2490 12.2490 k = 0.5000 0.5000 0.5000 ( 6776 PWs) bands (ev): -3.8713 -3.8713 -3.8709 -3.8709 -3.8709 -3.8709 -3.5186 -3.5186 -0.1792 -0.1792 -0.1792 -0.1792 -0.0104 -0.0104 -0.0104 -0.0104 0.0710 0.0710 0.0710 0.0710 0.0760 0.0760 0.0863 0.0863 0.0947 0.0947 0.1660 0.1660 0.1660 0.1660 0.1775 0.1775 0.2048 0.2048 0.2048 0.2048 0.3270 0.3270 0.3433 0.3433 0.3433 0.3433 0.3532 0.3532 0.4065 0.4065 0.4065 0.4065 0.4316 0.4316 0.4421 0.4421 0.4446 0.4446 0.4446 0.4446 0.5025 0.5025 0.5025 0.5025 0.5932 0.5932 0.7245 0.7245 0.7245 0.7245 0.7908 0.7908 0.8584 0.8584 0.8584 0.8584 0.9308 0.9308 3.4914 3.4914 6.2971 6.2971 6.3540 6.3540 6.3540 6.3540 6.4628 6.4628 6.4628 6.4628 7.3302 7.3302 7.3302 7.3302 7.3311 7.3311 7.5616 7.5616 7.6593 7.6593 7.6593 7.6593 10.7012 10.7012 10.7633 10.7633 10.7633 10.7633 11.3260 11.3260 11.3260 11.3260 12.2449 12.2449 k = 0.5000 0.5000 0.5000 ( 6776 PWs) bands (ev): -3.8713 -3.8713 -3.8709 -3.8709 -3.8709 -3.8709 -3.5186 -3.5186 -0.1792 -0.1792 -0.1792 -0.1792 -0.0104 -0.0104 -0.0104 -0.0104 0.0710 0.0710 0.0710 0.0710 0.0760 0.0760 0.0863 0.0863 0.0947 0.0947 0.1660 0.1660 0.1660 0.1660 0.1775 0.1775 0.2048 0.2048 0.2048 0.2048 0.3270 0.3270 0.3433 0.3433 0.3433 0.3433 0.3532 0.3532 0.4065 0.4065 0.4065 0.4065 0.4316 0.4316 0.4421 0.4421 0.4446 0.4446 0.4446 0.4446 0.5025 0.5025 0.5025 0.5025 0.5932 0.5932 0.7245 0.7245 0.7245 0.7245 0.7908 0.7908 0.8584 0.8584 0.8584 0.8584 0.9308 0.9308 3.4914 3.4914 6.2971 6.2971 6.3540 6.3540 6.3540 6.3540 6.4628 6.4628 6.4628 6.4628 7.3302 7.3302 7.3302 7.3302 7.3311 7.3311 7.5616 7.5616 7.6593 7.6593 7.6593 7.6593 10.7012 10.7012 10.7633 10.7633 10.7633 10.7633 11.3260 11.3260 11.3260 11.3260 12.2449 12.2449 k = 0.4872 0.5000 0.4872 ( 6776 PWs) bands (ev): -3.8719 -3.8719 -3.8713 -3.8713 -3.8703 -3.8703 -3.5191 -3.5191 -0.1793 -0.1793 -0.1792 -0.1792 -0.0106 -0.0106 -0.0104 -0.0104 0.0663 0.0663 0.0702 0.0702 0.0797 0.0797 0.0858 0.0858 0.0947 0.0947 0.1639 0.1639 0.1652 0.1652 0.1744 0.1744 0.2058 0.2058 0.2084 0.2084 0.3258 0.3258 0.3433 0.3433 0.3439 0.3439 0.3530 0.3530 0.4057 0.4057 0.4075 0.4075 0.4329 0.4329 0.4414 0.4414 0.4447 0.4447 0.4454 0.4454 0.5025 0.5025 0.5030 0.5030 0.5927 0.5927 0.7165 0.7165 0.7234 0.7234 0.7951 0.7951 0.8522 0.8522 0.8621 0.8621 0.9484 0.9484 3.4939 3.4939 6.2866 6.2866 6.3354 6.3354 6.3508 6.3508 6.4462 6.4462 6.4564 6.4564 7.3255 7.3255 7.3337 7.3337 7.3610 7.3610 7.5683 7.5683 7.6607 7.6607 7.6670 7.6670 10.7022 10.7022 10.7619 10.7619 10.7669 10.7669 11.3239 11.3239 11.3275 11.3275 12.2489 12.2489 k = 0.4744 0.5000 0.4744 ( 6764 PWs) bands (ev): -3.8743 -3.8743 -3.8721 -3.8721 -3.8682 -3.8682 -3.5204 -3.5204 -0.1796 -0.1796 -0.1792 -0.1792 -0.0110 -0.0110 -0.0104 -0.0104 0.0590 0.0590 0.0680 0.0680 0.0820 0.0820 0.0861 0.0861 0.0950 0.0950 0.1557 0.1557 0.1629 0.1629 0.1706 0.1706 0.2084 0.2084 0.2155 0.2155 0.3228 0.3228 0.3434 0.3434 0.3454 0.3454 0.3526 0.3526 0.4039 0.4039 0.4102 0.4102 0.4364 0.4364 0.4403 0.4403 0.4452 0.4452 0.4468 0.4468 0.5028 0.5028 0.5045 0.5045 0.5913 0.5913 0.6984 0.6984 0.7204 0.7204 0.8001 0.8001 0.8465 0.8465 0.8744 0.8744 0.9883 0.9883 3.5014 3.5014 6.2427 6.2427 6.2867 6.2867 6.3407 6.3407 6.4122 6.4122 6.4397 6.4397 7.3122 7.3122 7.3402 7.3402 7.4420 7.4420 7.5837 7.5837 7.6684 7.6684 7.6905 7.6905 10.7036 10.7036 10.7577 10.7577 10.7789 10.7789 11.3185 11.3185 11.3321 11.3321 12.2607 12.2607 k = 0.4615 0.5000 0.4615 ( 6760 PWs) bands (ev): -3.8783 -3.8783 -3.8735 -3.8735 -3.8646 -3.8646 -3.5224 -3.5224 -0.1800 -0.1800 -0.1792 -0.1792 -0.0118 -0.0118 -0.0105 -0.0105 0.0509 0.0509 0.0641 0.0641 0.0791 0.0791 0.0885 0.0885 0.0964 0.0964 0.1430 0.1430 0.1599 0.1599 0.1683 0.1683 0.2121 0.2121 0.2227 0.2227 0.3187 0.3187 0.3429 0.3429 0.3469 0.3469 0.3529 0.3529 0.4017 0.4017 0.4141 0.4141 0.4391 0.4391 0.4405 0.4405 0.4470 0.4470 0.4486 0.4486 0.5031 0.5031 0.5069 0.5069 0.5891 0.5891 0.6770 0.6770 0.7163 0.7163 0.7992 0.7992 0.8492 0.8492 0.8968 0.8968 1.0398 1.0398 3.5139 3.5139 6.1439 6.1439 6.2326 6.2326 6.3225 6.3225 6.3778 6.3778 6.4182 6.4182 7.2926 7.2926 7.3441 7.3441 7.5521 7.5521 7.5967 7.5967 7.6944 7.6944 7.7298 7.7298 10.7020 10.7020 10.7509 10.7509 10.8019 10.8019 11.3118 11.3118 11.3393 11.3393 12.2797 12.2797 k = 0.4487 0.5000 0.4487 ( 6760 PWs) bands (ev): -3.8838 -3.8838 -3.8756 -3.8756 -3.8597 -3.8597 -3.5252 -3.5252 -0.1806 -0.1806 -0.1793 -0.1793 -0.0129 -0.0129 -0.0106 -0.0106 0.0419 0.0419 0.0587 0.0587 0.0744 0.0744 0.0892 0.0892 0.0994 0.0994 0.1284 0.1284 0.1567 0.1567 0.1663 0.1663 0.2162 0.2162 0.2290 0.2290 0.3143 0.3143 0.3411 0.3411 0.3483 0.3483 0.3547 0.3547 0.3997 0.3997 0.4188 0.4188 0.4380 0.4380 0.4428 0.4428 0.4501 0.4501 0.4523 0.4523 0.5036 0.5036 0.5102 0.5102 0.5862 0.5862 0.6558 0.6558 0.7121 0.7121 0.7963 0.7963 0.8567 0.8567 0.9277 0.9277 1.0992 1.0992 3.5312 3.5312 6.0140 6.0140 6.1668 6.1668 6.2946 6.2946 6.3435 6.3435 6.3971 6.3971 7.2684 7.2684 7.3405 7.3405 7.5880 7.5880 7.6870 7.6870 7.7455 7.7455 7.7842 7.7842 10.6953 10.6953 10.7412 10.7412 10.8372 10.8372 11.3071 11.3071 11.3488 11.3488 12.3048 12.3048 k = 0.4359 0.5000 0.4359 ( 6768 PWs) bands (ev): -3.8909 -3.8909 -3.8785 -3.8785 -3.8533 -3.8533 -3.5283 -3.5283 -0.1815 -0.1815 -0.1794 -0.1794 -0.0143 -0.0143 -0.0108 -0.0108 0.0320 0.0320 0.0514 0.0514 0.0685 0.0685 0.0887 0.0887 0.1027 0.1027 0.1135 0.1135 0.1537 0.1537 0.1644 0.1644 0.2204 0.2204 0.2339 0.2339 0.3098 0.3098 0.3382 0.3382 0.3500 0.3500 0.3571 0.3571 0.3980 0.3980 0.4237 0.4237 0.4370 0.4370 0.4441 0.4441 0.4520 0.4520 0.4595 0.4595 0.5043 0.5043 0.5142 0.5142 0.5830 0.5830 0.6361 0.6361 0.7085 0.7085 0.7940 0.7940 0.8669 0.8669 0.9647 0.9647 1.1651 1.1651 3.5535 3.5535 5.8696 5.8696 6.0879 6.0879 6.2567 6.2567 6.3073 6.3073 6.3782 6.3782 7.2401 7.2401 7.3282 7.3282 7.5769 7.5769 7.8082 7.8082 7.8240 7.8240 7.8566 7.8566 10.6834 10.6834 10.7276 10.7276 10.8849 10.8849 11.3077 11.3077 11.3601 11.3601 12.3344 12.3344 k = 0.4231 0.5000 0.4231 ( 6776 PWs) bands (ev): -3.8994 -3.8994 -3.8824 -3.8824 -3.8457 -3.8457 -3.5317 -3.5317 -0.1826 -0.1826 -0.1796 -0.1796 -0.0160 -0.0160 -0.0110 -0.0110 0.0211 0.0211 0.0423 0.0423 0.0618 0.0618 0.0877 0.0877 0.0964 0.0964 0.1082 0.1082 0.1509 0.1509 0.1625 0.1625 0.2244 0.2244 0.2373 0.2373 0.3057 0.3057 0.3347 0.3347 0.3521 0.3521 0.3598 0.3598 0.3968 0.3968 0.4285 0.4285 0.4361 0.4361 0.4454 0.4454 0.4540 0.4540 0.4680 0.4680 0.5052 0.5052 0.5188 0.5188 0.5796 0.5796 0.6189 0.6189 0.7058 0.7058 0.7928 0.7928 0.8794 0.8794 1.0066 1.0066 1.2367 1.2367 3.5805 3.5805 5.7180 5.7180 5.9993 5.9993 6.2102 6.2102 6.2680 6.2680 6.3609 6.3609 7.2080 7.2080 7.3079 7.3079 7.5593 7.5593 7.8924 7.8924 7.9156 7.9156 7.9781 7.9781 10.6674 10.6674 10.7089 10.7089 10.9447 10.9447 11.3164 11.3164 11.3726 11.3726 12.3666 12.3666 k = 0.4103 0.5000 0.4103 ( 6764 PWs) bands (ev): -3.9093 -3.9093 -3.8874 -3.8874 -3.8366 -3.8366 -3.5350 -3.5350 -0.1840 -0.1840 -0.1798 -0.1798 -0.0180 -0.0180 -0.0114 -0.0114 0.0094 0.0094 0.0316 0.0316 0.0547 0.0547 0.0818 0.0818 0.0865 0.0865 0.1114 0.1114 0.1485 0.1485 0.1609 0.1609 0.2281 0.2281 0.2390 0.2390 0.3022 0.3022 0.3311 0.3311 0.3547 0.3547 0.3624 0.3624 0.3962 0.3962 0.4328 0.4328 0.4355 0.4355 0.4472 0.4472 0.4561 0.4561 0.4771 0.4771 0.5062 0.5062 0.5240 0.5240 0.5761 0.5761 0.6044 0.6044 0.7041 0.7041 0.7925 0.7925 0.8945 0.8945 1.0525 1.0525 1.3136 1.3136 3.6123 3.6123 5.5625 5.5625 5.9042 5.9042 6.1574 6.1574 6.2249 6.2249 6.3438 6.3438 7.1721 7.1721 7.2809 7.2809 7.5373 7.5373 7.9802 7.9802 7.9997 7.9997 8.1190 8.1190 10.6484 10.6484 10.6850 10.6850 11.0164 11.0164 11.3348 11.3348 11.3859 11.3859 12.3992 12.3992 k = 0.3974 0.5000 0.3974 ( 6756 PWs) bands (ev): -3.9204 -3.9204 -3.8936 -3.8936 -3.8263 -3.8263 -3.5380 -3.5380 -0.1857 -0.1857 -0.1803 -0.1803 -0.0205 -0.0205 -0.0121 -0.0121 -0.0029 -0.0029 0.0195 0.0195 0.0473 0.0473 0.0681 0.0681 0.0848 0.0848 0.1146 0.1146 0.1464 0.1464 0.1595 0.1595 0.2313 0.2313 0.2392 0.2392 0.2996 0.2996 0.3278 0.3278 0.3576 0.3576 0.3648 0.3648 0.3962 0.3962 0.4348 0.4348 0.4368 0.4368 0.4494 0.4494 0.4583 0.4583 0.4863 0.4863 0.5075 0.5075 0.5295 0.5295 0.5726 0.5726 0.5928 0.5928 0.7033 0.7033 0.7930 0.7930 0.9121 0.9121 1.1020 1.1020 1.3953 1.3953 3.6488 3.6488 5.4054 5.4054 5.8048 5.8048 6.1006 6.1006 6.1773 6.1773 6.3262 6.3262 7.1325 7.1325 7.2485 7.2485 7.5120 7.5120 8.0715 8.0715 8.0890 8.0890 8.2604 8.2604 10.6275 10.6275 10.6566 10.6566 11.0996 11.0996 11.3620 11.3620 11.4006 11.4006 12.4303 12.4303 k = 0.3846 0.5000 0.3846 ( 6762 PWs) bands (ev): -3.9327 -3.9327 -3.9013 -3.9013 -3.8148 -3.8148 -3.5404 -3.5404 -0.1879 -0.1879 -0.1810 -0.1810 -0.0244 -0.0244 -0.0167 -0.0167 -0.0119 -0.0119 0.0068 0.0068 0.0396 0.0396 0.0556 0.0556 0.0829 0.0829 0.1175 0.1175 0.1445 0.1445 0.1582 0.1582 0.2338 0.2338 0.2378 0.2378 0.2978 0.2978 0.3251 0.3251 0.3608 0.3608 0.3670 0.3670 0.3967 0.3967 0.4347 0.4347 0.4399 0.4399 0.4519 0.4519 0.4607 0.4607 0.4953 0.4953 0.5093 0.5093 0.5352 0.5352 0.5687 0.5687 0.5842 0.5842 0.7033 0.7033 0.7941 0.7941 0.9325 0.9325 1.1548 1.1548 1.4817 1.4817 3.6897 3.6897 5.2478 5.2478 5.7028 5.7028 6.0412 6.0412 6.1249 6.1249 6.3077 6.3077 7.0891 7.0891 7.2119 7.2119 7.4837 7.4837 8.1646 8.1646 8.1832 8.1832 8.3995 8.3995 10.6053 10.6053 10.6257 10.6257 11.1942 11.1942 11.3905 11.3905 11.4230 11.4230 12.4586 12.4586 k = 0.3718 0.5000 0.3718 ( 6758 PWs) bands (ev): -3.9461 -3.9461 -3.9104 -3.9104 -3.8021 -3.8021 -3.5419 -3.5419 -0.1904 -0.1904 -0.1820 -0.1820 -0.0337 -0.0337 -0.0255 -0.0255 -0.0144 -0.0144 -0.0042 -0.0042 0.0315 0.0315 0.0448 0.0448 0.0809 0.0809 0.1200 0.1200 0.1428 0.1428 0.1572 0.1572 0.2348 0.2348 0.2362 0.2362 0.2967 0.2967 0.3232 0.3232 0.3642 0.3642 0.3690 0.3690 0.3976 0.3976 0.4347 0.4347 0.4427 0.4427 0.4542 0.4542 0.4635 0.4635 0.5031 0.5031 0.5123 0.5123 0.5407 0.5407 0.5648 0.5648 0.5786 0.5786 0.7041 0.7041 0.7956 0.7956 0.9557 0.9557 1.2105 1.2105 1.5724 1.5724 3.7351 3.7351 5.0908 5.0908 5.5993 5.5993 5.9801 5.9801 6.0676 6.0676 6.2883 6.2883 7.0422 7.0422 7.1718 7.1718 7.4529 7.4529 8.2591 8.2591 8.2808 8.2808 8.5352 8.5352 10.5815 10.5815 10.5952 10.5952 11.2992 11.2992 11.4074 11.4074 11.4646 11.4646 12.4842 12.4842 k = 0.3590 0.5000 0.3590 ( 6756 PWs) bands (ev): -3.9604 -3.9604 -3.9211 -3.9211 -3.7882 -3.7882 -3.5425 -3.5425 -0.1936 -0.1936 -0.1834 -0.1834 -0.0479 -0.0479 -0.0336 -0.0336 -0.0188 -0.0188 -0.0101 -0.0101 0.0229 0.0229 0.0357 0.0357 0.0786 0.0786 0.1220 0.1220 0.1413 0.1413 0.1563 0.1563 0.2316 0.2316 0.2372 0.2372 0.2963 0.2963 0.3222 0.3222 0.3678 0.3678 0.3709 0.3709 0.3989 0.3989 0.4350 0.4350 0.4453 0.4453 0.4562 0.4562 0.4668 0.4668 0.5080 0.5080 0.5180 0.5180 0.5456 0.5456 0.5614 0.5614 0.5756 0.5756 0.7055 0.7055 0.7975 0.7975 0.9818 0.9818 1.2691 1.2691 1.6672 1.6672 3.7846 3.7846 4.9350 4.9350 5.4952 5.4952 5.9182 5.9182 6.0055 6.0055 6.2679 6.2679 6.9918 6.9918 7.1290 7.1290 7.4199 7.4199 8.3546 8.3546 8.3801 8.3801 8.6668 8.6668 10.5542 10.5542 10.5695 10.5695 11.4000 11.4000 11.4307 11.4307 11.5198 11.5198 12.5079 12.5079 k = 0.3462 0.5000 0.3462 ( 6742 PWs) bands (ev): -3.9755 -3.9755 -3.9333 -3.9333 -3.7733 -3.7733 -3.5418 -3.5418 -0.1974 -0.1974 -0.1853 -0.1853 -0.0629 -0.0629 -0.0446 -0.0446 -0.0233 -0.0233 -0.0124 -0.0124 0.0139 0.0139 0.0282 0.0282 0.0762 0.0762 0.1233 0.1233 0.1401 0.1401 0.1555 0.1555 0.2277 0.2277 0.2377 0.2377 0.2962 0.2962 0.3223 0.3223 0.3714 0.3714 0.3727 0.3727 0.4003 0.4003 0.4354 0.4354 0.4479 0.4479 0.4577 0.4577 0.4704 0.4704 0.5108 0.5108 0.5254 0.5254 0.5491 0.5491 0.5596 0.5596 0.5746 0.5746 0.7076 0.7076 0.7998 0.7998 1.0107 1.0107 1.3302 1.3302 1.7659 1.7659 3.8381 3.8381 4.7808 4.7808 5.3914 5.3914 5.8558 5.8558 5.9387 5.9387 6.2466 6.2466 6.9384 6.9384 7.0843 7.0843 7.3851 7.3851 8.4509 8.4509 8.4798 8.4798 8.7941 8.7941 10.5255 10.5255 10.5488 10.5488 11.4129 11.4129 11.5467 11.5467 11.5832 11.5832 12.4595 12.4595 k = 0.3333 0.5000 0.3333 ( 6738 PWs) bands (ev): -3.9913 -3.9913 -3.9471 -3.9471 -3.7574 -3.7574 -3.5400 -3.5400 -0.2019 -0.2019 -0.1879 -0.1879 -0.0780 -0.0780 -0.0567 -0.0567 -0.0269 -0.0269 -0.0142 -0.0142 0.0050 0.0050 0.0221 0.0221 0.0736 0.0736 0.1238 0.1238 0.1395 0.1395 0.1548 0.1548 0.2234 0.2234 0.2374 0.2374 0.2965 0.2965 0.3233 0.3233 0.3745 0.3745 0.3752 0.3752 0.4020 0.4020 0.4361 0.4361 0.4503 0.4503 0.4589 0.4589 0.4743 0.4743 0.5131 0.5131 0.5326 0.5326 0.5509 0.5509 0.5599 0.5599 0.5755 0.5755 0.7102 0.7102 0.8024 0.8024 1.0425 1.0425 1.3937 1.3937 1.8682 1.8682 3.8954 3.8954 4.6287 4.6287 5.2883 5.2883 5.7932 5.7932 5.8676 5.8676 6.2245 6.2245 6.8824 6.8824 7.0380 7.0380 7.3487 7.3487 8.5469 8.5469 8.5791 8.5791 8.9169 8.9169 10.4990 10.4990 10.5314 10.5314 11.4110 11.4110 11.6528 11.6528 11.6818 11.6818 12.3948 12.3948 k = 0.3205 0.5000 0.3205 ( 6754 PWs) bands (ev): -4.0077 -4.0077 -3.9623 -3.9623 -3.7405 -3.7405 -3.5369 -3.5369 -0.2072 -0.2072 -0.1916 -0.1916 -0.0925 -0.0925 -0.0686 -0.0686 -0.0302 -0.0302 -0.0164 -0.0164 -0.0032 -0.0032 0.0173 0.0173 0.0709 0.0709 0.1233 0.1233 0.1393 0.1393 0.1540 0.1540 0.2192 0.2192 0.2364 0.2364 0.2972 0.2972 0.3251 0.3251 0.3763 0.3763 0.3788 0.3788 0.4037 0.4037 0.4369 0.4369 0.4525 0.4525 0.4598 0.4598 0.4782 0.4782 0.5154 0.5154 0.5380 0.5380 0.5530 0.5530 0.5609 0.5609 0.5782 0.5782 0.7132 0.7132 0.8053 0.8053 1.0771 1.0771 1.4596 1.4596 1.9738 1.9738 3.9560 3.9560 4.4791 4.4791 5.1865 5.1865 5.7307 5.7307 5.7923 5.7923 6.2018 6.2018 6.8241 6.8241 6.9907 6.9907 7.3110 7.3110 8.6420 8.6420 8.6774 8.6774 9.0353 9.0353 10.4762 10.4762 10.5172 10.5172 11.4034 11.4034 11.7274 11.7274 11.8255 11.8255 12.3342 12.3342 k = 0.3077 0.5000 0.3077 ( 6746 PWs) bands (ev): -4.0245 -4.0245 -3.9787 -3.9787 -3.7228 -3.7228 -3.5325 -3.5325 -0.2134 -0.2134 -0.1962 -0.1962 -0.1061 -0.1061 -0.0798 -0.0798 -0.0337 -0.0337 -0.0196 -0.0196 -0.0101 -0.0101 0.0135 0.0135 0.0681 0.0681 0.1221 0.1221 0.1396 0.1396 0.1533 0.1533 0.2151 0.2151 0.2348 0.2348 0.2984 0.2984 0.3275 0.3275 0.3783 0.3783 0.3825 0.3825 0.4055 0.4055 0.4378 0.4378 0.4546 0.4546 0.4606 0.4606 0.4821 0.4821 0.5180 0.5180 0.5411 0.5411 0.5569 0.5569 0.5622 0.5622 0.5821 0.5821 0.7168 0.7168 0.8084 0.8084 1.1144 1.1144 1.5276 1.5276 2.0824 2.0824 4.0195 4.0195 4.3325 4.3325 5.0867 5.0867 5.6682 5.6682 5.7135 5.7135 6.1785 6.1785 6.7641 6.7641 6.9428 6.9428 7.2724 7.2724 8.7350 8.7350 8.7741 8.7741 9.1495 9.1495 10.4582 10.4582 10.5068 10.5068 11.3898 11.3898 11.8060 11.8060 11.9756 11.9756 12.2779 12.2779 k = 0.2949 0.5000 0.2949 ( 6750 PWs) bands (ev): -4.0417 -4.0417 -3.9962 -3.9962 -3.7044 -3.7044 -3.5270 -3.5270 -0.2204 -0.2204 -0.2023 -0.2023 -0.1183 -0.1183 -0.0902 -0.0902 -0.0373 -0.0373 -0.0247 -0.0247 -0.0144 -0.0144 0.0106 0.0106 0.0652 0.0652 0.1201 0.1201 0.1401 0.1401 0.1524 0.1524 0.2113 0.2113 0.2326 0.2326 0.3000 0.3000 0.3304 0.3304 0.3803 0.3803 0.3861 0.3861 0.4073 0.4073 0.4388 0.4388 0.4564 0.4564 0.4612 0.4612 0.4861 0.4861 0.5209 0.5209 0.5426 0.5426 0.5602 0.5602 0.5657 0.5657 0.5865 0.5865 0.7209 0.7209 0.8118 0.8118 1.1544 1.1544 1.5976 1.5976 2.1938 2.1938 4.0837 4.0837 4.1908 4.1908 4.9892 4.9892 5.6052 5.6052 5.6320 5.6320 6.1550 6.1550 6.7031 6.7031 6.8945 6.8945 7.2331 7.2331 8.8248 8.8248 8.8686 8.8686 9.2599 9.2599 10.4452 10.4452 10.5006 10.5006 11.3700 11.3700 11.8876 11.8876 12.1290 12.1290 12.2272 12.2272 k = 0.2821 0.5000 0.2821 ( 6740 PWs) bands (ev): -4.0591 -4.0591 -4.0145 -4.0145 -3.6852 -3.6852 -3.5205 -3.5205 -0.2282 -0.2282 -0.2099 -0.2099 -0.1289 -0.1289 -0.0998 -0.0998 -0.0413 -0.0413 -0.0309 -0.0309 -0.0168 -0.0168 0.0086 0.0086 0.0623 0.0623 0.1176 0.1176 0.1408 0.1408 0.1515 0.1515 0.2078 0.2078 0.2300 0.2300 0.3020 0.3020 0.3336 0.3336 0.3824 0.3824 0.3897 0.3897 0.4092 0.4092 0.4398 0.4398 0.4580 0.4580 0.4618 0.4618 0.4901 0.4901 0.5240 0.5240 0.5437 0.5437 0.5615 0.5615 0.5717 0.5717 0.5911 0.5911 0.7254 0.7254 0.8155 0.8155 1.1969 1.1969 1.6695 1.6695 2.3075 2.3075 4.0427 4.0427 4.1597 4.1597 4.8947 4.8947 5.5365 5.5365 5.5534 5.5534 6.1312 6.1312 6.6418 6.6418 6.8462 6.8462 7.1935 7.1935 8.9102 8.9102 8.9603 8.9603 9.3669 9.3669 10.4377 10.4377 10.4993 10.4993 11.3432 11.3432 11.9712 11.9712 12.1751 12.1751 12.2906 12.2906 k = 0.2692 0.5000 0.2692 ( 6738 PWs) bands (ev): -4.0765 -4.0765 -4.0335 -4.0335 -3.6656 -3.6656 -3.5130 -3.5130 -0.2367 -0.2367 -0.2189 -0.2189 -0.1378 -0.1378 -0.1085 -0.1085 -0.0455 -0.0455 -0.0372 -0.0372 -0.0183 -0.0183 0.0071 0.0071 0.0594 0.0594 0.1148 0.1148 0.1414 0.1414 0.1504 0.1504 0.2046 0.2046 0.2271 0.2271 0.3044 0.3044 0.3369 0.3369 0.3846 0.3846 0.3931 0.3931 0.4112 0.4112 0.4409 0.4409 0.4591 0.4591 0.4625 0.4625 0.4941 0.4941 0.5275 0.5275 0.5449 0.5449 0.5625 0.5625 0.5782 0.5782 0.5956 0.5956 0.7304 0.7304 0.8193 0.8193 1.2418 1.2418 1.7433 1.7433 2.4230 2.4230 3.9073 3.9073 4.2278 4.2278 4.8038 4.8038 5.4524 5.4524 5.4880 5.4880 6.1073 6.1073 6.5812 6.5812 6.7979 6.7979 7.1539 7.1539 8.9896 8.9896 9.0486 9.0486 9.4709 9.4709 10.4357 10.4357 10.5035 10.5035 11.3086 11.3086 12.0527 12.0527 12.1363 12.1363 12.4453 12.4453 k = 0.2564 0.5000 0.2564 ( 6738 PWs) bands (ev): -4.0940 -4.0940 -4.0529 -4.0529 -3.6455 -3.6455 -3.5048 -3.5048 -0.2459 -0.2459 -0.2291 -0.2291 -0.1451 -0.1451 -0.1166 -0.1166 -0.0498 -0.0498 -0.0431 -0.0431 -0.0191 -0.0191 0.0062 0.0062 0.0565 0.0565 0.1116 0.1116 0.1419 0.1419 0.1491 0.1491 0.2019 0.2019 0.2240 0.2240 0.3072 0.3072 0.3404 0.3404 0.3868 0.3868 0.3963 0.3963 0.4132 0.4132 0.4419 0.4419 0.4600 0.4600 0.4632 0.4632 0.4981 0.4981 0.5311 0.5311 0.5462 0.5462 0.5635 0.5635 0.5846 0.5846 0.6000 0.6000 0.7359 0.7359 0.8234 0.8234 1.2889 1.2889 1.8187 1.8187 2.5398 2.5398 3.7737 3.7737 4.2981 4.2981 4.7173 4.7173 5.3622 5.3622 5.4269 5.4269 6.0835 6.0835 6.5220 6.5220 6.7500 6.7500 7.1145 7.1145 9.0618 9.0618 9.1328 9.1328 9.5723 9.5723 10.4392 10.4392 10.5136 10.5136 11.2648 11.2648 12.0787 12.0787 12.1568 12.1568 12.5829 12.5829 k = 0.2436 0.5000 0.2436 ( 6734 PWs) bands (ev): -4.1113 -4.1113 -4.0725 -4.0725 -3.6251 -3.6251 -3.4959 -3.4959 -0.2555 -0.2555 -0.2402 -0.2402 -0.1513 -0.1513 -0.1240 -0.1240 -0.0541 -0.0541 -0.0485 -0.0485 -0.0194 -0.0194 0.0056 0.0056 0.0537 0.0537 0.1083 0.1083 0.1423 0.1423 0.1477 0.1477 0.1995 0.1995 0.2208 0.2208 0.3103 0.3103 0.3440 0.3440 0.3892 0.3892 0.3994 0.3994 0.4152 0.4152 0.4430 0.4430 0.4606 0.4606 0.4640 0.4640 0.5021 0.5021 0.5349 0.5349 0.5478 0.5478 0.5647 0.5647 0.5908 0.5908 0.6041 0.6041 0.7419 0.7419 0.8276 0.8276 1.3382 1.3382 1.8958 1.8958 2.6571 2.6571 3.6437 3.6437 4.3675 4.3675 4.6363 4.6363 5.2694 5.2694 5.3673 5.3673 6.0599 6.0599 6.4654 6.4654 6.7024 6.7024 7.0755 7.0755 9.1253 9.1253 9.2119 9.2119 9.6715 9.6715 10.4483 10.4483 10.5295 10.5295 11.2106 11.2106 12.0465 12.0465 12.2379 12.2379 12.4735 12.4735 k = 0.2308 0.5000 0.2308 ( 6738 PWs) bands (ev): -4.1283 -4.1283 -4.0922 -4.0922 -3.6045 -3.6045 -3.4864 -3.4864 -0.2654 -0.2654 -0.2517 -0.2517 -0.1566 -0.1566 -0.1309 -0.1309 -0.0582 -0.0582 -0.0535 -0.0535 -0.0194 -0.0194 0.0053 0.0053 0.0510 0.0510 0.1047 0.1047 0.1425 0.1425 0.1461 0.1461 0.1975 0.1975 0.2177 0.2177 0.3136 0.3136 0.3474 0.3474 0.3917 0.3917 0.4024 0.4024 0.4172 0.4172 0.4440 0.4440 0.4611 0.4611 0.4648 0.4648 0.5061 0.5061 0.5387 0.5387 0.5496 0.5496 0.5661 0.5661 0.5966 0.5966 0.6080 0.6080 0.7483 0.7483 0.8319 0.8319 1.3895 1.3895 1.9743 1.9743 2.7740 2.7740 3.5176 3.5176 4.4324 4.4324 4.5638 4.5638 5.1749 5.1749 5.3092 5.3092 6.0366 6.0366 6.4125 6.4125 6.6551 6.6551 7.0374 7.0374 9.1790 9.1790 9.2848 9.2848 9.7689 9.7689 10.4627 10.4627 10.5509 10.5509 11.1445 11.1445 12.0134 12.0134 12.3034 12.3034 12.3694 12.3694 k = 0.2179 0.5000 0.2179 ( 6744 PWs) bands (ev): -4.1450 -4.1450 -4.1117 -4.1117 -3.5838 -3.5838 -3.4766 -3.4766 -0.2755 -0.2755 -0.2634 -0.2634 -0.1613 -0.1613 -0.1374 -0.1374 -0.0619 -0.0619 -0.0580 -0.0580 -0.0190 -0.0190 0.0053 0.0053 0.0484 0.0484 0.1011 0.1011 0.1424 0.1424 0.1444 0.1444 0.1958 0.1958 0.2145 0.2145 0.3172 0.3172 0.3508 0.3508 0.3942 0.3942 0.4052 0.4052 0.4192 0.4192 0.4449 0.4449 0.4615 0.4615 0.4656 0.4656 0.5100 0.5100 0.5424 0.5424 0.5519 0.5519 0.5677 0.5677 0.6020 0.6020 0.6118 0.6118 0.7552 0.7552 0.8364 0.8364 1.4426 1.4426 2.0544 2.0544 2.8892 2.8892 3.3958 3.3958 4.4641 4.4641 4.5275 4.5275 5.0793 5.0793 5.2537 5.2537 6.0138 6.0138 6.3645 6.3645 6.6083 6.6083 7.0002 7.0002 9.2218 9.2218 9.3503 9.3503 9.8649 9.8649 10.4824 10.4824 10.5767 10.5767 11.0662 11.0662 11.9829 11.9829 12.2260 12.2260 12.4230 12.4230 k = 0.2051 0.5000 0.2051 ( 6748 PWs) bands (ev): -4.1613 -4.1613 -4.1309 -4.1309 -3.5632 -3.5632 -3.4665 -3.4665 -0.2856 -0.2856 -0.2749 -0.2749 -0.1656 -0.1656 -0.1435 -0.1435 -0.0654 -0.0654 -0.0622 -0.0622 -0.0183 -0.0183 0.0054 0.0054 0.0459 0.0459 0.0973 0.0973 0.1422 0.1422 0.1426 0.1426 0.1944 0.1944 0.2115 0.2115 0.3209 0.3209 0.3540 0.3540 0.3967 0.3967 0.4079 0.4079 0.4212 0.4212 0.4457 0.4457 0.4618 0.4618 0.4664 0.4664 0.5138 0.5138 0.5457 0.5457 0.5545 0.5545 0.5694 0.5694 0.6070 0.6070 0.6153 0.6153 0.7625 0.7625 0.8409 0.8409 1.4974 1.4974 2.1357 2.1357 3.0010 3.0010 3.2783 3.2783 4.4198 4.4198 4.5686 4.5686 4.9830 4.9830 5.2024 5.2024 5.9916 5.9916 6.3228 6.3228 6.5618 6.5618 6.9642 6.9642 9.2532 9.2532 9.4067 9.4067 9.9596 9.9596 10.5070 10.5070 10.6048 10.6048 10.9767 10.9767 11.9557 11.9557 12.1372 12.1372 12.5065 12.5065 k = 0.1923 0.5000 0.1923 ( 6748 PWs) bands (ev): -4.1770 -4.1770 -4.1496 -4.1496 -3.5428 -3.5428 -3.4563 -3.4563 -0.2955 -0.2955 -0.2862 -0.2862 -0.1696 -0.1696 -0.1494 -0.1494 -0.0684 -0.0684 -0.0660 -0.0660 -0.0173 -0.0173 0.0056 0.0056 0.0436 0.0436 0.0936 0.0936 0.1406 0.1406 0.1419 0.1419 0.1933 0.1933 0.2087 0.2087 0.3248 0.3248 0.3571 0.3571 0.3993 0.3993 0.4104 0.4104 0.4232 0.4232 0.4465 0.4465 0.4622 0.4622 0.4672 0.4672 0.5176 0.5176 0.5486 0.5486 0.5576 0.5576 0.5712 0.5712 0.6117 0.6117 0.6186 0.6186 0.7703 0.7703 0.8455 0.8455 1.5536 1.5536 2.2183 2.2183 3.1069 3.1069 3.1656 3.1656 4.3728 4.3728 4.6114 4.6114 4.8866 4.8866 5.1585 5.1585 5.9701 5.9701 6.2888 6.2888 6.5156 6.5156 6.9296 6.9296 9.2732 9.2732 9.4516 9.4516 10.0534 10.0534 10.5365 10.5365 10.6325 10.6325 10.8797 10.8797 11.9328 11.9328 12.0679 12.0679 12.5892 12.5892 k = 0.1795 0.5000 0.1795 ( 6752 PWs) bands (ev): -4.1921 -4.1921 -4.1677 -4.1677 -3.5228 -3.5228 -3.4460 -3.4460 -0.3051 -0.3051 -0.2971 -0.2971 -0.1733 -0.1733 -0.1549 -0.1549 -0.0711 -0.0711 -0.0693 -0.0693 -0.0162 -0.0162 0.0060 0.0060 0.0415 0.0415 0.0898 0.0898 0.1387 0.1387 0.1412 0.1412 0.1925 0.1925 0.2060 0.2060 0.3287 0.3287 0.3598 0.3598 0.4020 0.4020 0.4129 0.4129 0.4252 0.4252 0.4471 0.4471 0.4627 0.4627 0.4679 0.4679 0.5213 0.5213 0.5511 0.5511 0.5611 0.5611 0.5732 0.5732 0.6160 0.6160 0.6217 0.6217 0.7785 0.7785 0.8501 0.8501 1.6110 1.6110 2.3021 2.3021 3.0575 3.0575 3.2043 3.2043 4.3380 4.3380 4.6377 4.6377 4.7912 4.7912 5.1264 5.1264 5.9494 5.9494 6.2639 6.2639 6.4695 6.4695 6.8965 6.8965 9.2819 9.2819 9.4826 9.4826 10.1464 10.1464 10.5704 10.5704 10.6561 10.6561 10.7804 10.7804 11.9154 11.9154 12.0183 12.0183 12.6675 12.6675 k = 0.1667 0.5000 0.1667 ( 6736 PWs) bands (ev): -4.2065 -4.2065 -4.1851 -4.1851 -3.5033 -3.5033 -3.4359 -3.4359 -0.3144 -0.3144 -0.3074 -0.3074 -0.1769 -0.1769 -0.1601 -0.1601 -0.0734 -0.0734 -0.0723 -0.0723 -0.0150 -0.0150 0.0066 0.0066 0.0396 0.0396 0.0860 0.0860 0.1367 0.1367 0.1405 0.1405 0.1918 0.1918 0.2036 0.2036 0.3326 0.3326 0.3624 0.3624 0.4047 0.4047 0.4152 0.4152 0.4271 0.4271 0.4476 0.4476 0.4632 0.4632 0.4686 0.4686 0.5250 0.5250 0.5533 0.5533 0.5647 0.5647 0.5752 0.5752 0.6199 0.6199 0.6247 0.6247 0.7870 0.7870 0.8548 0.8548 1.6694 1.6694 2.3869 2.3869 2.9547 2.9547 3.2888 3.2888 4.3202 4.3202 4.6382 4.6382 4.6996 4.6996 5.1102 5.1102 5.9298 5.9298 6.2494 6.2494 6.4233 6.4233 6.8651 6.8651 9.2796 9.2796 9.4963 9.4963 10.2386 10.2386 10.6085 10.6085 10.6690 10.6690 10.6887 10.6887 11.9056 11.9056 11.9865 11.9865 12.6446 12.6446 k = 0.1538 0.5000 0.1538 ( 6744 PWs) bands (ev): -4.2202 -4.2202 -4.2016 -4.2016 -3.4844 -3.4844 -3.4261 -3.4261 -0.3234 -0.3234 -0.3172 -0.3172 -0.1802 -0.1802 -0.1650 -0.1650 -0.0755 -0.0755 -0.0750 -0.0750 -0.0136 -0.0136 0.0071 0.0071 0.0380 0.0380 0.0823 0.0823 0.1348 0.1348 0.1395 0.1395 0.1913 0.1913 0.2013 0.2013 0.3365 0.3365 0.3646 0.3646 0.4074 0.4074 0.4174 0.4174 0.4289 0.4289 0.4479 0.4479 0.4638 0.4638 0.4692 0.4692 0.5286 0.5286 0.5552 0.5552 0.5684 0.5684 0.5773 0.5773 0.6234 0.6234 0.6274 0.6274 0.7958 0.7958 0.8593 0.8593 1.7284 1.7284 2.4726 2.4726 2.8574 2.8574 3.3566 3.3566 4.3233 4.3233 4.5889 4.5889 4.6347 4.6347 5.1101 5.1101 5.9112 5.9112 6.2463 6.2463 6.3768 6.3768 6.8356 6.8356 9.2670 9.2670 9.4900 9.4900 10.3302 10.3302 10.5994 10.5994 10.6500 10.6500 10.6799 10.6799 11.9053 11.9053 11.9701 11.9701 12.5926 12.5926 k = 0.1410 0.5000 0.1410 ( 6730 PWs) bands (ev): -4.2330 -4.2330 -4.2171 -4.2171 -3.4663 -3.4663 -3.4165 -3.4165 -0.3317 -0.3317 -0.3263 -0.3263 -0.1834 -0.1834 -0.1696 -0.1696 -0.0774 -0.0774 -0.0773 -0.0773 -0.0122 -0.0122 0.0078 0.0078 0.0368 0.0368 0.0786 0.0786 0.1329 0.1329 0.1385 0.1385 0.1909 0.1909 0.1993 0.1993 0.3404 0.3404 0.3666 0.3666 0.4101 0.4101 0.4195 0.4195 0.4307 0.4307 0.4482 0.4482 0.4644 0.4644 0.4697 0.4697 0.5322 0.5322 0.5569 0.5569 0.5720 0.5720 0.5793 0.5793 0.6267 0.6267 0.6300 0.6300 0.8048 0.8048 0.8637 0.8637 1.7876 1.7876 2.5590 2.5590 2.7659 2.7659 3.4049 3.4049 4.3491 4.3491 4.5026 4.5026 4.5886 4.5886 5.1215 5.1215 5.8940 5.8940 6.2552 6.2552 6.3298 6.3298 6.8081 6.8081 9.2448 9.2448 9.4618 9.4618 10.4208 10.4208 10.5311 10.5311 10.6711 10.6711 10.6978 10.6978 11.9153 11.9153 11.9671 11.9671 12.5615 12.5615 k = 0.1282 0.5000 0.1282 ( 6742 PWs) bands (ev): -4.2448 -4.2448 -4.2316 -4.2316 -3.4492 -3.4492 -3.4074 -3.4074 -0.3396 -0.3396 -0.3349 -0.3349 -0.1864 -0.1864 -0.1740 -0.1740 -0.0794 -0.0794 -0.0789 -0.0789 -0.0109 -0.0109 0.0083 0.0083 0.0358 0.0358 0.0751 0.0751 0.1312 0.1312 0.1373 0.1373 0.1906 0.1906 0.1975 0.1975 0.3441 0.3441 0.3682 0.3682 0.4127 0.4127 0.4214 0.4214 0.4323 0.4323 0.4482 0.4482 0.4651 0.4651 0.4702 0.4702 0.5356 0.5356 0.5585 0.5585 0.5754 0.5754 0.5814 0.5814 0.6296 0.6296 0.6323 0.6323 0.8140 0.8140 0.8680 0.8680 1.8466 1.8466 2.6447 2.6447 2.6817 2.6817 3.4336 3.4336 4.3875 4.3875 4.4232 4.4232 4.5340 4.5340 5.1377 5.1377 5.8780 5.8780 6.2759 6.2759 6.2820 6.2820 6.7826 6.7826 9.2138 9.2138 9.4127 9.4127 10.4801 10.4801 10.5104 10.5104 10.6545 10.6545 10.7457 10.7457 11.9347 11.9347 11.9754 11.9754 12.5512 12.5512 k = 0.1154 0.5000 0.1154 ( 6746 PWs) bands (ev): -4.2558 -4.2558 -4.2449 -4.2449 -3.4332 -3.4332 -3.3989 -3.3989 -0.3468 -0.3468 -0.3427 -0.3427 -0.1891 -0.1891 -0.1781 -0.1781 -0.0812 -0.0812 -0.0803 -0.0803 -0.0095 -0.0095 0.0087 0.0087 0.0353 0.0353 0.0716 0.0716 0.1296 0.1296 0.1359 0.1359 0.1903 0.1903 0.1959 0.1959 0.3477 0.3477 0.3696 0.3696 0.4153 0.4153 0.4233 0.4233 0.4339 0.4339 0.4481 0.4481 0.4658 0.4658 0.4705 0.4705 0.5390 0.5390 0.5598 0.5598 0.5786 0.5786 0.5833 0.5833 0.6323 0.6323 0.6345 0.6345 0.8233 0.8233 0.8720 0.8720 1.9047 1.9047 2.6001 2.6001 2.7346 2.7346 3.4457 3.4457 4.3234 4.3234 4.4388 4.4388 4.5001 4.5001 5.1542 5.1542 5.8634 5.8634 6.2326 6.2326 6.3081 6.3081 6.7593 6.7593 9.1750 9.1750 9.3463 9.3463 10.4463 10.4463 10.5939 10.5939 10.6328 10.6328 10.7970 10.7970 11.9608 11.9608 11.9934 11.9934 12.5610 12.5610 k = 0.1026 0.5000 0.1026 ( 6742 PWs) bands (ev): -4.2657 -4.2657 -4.2570 -4.2570 -3.4185 -3.4185 -3.3910 -3.3910 -0.3533 -0.3533 -0.3497 -0.3497 -0.1915 -0.1915 -0.1818 -0.1818 -0.0827 -0.0827 -0.0815 -0.0815 -0.0081 -0.0081 0.0089 0.0089 0.0353 0.0353 0.0683 0.0683 0.1281 0.1281 0.1346 0.1346 0.1901 0.1901 0.1946 0.1946 0.3511 0.3511 0.3706 0.3706 0.4179 0.4179 0.4251 0.4251 0.4353 0.4353 0.4478 0.4478 0.4665 0.4665 0.4708 0.4708 0.5423 0.5423 0.5610 0.5610 0.5815 0.5815 0.5852 0.5852 0.6347 0.6347 0.6365 0.6365 0.8325 0.8325 0.8757 0.8757 1.9614 1.9614 2.5278 2.5278 2.8221 2.8221 3.4454 3.4454 4.2418 4.2418 4.3818 4.3818 4.5689 4.5689 5.1682 5.1682 5.8502 5.8502 6.1818 6.1818 6.3493 6.3493 6.7382 6.7382 9.1298 9.1298 9.2684 9.2684 10.4259 10.4259 10.5910 10.5910 10.6901 10.6901 10.8503 10.8503 11.9901 11.9901 12.0190 12.0190 12.5895 12.5895 k = 0.0897 0.5000 0.0897 ( 6750 PWs) bands (ev): -4.2745 -4.2745 -4.2678 -4.2678 -3.4051 -3.4051 -3.3838 -3.3838 -0.3592 -0.3592 -0.3561 -0.3561 -0.1937 -0.1937 -0.1852 -0.1852 -0.0839 -0.0839 -0.0826 -0.0826 -0.0068 -0.0068 0.0088 0.0088 0.0357 0.0357 0.0651 0.0651 0.1269 0.1269 0.1332 0.1332 0.1900 0.1900 0.1934 0.1934 0.3542 0.3542 0.3714 0.3714 0.4203 0.4203 0.4266 0.4266 0.4366 0.4366 0.4474 0.4474 0.4672 0.4672 0.4709 0.4709 0.5454 0.5454 0.5619 0.5619 0.5842 0.5842 0.5869 0.5869 0.6368 0.6368 0.6383 0.6383 0.8414 0.8414 0.8790 0.8790 2.0158 2.0158 2.4624 2.4624 2.9095 2.9095 3.4374 3.4374 4.1645 4.1645 4.3066 4.3066 4.6623 4.6623 5.1789 5.1789 5.8385 5.8385 6.1292 6.1292 6.3974 6.3974 6.7195 6.7195 9.0799 9.0799 9.1852 9.1852 10.4151 10.4151 10.5572 10.5572 10.7737 10.7737 10.9049 10.9049 12.0199 12.0199 12.0497 12.0497 12.5260 12.5260 k = 0.0769 0.5000 0.0769 ( 6748 PWs) bands (ev): -4.2822 -4.2822 -4.2773 -4.2773 -3.3932 -3.3932 -3.3774 -3.3774 -0.3643 -0.3643 -0.3616 -0.3616 -0.1955 -0.1955 -0.1883 -0.1883 -0.0849 -0.0849 -0.0835 -0.0835 -0.0054 -0.0054 0.0085 0.0085 0.0365 0.0365 0.0621 0.0621 0.1259 0.1259 0.1318 0.1318 0.1899 0.1899 0.1924 0.1924 0.3572 0.3572 0.3719 0.3719 0.4227 0.4227 0.4281 0.4281 0.4377 0.4377 0.4468 0.4468 0.4679 0.4679 0.4710 0.4710 0.5484 0.5484 0.5626 0.5626 0.5865 0.5865 0.5885 0.5885 0.6386 0.6386 0.6399 0.6399 0.8500 0.8500 0.8819 0.8819 2.0670 2.0670 2.4044 2.4044 2.9962 2.9962 3.4253 3.4253 4.0931 4.0931 4.2278 4.2278 4.7623 4.7623 5.1865 5.1865 5.8282 5.8282 6.0748 6.0748 6.4493 6.4493 6.7032 6.7032 9.0275 9.0275 9.1025 9.1025 10.4106 10.4106 10.5233 10.5233 10.8548 10.8548 10.9595 10.9595 12.0476 12.0476 12.0838 12.0838 12.4368 12.4368 k = 0.0641 0.5000 0.0641 ( 6752 PWs) bands (ev): -4.2888 -4.2888 -4.2854 -4.2854 -3.3830 -3.3830 -3.3719 -3.3719 -0.3686 -0.3686 -0.3664 -0.3664 -0.1970 -0.1970 -0.1910 -0.1910 -0.0856 -0.0856 -0.0843 -0.0843 -0.0041 -0.0041 0.0080 0.0080 0.0376 0.0376 0.0592 0.0592 0.1251 0.1251 0.1304 0.1304 0.1899 0.1899 0.1916 0.1916 0.3599 0.3599 0.3721 0.3721 0.4249 0.4249 0.4293 0.4293 0.4388 0.4388 0.4461 0.4461 0.4685 0.4685 0.4710 0.4710 0.5511 0.5511 0.5630 0.5630 0.5885 0.5885 0.5899 0.5899 0.6402 0.6402 0.6412 0.6412 0.8581 0.8581 0.8843 0.8843 2.1137 2.1137 2.3544 2.3544 3.0813 3.0813 3.4118 3.4118 4.0290 4.0290 4.1481 4.1481 4.8633 4.8633 5.1914 5.1914 5.8195 5.8195 6.0189 6.0189 6.5017 6.5017 6.6893 6.6893 8.9752 8.9752 9.0251 9.0251 10.4097 10.4097 10.4921 10.4921 10.9313 10.9313 11.0129 11.0129 12.0713 12.0713 12.1199 12.1199 12.3537 12.3537 k = 0.0513 0.5000 0.0513 ( 6744 PWs) bands (ev): -4.2943 -4.2943 -4.2921 -4.2921 -3.3745 -3.3745 -3.3673 -3.3673 -0.3721 -0.3721 -0.3703 -0.3703 -0.1982 -0.1982 -0.1933 -0.1933 -0.0862 -0.0862 -0.0850 -0.0850 -0.0027 -0.0027 0.0072 0.0072 0.0391 0.0391 0.0565 0.0565 0.1246 0.1246 0.1291 0.1291 0.1898 0.1898 0.1909 0.1909 0.3623 0.3623 0.3720 0.3720 0.4269 0.4269 0.4304 0.4304 0.4396 0.4396 0.4453 0.4453 0.4691 0.4691 0.4710 0.4710 0.5537 0.5537 0.5632 0.5632 0.5902 0.5902 0.5910 0.5910 0.6415 0.6415 0.6423 0.6423 0.8654 0.8654 0.8860 0.8860 2.1547 2.1547 2.3128 2.3128 3.1632 3.1632 3.3988 3.3988 3.9736 3.9736 4.0698 4.0698 4.9608 4.9608 5.1943 5.1943 5.8124 5.8124 5.9625 5.9625 6.5512 6.5512 6.6778 6.6778 8.9260 8.9260 8.9567 8.9567 10.4106 10.4106 10.4653 10.4653 11.0013 11.0013 11.0628 11.0628 12.0901 12.0901 12.1560 12.1560 12.2794 12.2794 k = 0.0385 0.5000 0.0385 ( 6756 PWs) bands (ev): -4.2986 -4.2986 -4.2973 -4.2973 -3.3677 -3.3677 -3.3637 -3.3637 -0.3748 -0.3748 -0.3735 -0.3735 -0.1990 -0.1990 -0.1953 -0.1953 -0.0866 -0.0866 -0.0856 -0.0856 -0.0014 -0.0014 0.0062 0.0062 0.0408 0.0408 0.0539 0.0539 0.1244 0.1244 0.1278 0.1278 0.1898 0.1898 0.1904 0.1904 0.3644 0.3644 0.3717 0.3717 0.4287 0.4287 0.4312 0.4312 0.4404 0.4404 0.4445 0.4445 0.4695 0.4695 0.4709 0.4709 0.5560 0.5560 0.5631 0.5631 0.5914 0.5914 0.5919 0.5919 0.6426 0.6426 0.6432 0.6432 0.8718 0.8718 0.8870 0.8870 2.1886 2.1886 2.2799 2.2799 3.2395 3.2395 3.3876 3.3876 3.9284 3.9284 3.9960 3.9960 5.0501 5.0501 5.1958 5.1958 5.8069 5.8069 5.9079 5.9079 6.5944 6.5944 6.6689 6.6689 8.8832 8.8832 8.9005 8.9005 10.4122 10.4122 10.4438 10.4438 11.0623 11.0623 11.1064 11.1064 12.1044 12.1044 12.1890 12.1890 12.2169 12.2169 k = 0.0256 0.5000 0.0256 ( 6760 PWs) bands (ev): -4.3016 -4.3016 -4.3011 -4.3011 -3.3629 -3.3629 -3.3611 -3.3611 -0.3767 -0.3767 -0.3759 -0.3759 -0.1993 -0.1993 -0.1969 -0.1969 -0.0868 -0.0868 -0.0861 -0.0861 -0.0000 -0.0000 0.0051 0.0051 0.0427 0.0427 0.0514 0.0514 0.1244 0.1244 0.1268 0.1268 0.1898 0.1898 0.1901 0.1901 0.3663 0.3663 0.3712 0.3712 0.4301 0.4301 0.4318 0.4318 0.4410 0.4410 0.4436 0.4436 0.4699 0.4699 0.4708 0.4708 0.5579 0.5579 0.5627 0.5627 0.5924 0.5924 0.5926 0.5926 0.6434 0.6434 0.6438 0.6438 0.8772 0.8772 0.8871 0.8871 2.2141 2.2141 2.2561 2.2561 3.3054 3.3054 3.3790 3.3790 3.8948 3.8948 3.9316 3.9316 5.1246 5.1246 5.1966 5.1966 5.8031 5.8031 5.8592 5.8592 6.6279 6.6279 6.6625 6.6625 8.8499 8.8499 8.8587 8.8587 10.4138 10.4138 10.4282 10.4282 11.1114 11.1114 11.1400 11.1400 12.1144 12.1144 12.1683 12.1683 12.2168 12.2168 k = 0.0128 0.5000 0.0128 ( 6776 PWs) bands (ev): -4.3035 -4.3035 -4.3033 -4.3033 -3.3599 -3.3599 -3.3595 -3.3595 -0.3778 -0.3778 -0.3774 -0.3774 -0.1993 -0.1993 -0.1981 -0.1981 -0.0868 -0.0868 -0.0865 -0.0865 0.0013 0.0013 0.0039 0.0039 0.0447 0.0447 0.0491 0.0491 0.1246 0.1246 0.1258 0.1258 0.1897 0.1897 0.1898 0.1898 0.3679 0.3679 0.3703 0.3703 0.4312 0.4312 0.4320 0.4320 0.4416 0.4416 0.4428 0.4428 0.4702 0.4702 0.4706 0.4706 0.5596 0.5596 0.5620 0.5620 0.5929 0.5929 0.5930 0.5930 0.6439 0.6439 0.6441 0.6441 0.8813 0.8813 0.8862 0.8862 2.2300 2.2300 2.2417 2.2417 3.3528 3.3528 3.3736 3.3736 3.8741 3.8741 3.8850 3.8850 5.1759 5.1759 5.1968 5.1968 5.8017 5.8017 5.8232 5.8232 6.6493 6.6493 6.6586 6.6586 8.8290 8.8290 8.8325 8.8325 10.4149 10.4149 10.4188 10.4188 11.1454 11.1454 11.1596 11.1596 12.1206 12.1206 12.1378 12.1378 12.2347 12.2347 k = 0.0000 0.5000-0.0000 ( 6816 PWs) bands (ev): -4.3041 -4.3041 -4.3041 -4.3041 -3.3590 -3.3590 -3.3590 -3.3590 -0.3780 -0.3780 -0.3780 -0.3780 -0.1990 -0.1990 -0.1990 -0.1990 -0.0867 -0.0867 -0.0867 -0.0867 0.0026 0.0026 0.0026 0.0026 0.0468 0.0468 0.0468 0.0468 0.1251 0.1251 0.1251 0.1251 0.1897 0.1897 0.1897 0.1897 0.3692 0.3692 0.3692 0.3692 0.4318 0.4318 0.4318 0.4318 0.4421 0.4421 0.4421 0.4421 0.4704 0.4704 0.4704 0.4704 0.5609 0.5609 0.5609 0.5609 0.5931 0.5931 0.5931 0.5931 0.6441 0.6441 0.6441 0.6441 0.8843 0.8843 0.8843 0.8843 2.2361 2.2361 2.2361 2.2361 3.3712 3.3712 3.3712 3.3712 3.8672 3.8672 3.8672 3.8672 5.1957 5.1957 5.1957 5.1957 5.8055 5.8055 5.8055 5.8055 6.6570 6.6570 6.6570 6.6570 8.8228 8.8228 8.8228 8.8228 10.4155 10.4155 10.4155 10.4155 11.1618 11.1618 11.1618 11.1618 12.1250 12.1250 12.1250 12.1250 12.2414 12.2414 k = 0.5000 0.5000-0.0000 ( 6728 PWs) bands (ev): -3.9494 -3.9494 -3.9494 -3.9494 -3.7372 -3.7372 -3.7372 -3.7372 -0.2285 -0.2285 -0.2285 -0.2285 -0.1632 -0.1632 -0.1632 -0.1632 -0.0236 -0.0236 -0.0236 -0.0236 0.0615 0.0615 0.0615 0.0615 0.0770 0.0770 0.0770 0.0770 0.1357 0.1357 0.1357 0.1357 0.2616 0.2616 0.2616 0.2616 0.2644 0.2644 0.2644 0.2644 0.3688 0.3688 0.3688 0.3688 0.4303 0.4303 0.4303 0.4303 0.4537 0.4537 0.4537 0.4537 0.4658 0.4658 0.4658 0.4658 0.5322 0.5322 0.5322 0.5322 0.5762 0.5762 0.5762 0.5762 0.6240 0.6240 0.6240 0.6240 2.4654 2.4654 2.4654 2.4654 3.0438 3.0438 3.0438 3.0438 3.6408 3.6408 3.6408 3.6408 5.2468 5.2468 5.2468 5.2468 6.1663 6.1663 6.1663 6.1663 7.3078 7.3078 7.3078 7.3078 9.0008 9.0008 9.0008 9.0008 10.3196 10.3196 10.3196 10.3196 11.6622 11.6622 11.6622 11.6622 12.6028 12.6028 12.6028 12.6028 12.7864 12.7864 k = 0.5000 0.5000 0.0179 ( 6756 PWs) bands (ev): -3.9492 -3.9492 -3.9492 -3.9492 -3.7467 -3.7467 -3.7276 -3.7276 -0.2286 -0.2286 -0.2278 -0.2278 -0.1644 -0.1644 -0.1617 -0.1617 -0.0246 -0.0246 -0.0228 -0.0228 0.0607 0.0607 0.0623 0.0623 0.0765 0.0765 0.0777 0.0777 0.1353 0.1353 0.1361 0.1361 0.2587 0.2587 0.2618 0.2618 0.2649 0.2649 0.2667 0.2667 0.3676 0.3676 0.3699 0.3699 0.4296 0.4296 0.4307 0.4307 0.4533 0.4533 0.4542 0.4542 0.4650 0.4650 0.4665 0.4665 0.5317 0.5317 0.5326 0.5326 0.5748 0.5748 0.5776 0.5776 0.6229 0.6229 0.6249 0.6249 2.4534 2.4534 2.4553 2.4553 2.9355 2.9355 3.1534 3.1534 3.6537 3.6537 3.6539 3.6539 5.1466 5.1466 5.3494 5.3494 6.1659 6.1659 6.1682 6.1682 7.3077 7.3077 7.3085 7.3085 8.9988 8.9988 8.9997 8.9997 10.2574 10.2574 10.3763 10.3763 11.6479 11.6479 11.6492 11.6492 12.6132 12.6132 12.6189 12.6189 12.7143 12.7143 k = 0.5000 0.5000 0.0357 ( 6756 PWs) bands (ev): -3.9485 -3.9485 -3.9484 -3.9484 -3.7558 -3.7558 -3.7177 -3.7177 -0.2279 -0.2279 -0.2263 -0.2263 -0.1652 -0.1652 -0.1597 -0.1597 -0.0254 -0.0254 -0.0219 -0.0219 0.0601 0.0601 0.0633 0.0633 0.0763 0.0763 0.0787 0.0787 0.1349 0.1349 0.1367 0.1367 0.2559 0.2559 0.2597 0.2597 0.2678 0.2678 0.2692 0.2692 0.3664 0.3664 0.3709 0.3709 0.4289 0.4289 0.4310 0.4310 0.4529 0.4529 0.4548 0.4548 0.4642 0.4642 0.4672 0.4672 0.5311 0.5311 0.5327 0.5327 0.5736 0.5736 0.5792 0.5792 0.6216 0.6216 0.6258 0.6258 2.4207 2.4207 2.4243 2.4243 2.8288 2.8288 3.2641 3.2641 3.6915 3.6915 3.6917 3.6917 5.0491 5.0491 5.4541 5.4541 6.1667 6.1667 6.1714 6.1714 7.3080 7.3080 7.3096 7.3096 8.9935 8.9935 8.9954 8.9954 10.1892 10.1892 10.4281 10.4281 11.6090 11.6090 11.6116 11.6116 12.6163 12.6163 12.6283 12.6283 12.6625 12.6625 k = 0.5000 0.5000 0.0536 ( 6748 PWs) bands (ev): -3.9473 -3.9473 -3.9473 -3.9473 -3.7646 -3.7646 -3.7075 -3.7075 -0.2265 -0.2265 -0.2241 -0.2241 -0.1654 -0.1654 -0.1572 -0.1572 -0.0263 -0.0263 -0.0211 -0.0211 0.0598 0.0598 0.0643 0.0643 0.0762 0.0762 0.0800 0.0800 0.1347 0.1347 0.1374 0.1374 0.2530 0.2530 0.2578 0.2578 0.2710 0.2710 0.2718 0.2718 0.3652 0.3652 0.3718 0.3718 0.4280 0.4280 0.4311 0.4311 0.4527 0.4527 0.4554 0.4554 0.4634 0.4634 0.4679 0.4679 0.5306 0.5306 0.5327 0.5327 0.5726 0.5726 0.5807 0.5807 0.6201 0.6201 0.6266 0.6266 2.3709 2.3709 2.3760 2.3760 2.7239 2.7239 3.3756 3.3756 3.7505 3.7505 3.7506 3.7506 4.9550 4.9550 5.5604 5.5604 6.1689 6.1689 6.1760 6.1760 7.3087 7.3087 7.3111 7.3111 8.9849 8.9849 8.9877 8.9877 10.1146 10.1146 10.4757 10.4757 11.5517 11.5517 11.5555 11.5555 12.5111 12.5111 12.5949 12.5949 12.7236 12.7236 k = 0.5000 0.5000 0.0714 ( 6740 PWs) bands (ev): -3.9457 -3.9457 -3.9456 -3.9456 -3.7731 -3.7731 -3.6973 -3.6973 -0.2245 -0.2245 -0.2212 -0.2212 -0.1652 -0.1652 -0.1542 -0.1542 -0.0270 -0.0270 -0.0203 -0.0203 0.0597 0.0597 0.0652 0.0652 0.0764 0.0764 0.0816 0.0816 0.1345 0.1345 0.1381 0.1381 0.2503 0.2503 0.2560 0.2560 0.2742 0.2742 0.2745 0.2745 0.3638 0.3638 0.3727 0.3727 0.4270 0.4270 0.4311 0.4311 0.4526 0.4526 0.4560 0.4560 0.4625 0.4625 0.4687 0.4687 0.5300 0.5300 0.5325 0.5325 0.5718 0.5718 0.5823 0.5823 0.6184 0.6184 0.6274 0.6274 2.3083 2.3083 2.3146 2.3146 2.6209 2.6209 3.4871 3.4871 3.8261 3.8261 3.8265 3.8265 4.8649 4.8649 5.6680 5.6680 6.1724 6.1724 6.1821 6.1821 7.3099 7.3099 7.3132 7.3132 8.9727 8.9727 8.9765 8.9765 10.0335 10.0335 10.5197 10.5197 11.4829 11.4829 11.4879 11.4879 12.4007 12.4007 12.5534 12.5534 12.7964 12.7964 k = 0.5000 0.5000 0.0893 ( 6732 PWs) bands (ev): -3.9436 -3.9436 -3.9436 -3.9436 -3.7813 -3.7813 -3.6868 -3.6868 -0.2220 -0.2220 -0.2178 -0.2178 -0.1643 -0.1643 -0.1507 -0.1507 -0.0276 -0.0276 -0.0195 -0.0195 0.0599 0.0599 0.0662 0.0662 0.0768 0.0768 0.0835 0.0835 0.1344 0.1344 0.1390 0.1390 0.2476 0.2476 0.2544 0.2544 0.2773 0.2773 0.2776 0.2776 0.3625 0.3625 0.3734 0.3734 0.4259 0.4259 0.4310 0.4310 0.4526 0.4526 0.4566 0.4566 0.4615 0.4615 0.4695 0.4695 0.5294 0.5294 0.5320 0.5320 0.5712 0.5712 0.5837 0.5837 0.6164 0.6164 0.6284 0.6284 2.2366 2.2366 2.2440 2.2440 2.5199 2.5199 3.5978 3.5978 3.9146 3.9146 3.9156 3.9156 4.7798 4.7798 5.7765 5.7765 6.1771 6.1771 6.1897 6.1897 7.3116 7.3116 7.3156 7.3156 8.9566 8.9566 8.9615 8.9615 9.9458 9.9458 10.5609 10.5609 11.4079 11.4079 11.4140 11.4140 12.2886 12.2886 12.5191 12.5191 12.7342 12.7342 k = 0.5000 0.5000 0.1071 ( 6748 PWs) bands (ev): -3.9412 -3.9412 -3.9411 -3.9411 -3.7892 -3.7892 -3.6763 -3.6763 -0.2190 -0.2190 -0.2139 -0.2139 -0.1628 -0.1628 -0.1464 -0.1464 -0.0281 -0.0281 -0.0188 -0.0188 0.0604 0.0604 0.0671 0.0671 0.0772 0.0772 0.0856 0.0856 0.1343 0.1343 0.1400 0.1400 0.2449 0.2449 0.2530 0.2530 0.2801 0.2801 0.2811 0.2811 0.3611 0.3611 0.3740 0.3740 0.4247 0.4247 0.4307 0.4307 0.4526 0.4526 0.4570 0.4570 0.4605 0.4605 0.4704 0.4704 0.5290 0.5290 0.5311 0.5311 0.5708 0.5708 0.5849 0.5849 0.6142 0.6142 0.6295 0.6295 2.1591 2.1591 2.1674 2.1674 2.4210 2.4210 3.7061 3.7061 4.0127 4.0127 4.0146 4.0146 4.7015 4.7015 5.8854 5.8854 6.1829 6.1829 6.1990 6.1990 7.3136 7.3136 7.3185 7.3185 8.9363 8.9363 8.9423 8.9423 9.8517 9.8517 10.6000 10.6000 11.3307 11.3307 11.3380 11.3380 12.1765 12.1765 12.4938 12.4938 12.6498 12.6498 k = 0.5000 0.5000 0.1250 ( 6748 PWs) bands (ev): -3.9383 -3.9383 -3.9382 -3.9382 -3.7967 -3.7967 -3.6657 -3.6657 -0.2157 -0.2157 -0.2097 -0.2097 -0.1605 -0.1605 -0.1415 -0.1415 -0.0285 -0.0285 -0.0182 -0.0182 0.0612 0.0612 0.0679 0.0679 0.0779 0.0779 0.0878 0.0878 0.1342 0.1342 0.1412 0.1412 0.2423 0.2423 0.2518 0.2518 0.2829 0.2829 0.2847 0.2847 0.3597 0.3597 0.3745 0.3745 0.4234 0.4234 0.4302 0.4302 0.4526 0.4526 0.4573 0.4573 0.4593 0.4593 0.4714 0.4714 0.5287 0.5287 0.5300 0.5300 0.5709 0.5709 0.5858 0.5858 0.6118 0.6118 0.6311 0.6311 2.0780 2.0780 2.0871 2.0871 2.3243 2.3243 3.8092 3.8092 4.1181 4.1181 4.1212 4.1212 4.6327 4.6327 5.9935 5.9935 6.1898 6.1898 6.2106 6.2106 7.3160 7.3160 7.3217 7.3217 8.9115 8.9115 8.9185 8.9185 9.7515 9.7515 10.6374 10.6374 11.2542 11.2542 11.2626 11.2626 12.0656 12.0656 12.4773 12.4773 12.5587 12.5587 k = 0.5000 0.5000 0.1429 ( 6748 PWs) bands (ev): -3.9351 -3.9351 -3.9351 -3.9351 -3.8038 -3.8038 -3.6551 -3.6551 -0.2122 -0.2122 -0.2054 -0.2054 -0.1571 -0.1571 -0.1358 -0.1358 -0.0287 -0.0287 -0.0176 -0.0176 0.0623 0.0623 0.0687 0.0687 0.0787 0.0787 0.0902 0.0902 0.1342 0.1342 0.1425 0.1425 0.2397 0.2397 0.2509 0.2509 0.2857 0.2857 0.2884 0.2884 0.3583 0.3583 0.3748 0.3748 0.4222 0.4222 0.4296 0.4296 0.4527 0.4527 0.4574 0.4574 0.4580 0.4580 0.4726 0.4726 0.5286 0.5286 0.5287 0.5287 0.5713 0.5713 0.5864 0.5864 0.6092 0.6092 0.6332 0.6332 1.9950 1.9950 2.0048 2.0048 2.2299 2.2299 3.9019 3.9019 4.2291 4.2291 4.2336 4.2336 4.5788 4.5788 6.0978 6.0978 6.1977 6.1977 6.2274 6.2274 7.3187 7.3187 7.3253 7.3253 8.8816 8.8816 8.8898 8.8898 9.6457 9.6457 10.6739 10.6739 11.1803 11.1803 11.1900 11.1900 11.9567 11.9567 12.4547 12.4547 12.4799 12.4799 k = 0.5000 0.5000 0.1607 ( 6760 PWs) bands (ev): -3.9316 -3.9316 -3.9315 -3.9315 -3.8106 -3.8106 -3.6446 -3.6446 -0.2086 -0.2086 -0.2014 -0.2014 -0.1524 -0.1524 -0.1291 -0.1291 -0.0288 -0.0288 -0.0170 -0.0170 0.0636 0.0636 0.0695 0.0695 0.0796 0.0796 0.0925 0.0925 0.1342 0.1342 0.1439 0.1439 0.2371 0.2371 0.2501 0.2501 0.2884 0.2884 0.2923 0.2923 0.3569 0.3569 0.3750 0.3750 0.4208 0.4208 0.4289 0.4289 0.4528 0.4528 0.4566 0.4566 0.4573 0.4573 0.4739 0.4739 0.5270 0.5270 0.5289 0.5289 0.5721 0.5721 0.5866 0.5866 0.6066 0.6066 0.6358 0.6358 1.9113 1.9113 1.9217 1.9217 2.1378 2.1378 3.9752 3.9752 4.3442 4.3442 4.3505 4.3505 4.5490 4.5490 6.1822 6.1822 6.2065 6.2065 6.2648 6.2648 7.3217 7.3217 7.3292 7.3292 8.8463 8.8463 8.8557 8.8557 9.5346 9.5346 10.7097 10.7097 11.1106 11.1106 11.1217 11.1217 11.8506 11.8506 12.3654 12.3654 12.4760 12.4760 k = 0.5000 0.5000 0.1786 ( 6748 PWs) bands (ev): -3.9279 -3.9279 -3.9278 -3.9278 -3.8169 -3.8169 -3.6341 -3.6341 -0.2050 -0.2050 -0.1977 -0.1977 -0.1462 -0.1462 -0.1214 -0.1214 -0.0286 -0.0286 -0.0165 -0.0165 0.0652 0.0652 0.0702 0.0702 0.0806 0.0806 0.0949 0.0949 0.1343 0.1343 0.1456 0.1456 0.2347 0.2347 0.2495 0.2495 0.2910 0.2910 0.2963 0.2963 0.3556 0.3556 0.3750 0.3750 0.4195 0.4195 0.4281 0.4281 0.4528 0.4528 0.4551 0.4551 0.4570 0.4570 0.4754 0.4754 0.5252 0.5252 0.5296 0.5296 0.5733 0.5733 0.5863 0.5863 0.6042 0.6042 0.6390 0.6390 1.8278 1.8278 1.8387 1.8387 2.0481 2.0481 4.0173 4.0173 4.4617 4.4617 4.4709 4.4709 4.5558 4.5558 6.2161 6.2161 6.2204 6.2204 6.3488 6.3488 7.3250 7.3250 7.3334 7.3334 8.8053 8.8053 8.8159 8.8159 9.4189 9.4189 10.7454 10.7454 11.0462 11.0462 11.0586 11.0586 11.7476 11.7476 12.2714 12.2714 12.4860 12.4860 k = 0.5000 0.5000 0.1964 ( 6748 PWs) bands (ev): -3.9239 -3.9239 -3.9237 -3.9237 -3.8230 -3.8230 -3.6237 -3.6237 -0.2016 -0.2016 -0.1945 -0.1945 -0.1385 -0.1385 -0.1125 -0.1125 -0.0282 -0.0282 -0.0160 -0.0160 0.0669 0.0669 0.0710 0.0710 0.0818 0.0818 0.0972 0.0972 0.1344 0.1344 0.1473 0.1473 0.2323 0.2323 0.2492 0.2492 0.2934 0.2934 0.3004 0.3004 0.3543 0.3543 0.3748 0.3748 0.4182 0.4182 0.4271 0.4271 0.4528 0.4528 0.4534 0.4534 0.4565 0.4565 0.4769 0.4769 0.5230 0.5230 0.5307 0.5307 0.5747 0.5747 0.5857 0.5857 0.6019 0.6019 0.6427 0.6427 1.7452 1.7452 1.7565 1.7565 1.9608 1.9608 4.0228 4.0228 4.5760 4.5760 4.5940 4.5940 4.6096 4.6096 6.2264 6.2264 6.2396 6.2396 6.4515 6.4515 7.3284 7.3284 7.3378 7.3378 8.7582 8.7582 8.7702 8.7702 9.2991 9.2991 10.7810 10.7810 10.9879 10.9879 11.0016 11.0016 11.6483 11.6483 12.1792 12.1792 12.5042 12.5042 k = 0.5000 0.5000 0.2143 ( 6756 PWs) bands (ev): -3.9197 -3.9197 -3.9196 -3.9196 -3.8286 -3.8286 -3.6135 -3.6135 -0.1983 -0.1983 -0.1919 -0.1919 -0.1292 -0.1292 -0.1026 -0.1026 -0.0276 -0.0276 -0.0155 -0.0155 0.0689 0.0689 0.0716 0.0716 0.0830 0.0830 0.0993 0.0993 0.1346 0.1346 0.1492 0.1492 0.2299 0.2299 0.2490 0.2490 0.2957 0.2957 0.3046 0.3046 0.3531 0.3531 0.3744 0.3744 0.4169 0.4169 0.4261 0.4261 0.4514 0.4514 0.4530 0.4530 0.4558 0.4558 0.4784 0.4784 0.5206 0.5206 0.5323 0.5323 0.5763 0.5763 0.5847 0.5847 0.6005 0.6005 0.6469 0.6469 1.6641 1.6641 1.6757 1.6757 1.8761 1.8761 3.9997 3.9997 4.6730 4.6730 4.7157 4.7157 4.7192 4.7192 6.2372 6.2372 6.2554 6.2554 6.5569 6.5569 7.3320 7.3320 7.3424 7.3424 8.7050 8.7050 8.7184 8.7184 9.1758 9.1758 10.8166 10.8166 10.9365 10.9365 10.9512 10.9512 11.5528 11.5528 12.0898 12.0898 12.5297 12.5297 k = 0.5000 0.5000 0.2321 ( 6744 PWs) bands (ev): -3.9154 -3.9154 -3.9152 -3.9152 -3.8339 -3.8339 -3.6036 -3.6036 -0.1953 -0.1953 -0.1897 -0.1897 -0.1185 -0.1185 -0.0915 -0.0915 -0.0268 -0.0268 -0.0150 -0.0150 0.0710 0.0710 0.0723 0.0723 0.0844 0.0844 0.1014 0.1014 0.1348 0.1348 0.1512 0.1512 0.2276 0.2276 0.2490 0.2490 0.2979 0.2979 0.3090 0.3090 0.3520 0.3520 0.3738 0.3738 0.4156 0.4156 0.4249 0.4249 0.4494 0.4494 0.4531 0.4531 0.4550 0.4550 0.4800 0.4800 0.5181 0.5181 0.5343 0.5343 0.5775 0.5775 0.5836 0.5836 0.6004 0.6004 0.6515 0.6515 1.5849 1.5849 1.5968 1.5968 1.7940 1.7940 3.9604 3.9604 4.7758 4.7758 4.8382 4.8382 4.8460 4.8460 6.2485 6.2485 6.2704 6.2704 6.6615 6.6615 7.3356 7.3356 7.3472 7.3472 8.6456 8.6456 8.6606 8.6606 9.0494 9.0494 10.8497 10.8497 10.8949 10.8949 10.9075 10.9075 11.4615 11.4615 12.0037 12.0037 12.5618 12.5618 k = 0.5000 0.5000 0.2500 ( 6720 PWs) bands (ev): -3.9110 -3.9110 -3.9109 -3.9109 -3.8388 -3.8388 -3.5939 -3.5939 -0.1926 -0.1926 -0.1879 -0.1879 -0.1066 -0.1066 -0.0793 -0.0793 -0.0258 -0.0258 -0.0146 -0.0146 0.0730 0.0730 0.0732 0.0732 0.0859 0.0859 0.1033 0.1033 0.1352 0.1352 0.1532 0.1532 0.2254 0.2254 0.2491 0.2491 0.2998 0.2998 0.3134 0.3134 0.3511 0.3511 0.3729 0.3729 0.4144 0.4144 0.4235 0.4235 0.4474 0.4474 0.4531 0.4531 0.4541 0.4541 0.4814 0.4814 0.5153 0.5153 0.5366 0.5366 0.5784 0.5784 0.5824 0.5824 0.6023 0.6023 0.6565 0.6565 1.5080 1.5080 1.5199 1.5199 1.7144 1.7144 3.9136 3.9136 4.8889 4.8889 4.9633 4.9633 4.9738 4.9738 6.2601 6.2601 6.2851 6.2851 6.7643 6.7643 7.3393 7.3393 7.3521 7.3521 8.5802 8.5802 8.5969 8.5969 8.9207 8.9207 10.8450 10.8450 10.8705 10.8705 10.8983 10.8983 11.3747 11.3747 11.9215 11.9215 12.6000 12.6000 k = 0.5000 0.5000 0.2679 ( 6736 PWs) bands (ev): -3.9066 -3.9066 -3.9065 -3.9065 -3.8433 -3.8433 -3.5846 -3.5846 -0.1903 -0.1903 -0.1864 -0.1864 -0.0936 -0.0936 -0.0661 -0.0661 -0.0247 -0.0247 -0.0141 -0.0141 0.0735 0.0735 0.0755 0.0755 0.0874 0.0874 0.1052 0.1052 0.1356 0.1356 0.1552 0.1552 0.2232 0.2232 0.2492 0.2492 0.3015 0.3015 0.3177 0.3177 0.3502 0.3502 0.3716 0.3716 0.4133 0.4133 0.4220 0.4220 0.4454 0.4454 0.4530 0.4530 0.4530 0.4530 0.4826 0.4826 0.5124 0.5124 0.5387 0.5387 0.5792 0.5792 0.5812 0.5812 0.6064 0.6064 0.6617 0.6617 1.4337 1.4337 1.4455 1.4455 1.6376 1.6376 3.8642 3.8642 5.0085 5.0085 5.0893 5.0893 5.1021 5.1021 6.2719 6.2719 6.2997 6.2997 6.8642 6.8642 7.3429 7.3429 7.3572 7.3572 8.5090 8.5090 8.5276 8.5276 8.7900 8.7900 10.8152 10.8152 10.8399 10.8399 10.9339 10.9339 11.2927 11.2927 11.8436 11.8436 12.6436 12.6436 k = 0.5000 0.5000 0.2857 ( 6732 PWs) bands (ev): -3.9023 -3.9023 -3.9021 -3.9021 -3.8475 -3.8475 -3.5757 -3.5757 -0.1882 -0.1882 -0.1851 -0.1851 -0.0797 -0.0797 -0.0520 -0.0520 -0.0233 -0.0233 -0.0136 -0.0136 0.0741 0.0741 0.0777 0.0777 0.0890 0.0890 0.1069 0.1069 0.1362 0.1362 0.1572 0.1572 0.2212 0.2212 0.2493 0.2493 0.3029 0.3029 0.3220 0.3220 0.3495 0.3495 0.3700 0.3700 0.4122 0.4122 0.4204 0.4204 0.4435 0.4435 0.4519 0.4519 0.4529 0.4529 0.4835 0.4835 0.5093 0.5093 0.5398 0.5398 0.5802 0.5802 0.5812 0.5812 0.6125 0.6125 0.6671 0.6671 1.3623 1.3623 1.3737 1.3737 1.5634 1.5634 3.8149 3.8149 5.1323 5.1323 5.2153 5.2153 5.2306 5.2306 6.2836 6.2836 6.3142 6.3142 6.9604 6.9604 7.3463 7.3463 7.3624 7.3624 8.4326 8.4326 8.4532 8.4532 8.6578 8.6578 10.7892 10.7892 10.8155 10.8155 10.9722 10.9722 11.2158 11.2158 11.7703 11.7703 12.6918 12.6918 k = 0.5000 0.5000 0.3036 ( 6752 PWs) bands (ev): -3.8980 -3.8980 -3.8978 -3.8978 -3.8513 -3.8513 -3.5673 -3.5673 -0.1865 -0.1865 -0.1841 -0.1841 -0.0651 -0.0651 -0.0373 -0.0373 -0.0216 -0.0216 -0.0132 -0.0132 0.0745 0.0745 0.0799 0.0799 0.0905 0.0905 0.1087 0.1087 0.1369 0.1369 0.1591 0.1591 0.2192 0.2192 0.2493 0.2493 0.3042 0.3042 0.3262 0.3262 0.3489 0.3489 0.3679 0.3679 0.4112 0.4112 0.4187 0.4187 0.4419 0.4419 0.4508 0.4508 0.4528 0.4528 0.4836 0.4836 0.5065 0.5065 0.5393 0.5393 0.5794 0.5794 0.5852 0.5852 0.6206 0.6206 0.6727 0.6727 1.2940 1.2940 1.3049 1.3049 1.4920 1.4920 3.7673 3.7673 5.2588 5.2588 5.3408 5.3408 5.3587 5.3587 6.2953 6.2953 6.3284 6.3284 7.0521 7.0521 7.3494 7.3494 7.3679 7.3679 8.3516 8.3516 8.3742 8.3742 8.5249 8.5249 10.7682 10.7682 10.7965 10.7965 11.0108 11.0108 11.1448 11.1448 11.7019 11.7019 12.6769 12.6769 k = 0.5000 0.5000 0.3214 ( 6752 PWs) bands (ev): -3.8939 -3.8939 -3.8937 -3.8937 -3.8548 -3.8548 -3.5594 -3.5594 -0.1849 -0.1849 -0.1831 -0.1831 -0.0500 -0.0500 -0.0238 -0.0238 -0.0179 -0.0179 -0.0128 -0.0128 0.0750 0.0750 0.0820 0.0820 0.0921 0.0921 0.1105 0.1105 0.1380 0.1380 0.1610 0.1610 0.2173 0.2173 0.2491 0.2491 0.3054 0.3054 0.3302 0.3302 0.3485 0.3485 0.3656 0.3656 0.4104 0.4104 0.4170 0.4170 0.4405 0.4405 0.4497 0.4497 0.4525 0.4525 0.4826 0.4826 0.5040 0.5040 0.5373 0.5373 0.5791 0.5791 0.5916 0.5916 0.6306 0.6306 0.6783 0.6783 1.2292 1.2292 1.2391 1.2391 1.4233 1.4233 3.7222 3.7222 5.3867 5.3867 5.4651 5.4651 5.4858 5.4858 6.3068 6.3068 6.3422 6.3422 7.1379 7.1379 7.3522 7.3522 7.3742 7.3742 8.2667 8.2667 8.2910 8.2910 8.3921 8.3921 10.7519 10.7519 10.7824 10.7824 11.0444 11.0444 11.0847 11.0847 11.6386 11.6386 12.6073 12.6073 k = 0.5000 0.5000 0.3393 ( 6752 PWs) bands (ev): -3.8900 -3.8900 -3.8898 -3.8898 -3.8579 -3.8579 -3.5520 -3.5520 -0.1837 -0.1837 -0.1823 -0.1823 -0.0345 -0.0345 -0.0198 -0.0198 -0.0124 -0.0124 -0.0044 -0.0044 0.0754 0.0754 0.0840 0.0840 0.0935 0.0935 0.1126 0.1126 0.1395 0.1395 0.1627 0.1627 0.2155 0.2155 0.2485 0.2485 0.3065 0.3065 0.3340 0.3340 0.3482 0.3482 0.3629 0.3629 0.4096 0.4096 0.4153 0.4153 0.4394 0.4394 0.4486 0.4486 0.4522 0.4522 0.4802 0.4802 0.5024 0.5024 0.5339 0.5339 0.5792 0.5792 0.6002 0.6002 0.6428 0.6428 0.6838 0.6838 1.1682 1.1682 1.1767 1.1767 1.3575 1.3575 3.6802 3.6802 5.5152 5.5152 5.5875 5.5875 5.6113 5.6113 6.3179 6.3179 6.3555 6.3555 7.2159 7.2159 7.3544 7.3544 7.3824 7.3824 8.1789 8.1789 8.2032 8.2032 8.2614 8.2614 10.7396 10.7396 10.7724 10.7724 11.0121 11.0121 11.0962 11.0962 11.5806 11.5806 12.5425 12.5425 k = 0.5000 0.5000 0.3571 ( 6752 PWs) bands (ev): -3.8863 -3.8863 -3.8861 -3.8861 -3.8607 -3.8607 -3.5453 -3.5453 -0.1826 -0.1826 -0.1817 -0.1817 -0.0191 -0.0191 -0.0180 -0.0180 -0.0119 -0.0119 0.0115 0.0115 0.0759 0.0759 0.0856 0.0856 0.0946 0.0946 0.1150 0.1150 0.1416 0.1416 0.1643 0.1643 0.2137 0.2137 0.2472 0.2472 0.3078 0.3078 0.3375 0.3375 0.3479 0.3479 0.3600 0.3600 0.4089 0.4089 0.4136 0.4136 0.4386 0.4386 0.4476 0.4476 0.4518 0.4518 0.4762 0.4762 0.5016 0.5016 0.5297 0.5297 0.5799 0.5799 0.6107 0.6107 0.6573 0.6573 0.6894 0.6894 1.1112 1.1112 1.1178 1.1178 1.2945 1.2945 3.6419 3.6419 5.6434 5.6434 5.7073 5.7073 5.7343 5.7343 6.3286 6.3286 6.3682 6.3682 7.2815 7.2815 7.3560 7.3560 7.3960 7.3960 8.0893 8.0893 8.1034 8.1034 8.1420 8.1420 10.7305 10.7305 10.7659 10.7659 10.9590 10.9590 11.1338 11.1338 11.5282 11.5282 12.4830 12.4830 k = 0.5000 0.5000 0.3750 ( 6772 PWs) bands (ev): -3.8830 -3.8830 -3.8827 -3.8827 -3.8632 -3.8632 -3.5393 -3.5393 -0.1817 -0.1817 -0.1811 -0.1811 -0.0164 -0.0164 -0.0117 -0.0117 -0.0038 -0.0038 0.0269 0.0269 0.0764 0.0764 0.0870 0.0870 0.0953 0.0953 0.1181 0.1181 0.1442 0.1442 0.1658 0.1658 0.2121 0.2121 0.2452 0.2452 0.3092 0.3092 0.3406 0.3406 0.3477 0.3477 0.3569 0.3569 0.4083 0.4083 0.4120 0.4120 0.4382 0.4382 0.4467 0.4467 0.4513 0.4513 0.4708 0.4708 0.5013 0.5013 0.5250 0.5250 0.5811 0.5811 0.6226 0.6226 0.6742 0.6742 0.6949 0.6949 1.0586 1.0586 1.0626 1.0626 1.2344 1.2344 3.6075 3.6075 5.7702 5.7702 5.8233 5.8233 5.8538 5.8538 6.3390 6.3390 6.3802 6.3802 7.3256 7.3256 7.3566 7.3566 7.4232 7.4232 7.9821 7.9821 7.9995 7.9995 8.0456 8.0456 10.7240 10.7240 10.7621 10.7621 10.9110 10.9110 11.1714 11.1714 11.4815 11.4815 12.4292 12.4292 k = 0.5000 0.5000 0.3929 ( 6780 PWs) bands (ev): -3.8800 -3.8800 -3.8797 -3.8797 -3.8652 -3.8652 -3.5339 -3.5339 -0.1810 -0.1810 -0.1806 -0.1806 -0.0150 -0.0150 -0.0114 -0.0114 0.0108 0.0108 0.0412 0.0412 0.0770 0.0770 0.0881 0.0881 0.0955 0.0955 0.1223 0.1223 0.1475 0.1475 0.1671 0.1671 0.2106 0.2106 0.2421 0.2421 0.3111 0.3111 0.3434 0.3434 0.3474 0.3474 0.3540 0.3540 0.4078 0.4078 0.4107 0.4107 0.4380 0.4380 0.4458 0.4458 0.4507 0.4507 0.4646 0.4646 0.5014 0.5014 0.5202 0.5202 0.5827 0.5827 0.6359 0.6359 0.6937 0.6937 0.7003 0.7003 1.0108 1.0108 1.0113 1.0113 1.1773 1.1773 3.5772 3.5772 5.8938 5.8938 5.9345 5.9345 5.9682 5.9682 6.3491 6.3491 6.3915 6.3915 7.3456 7.3456 7.3561 7.3561 7.4653 7.4653 7.8553 7.8553 7.9113 7.9113 7.9592 7.9592 10.7193 10.7193 10.7604 10.7604 10.8692 10.8692 11.2072 11.2072 11.4407 11.4407 12.3816 12.3816 k = 0.5000 0.5000 0.4107 ( 6772 PWs) bands (ev): -3.8774 -3.8774 -3.8771 -3.8771 -3.8670 -3.8670 -3.5293 -3.5293 -0.1804 -0.1804 -0.1802 -0.1802 -0.0137 -0.0137 -0.0111 -0.0111 0.0245 0.0245 0.0533 0.0533 0.0780 0.0780 0.0886 0.0886 0.0953 0.0953 0.1283 0.1283 0.1513 0.1513 0.1683 0.1683 0.2092 0.2092 0.2378 0.2378 0.3134 0.3134 0.3456 0.3456 0.3471 0.3471 0.3516 0.3516 0.4075 0.4075 0.4094 0.4094 0.4382 0.4382 0.4450 0.4450 0.4499 0.4499 0.4578 0.4578 0.5017 0.5017 0.5155 0.5155 0.5848 0.5848 0.6506 0.6506 0.7056 0.7056 0.7156 0.7156 0.9642 0.9642 0.9683 0.9683 1.1233 1.1233 3.5513 3.5513 6.0109 6.0109 6.0402 6.0402 6.0754 6.0754 6.3594 6.3594 6.4023 6.4023 7.3523 7.3523 7.3541 7.3541 7.5100 7.5100 7.7310 7.7310 7.8276 7.8276 7.8789 7.8789 10.7156 10.7156 10.7600 10.7600 10.8342 10.8342 11.2401 11.2401 11.4059 11.4059 12.3406 12.3406 k = 0.5000 0.5000 0.4286 ( 6780 PWs) bands (ev): -3.8752 -3.8752 -3.8749 -3.8749 -3.8685 -3.8685 -3.5255 -3.5255 -0.1800 -0.1800 -0.1798 -0.1798 -0.0126 -0.0126 -0.0108 -0.0108 0.0370 0.0370 0.0620 0.0620 0.0797 0.0797 0.0883 0.0883 0.0949 0.0949 0.1362 0.1362 0.1555 0.1555 0.1693 0.1693 0.2078 0.2078 0.2321 0.2321 0.3163 0.3163 0.3463 0.3463 0.3465 0.3465 0.3505 0.3505 0.4071 0.4071 0.4084 0.4084 0.4387 0.4387 0.4438 0.4438 0.4489 0.4489 0.4512 0.4512 0.5019 0.5019 0.5112 0.5112 0.5871 0.5871 0.6665 0.6665 0.7108 0.7108 0.7396 0.7396 0.9218 0.9218 0.9315 0.9315 1.0725 1.0725 3.5299 3.5299 6.1141 6.1141 6.1411 6.1411 6.1720 6.1720 6.3712 6.3712 6.4131 6.4131 7.3504 7.3504 7.3525 7.3525 7.5485 7.5485 7.6129 7.6129 7.7527 7.7527 7.8064 7.8064 10.7123 10.7123 10.7606 10.7606 10.8064 10.8064 11.2691 11.2691 11.3773 11.3773 12.3066 12.3066 k = 0.5000 0.5000 0.4464 ( 6764 PWs) bands (ev): -3.8734 -3.8734 -3.8731 -3.8731 -3.8696 -3.8696 -3.5225 -3.5225 -0.1796 -0.1796 -0.1796 -0.1796 -0.0116 -0.0116 -0.0106 -0.0106 0.0482 0.0482 0.0672 0.0672 0.0820 0.0820 0.0867 0.0867 0.0947 0.0947 0.1460 0.1460 0.1595 0.1595 0.1703 0.1703 0.2067 0.2067 0.2251 0.2251 0.3197 0.3197 0.3454 0.3454 0.3458 0.3458 0.3513 0.3513 0.4069 0.4069 0.4076 0.4076 0.4395 0.4395 0.4411 0.4411 0.4467 0.4467 0.4478 0.4478 0.5022 0.5022 0.5076 0.5076 0.5894 0.5894 0.6835 0.6835 0.7158 0.7158 0.7645 0.7645 0.8853 0.8853 0.9011 0.9011 1.0253 1.0253 3.5131 3.5131 6.1961 6.1961 6.2340 6.2340 6.2531 6.2531 6.3876 6.3876 6.4252 6.4252 7.3449 7.3449 7.3483 7.3483 7.5054 7.5054 7.5746 7.5746 7.6937 7.6937 7.7450 7.7450 10.7088 10.7088 10.7615 10.7615 10.7860 10.7860 11.2931 11.2931 11.3549 11.3549 12.2798 12.2798 k = 0.5000 0.5000 0.4643 ( 6764 PWs) bands (ev): -3.8722 -3.8722 -3.8719 -3.8719 -3.8703 -3.8703 -3.5203 -3.5203 -0.1794 -0.1794 -0.1794 -0.1794 -0.0109 -0.0109 -0.0105 -0.0105 0.0579 0.0579 0.0696 0.0696 0.0837 0.0837 0.0842 0.0842 0.0947 0.0947 0.1563 0.1563 0.1629 0.1629 0.1717 0.1717 0.2057 0.2057 0.2170 0.2170 0.3231 0.3231 0.3443 0.3443 0.3448 0.3448 0.3523 0.3523 0.4067 0.4067 0.4070 0.4070 0.4365 0.4365 0.4404 0.4404 0.4452 0.4452 0.4466 0.4466 0.5023 0.5023 0.5048 0.5048 0.5914 0.5914 0.7011 0.7011 0.7201 0.7201 0.7863 0.7863 0.8586 0.8586 0.8781 0.8781 0.9826 0.9826 3.5011 3.5011 6.2545 6.2545 6.3039 6.3039 6.3120 6.3120 6.4143 6.4143 6.4400 6.4400 7.3385 7.3385 7.3410 7.3410 7.4154 7.4154 7.5796 7.5796 7.6628 7.6628 7.6983 7.6983 10.7052 10.7052 10.7624 10.7624 10.7727 10.7727 11.3111 11.3111 11.3389 11.3389 12.2605 12.2605 k = 0.5000 0.5000 0.4821 ( 6776 PWs) bands (ev): -3.8715 -3.8715 -3.8711 -3.8711 -3.8708 -3.8708 -3.5190 -3.5190 -0.1793 -0.1793 -0.1793 -0.1793 -0.0105 -0.0105 -0.0104 -0.0104 0.0660 0.0660 0.0707 0.0707 0.0796 0.0796 0.0857 0.0857 0.0947 0.0947 0.1639 0.1639 0.1652 0.1652 0.1747 0.1747 0.2051 0.2051 0.2089 0.2089 0.3259 0.3259 0.3435 0.3435 0.3437 0.3437 0.3530 0.3530 0.4065 0.4065 0.4066 0.4066 0.4329 0.4329 0.4415 0.4415 0.4447 0.4447 0.4453 0.4453 0.5024 0.5024 0.5030 0.5030 0.5927 0.5927 0.7170 0.7170 0.7233 0.7233 0.7938 0.7938 0.8524 0.8524 0.8635 0.8635 0.9473 0.9473 3.4939 3.4939 6.2872 6.2872 6.3421 6.3421 6.3444 6.3444 6.4474 6.4474 6.4556 6.4556 7.3329 7.3329 7.3335 7.3335 7.3533 7.3533 7.5680 7.5680 7.6584 7.6584 7.6692 7.6692 10.7023 10.7023 10.7631 10.7631 10.7656 10.7656 11.3222 11.3222 11.3292 11.3292 12.2488 12.2488 k = 0.5000 0.5000 0.5000 ( 6776 PWs) bands (ev): -3.8713 -3.8713 -3.8709 -3.8709 -3.8709 -3.8709 -3.5186 -3.5186 -0.1792 -0.1792 -0.1792 -0.1792 -0.0104 -0.0104 -0.0104 -0.0104 0.0710 0.0710 0.0710 0.0710 0.0760 0.0760 0.0863 0.0863 0.0947 0.0947 0.1660 0.1660 0.1660 0.1660 0.1775 0.1775 0.2048 0.2048 0.2048 0.2048 0.3270 0.3270 0.3433 0.3433 0.3433 0.3433 0.3532 0.3532 0.4065 0.4065 0.4065 0.4065 0.4316 0.4316 0.4421 0.4421 0.4446 0.4446 0.4446 0.4446 0.5025 0.5025 0.5025 0.5025 0.5932 0.5932 0.7245 0.7245 0.7245 0.7245 0.7908 0.7908 0.8584 0.8584 0.8584 0.8584 0.9308 0.9308 3.4914 3.4914 6.2971 6.2971 6.3540 6.3540 6.3540 6.3540 6.4628 6.4628 6.4628 6.4628 7.3302 7.3302 7.3302 7.3302 7.3311 7.3311 7.5616 7.5616 7.6593 7.6593 7.6593 7.6593 10.7012 10.7012 10.7633 10.7633 10.7633 10.7633 11.3260 11.3260 11.3260 11.3260 12.2449 12.2449 Writing output data file Zn3As2.save init_run : 0.26s CPU 0.39s WALL ( 1 calls) electrons : 328.15s CPU 332.06s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 328.14s CPU 332.05s 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 : 0.08s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.09s WALL ( 215 calls) cegterg : 301.33s CPU 304.43s WALL ( 287 calls) Called by sum_band: Called by *egterg: h_psi : 149.47s CPU 151.44s WALL ( 4304 calls) s_psi : 15.49s CPU 15.51s WALL ( 4304 calls) g_psi : 0.50s CPU 0.47s WALL ( 3802 calls) cdiaghg : 112.41s CPU 113.83s WALL ( 4017 calls) cegterg:over : 18.10s CPU 18.14s WALL ( 3802 calls) cegterg:upda : 13.60s CPU 13.72s WALL ( 3802 calls) cegterg:last : 8.35s CPU 8.39s WALL ( 717 calls) cdiaghg:chol : 6.96s CPU 7.05s WALL ( 4017 calls) cdiaghg:inve : 5.18s CPU 5.41s WALL ( 4017 calls) cdiaghg:para : 9.82s CPU 9.61s WALL ( 8034 calls) Called by h_psi: h_psi:vloc : 117.15s CPU 118.81s WALL ( 4304 calls) h_psi:vnl : 31.76s CPU 32.08s WALL ( 4304 calls) add_vuspsi : 17.06s CPU 17.18s WALL ( 4304 calls) General routines calbec : 14.64s CPU 14.89s WALL ( 4304 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 109.64s CPU 111.33s WALL ( 1022848 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.28s CPU 0.43s WALL ( 430 calls) Parallel routines fft_scatter : 38.69s CPU 39.43s WALL ( 1022871 calls) PWSCF : 5m55.43s CPU 6m 9.84s WALL This run was terminated on: 20:37:46 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=