Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:48:18 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: ./Mg3NF3.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P 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 53 33 9 1791 857 135 Max 54 34 10 1796 869 140 Sum 1941 1201 349 64589 31103 4945 bravais-lattice index = 14 lattice parameter (alat) = 7.9671 a.u. unit-cell volume = 505.7062 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.967085 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.000000 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.000000 ) PseudoPot. # 1 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1129 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. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd 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 1085 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 atomic species valence mass pseudopotential F 7.00 18.99840 F( 1.00) Mg 10.00 24.30500 Mg( 1.00) N 5.00 14.00670 N( 1.00) 48 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cart. axis [1,0,1] cryst. s( 9) = ( 0 0 1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 10 180 deg rotation - cart. axis [-1,0,1] cryst. s(10) = ( 0 0 -1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(10) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 11 90 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 0 0 -1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(11) = ( -0.0000000 0.0000000 1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 12 90 deg rotation - cart. axis [0,-1,0] cryst. s(12) = ( 0 0 1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(12) = ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 13 180 deg rotation - cart. axis [0,1,1] cryst. s(13) = ( -1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 14 180 deg rotation - cart. axis [0,1,-1] cryst. s(14) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(14) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 15 90 deg rotation - cart. axis [-1,0,0] cryst. s(15) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 16 90 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( 1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(16) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 17 120 deg rotation - cart. axis [-1,-1,-1] cryst. s(17) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s(17) = ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 18 120 deg rotation - cart. axis [-1,1,1] cryst. s(18) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s(18) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 19 120 deg rotation - cart. axis [1,1,-1] cryst. s(19) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s(19) = ( -0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 20 120 deg rotation - cart. axis [1,-1,1] cryst. s(20) = ( 0 0 1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(20) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 21 120 deg rotation - cart. axis [1,1,1] cryst. s(21) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s(21) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 22 120 deg rotation - cart. axis [-1,1,-1] cryst. s(22) = ( 0 -1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(22) = ( -0.0000000 -0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 23 120 deg rotation - cart. axis [1,-1,-1] cryst. s(23) = ( 0 -1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(23) = ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 24 120 deg rotation - cart. axis [-1,-1,1] cryst. s(24) = ( 0 1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(24) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 25 inversion cryst. s(25) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(25) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 26 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(26) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(26) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 27 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(27) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(27) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 28 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(28) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(28) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 29 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(29) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(29) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 30 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(30) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(30) = ( 0.0000000 1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 31 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(31) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(31) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 32 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(32) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(32) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 33 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(33) = ( 0 0 -1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(33) = ( -0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 34 inv. 180 deg rotation - cart. axis [-1,0,1] cryst. s(34) = ( 0 0 1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(34) = ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 35 inv. 90 deg rotation - cart. axis [0,1,0] cryst. s(35) = ( 0 0 1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(35) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 36 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(36) = ( 0 0 -1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s(36) = ( -0.0000000 -0.0000000 1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 37 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(37) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(37) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 38 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(38) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(38) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 39 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(39) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(39) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 40 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(40) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(40) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 41 inv. 120 deg rotation - cart. axis [-1,-1,-1] cryst. s(41) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(41) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 42 inv. 120 deg rotation - cart. axis [-1,1,1] cryst. s(42) = ( 0 0 1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s(42) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 43 inv. 120 deg rotation - cart. axis [1,1,-1] cryst. s(43) = ( 0 0 1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s(43) = ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 44 inv. 120 deg rotation - cart. axis [1,-1,1] cryst. s(44) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s(44) = ( -0.0000000 1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 45 inv. 120 deg rotation - cart. axis [1,1,1] cryst. s(45) = ( 0 -1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(45) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 46 inv. 120 deg rotation - cart. axis [-1,1,-1] cryst. s(46) = ( 0 1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(46) = ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 47 inv. 120 deg rotation - cart. axis [1,-1,-1] cryst. s(47) = ( 0 1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(47) = ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 48 inv. 120 deg rotation - cart. axis [-1,-1,1] cryst. s(48) = ( 0 -1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s(48) = ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) double point group O_h (m-3m) there are 16 classes and 6 irreducible representations the character table: E -E 8C3 -8C3 3C2 6C4 -6C4 6C2' i -i 8S6 -8S6 -3C2 -6C2' G_6+ 2.00 -2.00 1.00 -1.00 0.00 1.41 -1.41 0.00 2.00 -2.00 1.00 -1.00 G_7+ 2.00 -2.00 1.00 -1.00 0.00 -1.41 1.41 0.00 2.00 -2.00 1.00 -1.00 G_8+ 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 4.00 -4.00 -1.00 1.00 G_6- 2.00 -2.00 1.00 -1.00 0.00 1.41 -1.41 0.00 -2.00 2.00 -1.00 1.00 G_7- 2.00 -2.00 1.00 -1.00 0.00 -1.41 1.41 0.00 -2.00 2.00 -1.00 1.00 G_8- 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 -4.00 4.00 1.00 -1.00 3s_h 6S4 -6S4 6s_d -3s_h -6s_d G_6+ 0.00 1.41 -1.41 0.00 G_7+ 0.00 -1.41 1.41 0.00 G_8+ 0.00 0.00 0.00 0.00 G_6- 0.00 -1.41 1.41 0.00 G_7- 0.00 1.41 -1.41 0.00 G_8- 0.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 8C3 17 19 20 18 24 21 22 23 120 deg rotation - cart. axis [-1,-1,-1] -8C3 -17 -19 -20 -18 -24 -21 -22 -23 120 deg rotation - cart. axis [-1,-1,-1] E 3C2 -3C2 2 -2 4 -4 3 -3 180 deg rotation - cart. axis [0,0,1] 6C4 7 8 15 16 12 11 90 deg rotation - cart. axis [0,0,-1] -6C4 -7 -8 -15 -16 -12 -11 90 deg rotation - cart. axis [0,0,-1] E 6C2'-6C2' 5 -5 6 -6 14 -13 -14 13 -10 -9 10 9 180 deg rotation - cart. axis [1,1,0] i 25 inversion -i -25 inversion E 8S6 41 43 44 42 48 45 46 47 inv. 120 deg rotation - cart. axis [-1,-1,-1] -8S6 -41 -43 -44 -42 -48 -45 -46 -47 inv. 120 deg rotation - cart. axis [-1,-1,-1] E 3s_h-3s_h 26 -26 28 -28 27 -27 inv. 180 deg rotation - cart. axis [0,0,1] 6S4 31 32 39 40 36 35 inv. 90 deg rotation - cart. axis [0,0,-1] -6S4 -31 -32 -39 -40 -36 -35 inv. 90 deg rotation - cart. axis [0,0,-1] E 6s_d-6s_d 29 -29 30 -30 38 -37 -38 37 -34 -33 34 33 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 291 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 2) = ( 0.0000000 0.0131579 -0.0000000), wk = 0.0034364 k( 3) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0034364 k( 4) = ( 0.0000000 0.0394737 -0.0000000), wk = 0.0034364 k( 5) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0034364 k( 6) = ( 0.0000000 0.0657895 -0.0000000), wk = 0.0034364 k( 7) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0034364 k( 8) = ( 0.0000000 0.0921053 -0.0000000), wk = 0.0034364 k( 9) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0034364 k( 10) = ( 0.0000000 0.1184210 -0.0000000), wk = 0.0034364 k( 11) = ( 0.0000000 0.1315790 -0.0000000), wk = 0.0034364 k( 12) = ( 0.0000000 0.1447368 -0.0000000), wk = 0.0034364 k( 13) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0034364 k( 14) = ( 0.0000000 0.1710526 -0.0000000), wk = 0.0034364 k( 15) = ( 0.0000000 0.1842105 -0.0000000), wk = 0.0034364 k( 16) = ( 0.0000000 0.1973684 -0.0000000), wk = 0.0034364 k( 17) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0034364 k( 18) = ( 0.0000000 0.2236842 -0.0000000), wk = 0.0034364 k( 19) = ( 0.0000000 0.2368421 -0.0000000), wk = 0.0034364 k( 20) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0034364 k( 21) = ( 0.0000000 0.2631579 -0.0000000), wk = 0.0034364 k( 22) = ( 0.0000000 0.2763158 -0.0000000), wk = 0.0034364 k( 23) = ( 0.0000000 0.2894737 -0.0000000), wk = 0.0034364 k( 24) = ( 0.0000000 0.3026316 -0.0000000), wk = 0.0034364 k( 25) = ( 0.0000000 0.3157895 -0.0000000), wk = 0.0034364 k( 26) = ( 0.0000000 0.3289474 -0.0000000), wk = 0.0034364 k( 27) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0034364 k( 28) = ( 0.0000000 0.3552632 -0.0000000), wk = 0.0034364 k( 29) = ( 0.0000000 0.3684211 -0.0000000), wk = 0.0034364 k( 30) = ( 0.0000000 0.3815789 -0.0000000), wk = 0.0034364 k( 31) = ( 0.0000000 0.3947368 -0.0000000), wk = 0.0034364 k( 32) = ( 0.0000000 0.4078947 -0.0000000), wk = 0.0034364 k( 33) = ( 0.0000000 0.4210526 -0.0000000), wk = 0.0034364 k( 34) = ( 0.0000000 0.4342105 -0.0000000), wk = 0.0034364 k( 35) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0034364 k( 36) = ( 0.0000000 0.4605263 -0.0000000), wk = 0.0034364 k( 37) = ( 0.0000000 0.4736842 -0.0000000), wk = 0.0034364 k( 38) = ( 0.0000000 0.4868421 -0.0000000), wk = 0.0034364 k( 39) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034364 k( 40) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034364 k( 41) = ( 0.0131579 0.5000000 -0.0000000), wk = 0.0034364 k( 42) = ( 0.0263158 0.5000000 -0.0000000), wk = 0.0034364 k( 43) = ( 0.0394737 0.5000000 -0.0000000), wk = 0.0034364 k( 44) = ( 0.0526316 0.5000000 -0.0000000), wk = 0.0034364 k( 45) = ( 0.0657895 0.5000000 -0.0000000), wk = 0.0034364 k( 46) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0034364 k( 47) = ( 0.0921053 0.5000000 -0.0000000), wk = 0.0034364 k( 48) = ( 0.1052632 0.5000000 -0.0000000), wk = 0.0034364 k( 49) = ( 0.1184210 0.5000000 -0.0000000), wk = 0.0034364 k( 50) = ( 0.1315790 0.5000000 -0.0000000), wk = 0.0034364 k( 51) = ( 0.1447368 0.5000000 -0.0000000), wk = 0.0034364 k( 52) = ( 0.1578947 0.5000000 -0.0000000), wk = 0.0034364 k( 53) = ( 0.1710526 0.5000000 -0.0000000), wk = 0.0034364 k( 54) = ( 0.1842105 0.5000000 -0.0000000), wk = 0.0034364 k( 55) = ( 0.1973684 0.5000000 -0.0000000), wk = 0.0034364 k( 56) = ( 0.2105263 0.5000000 -0.0000000), wk = 0.0034364 k( 57) = ( 0.2236842 0.5000000 -0.0000000), wk = 0.0034364 k( 58) = ( 0.2368421 0.5000000 -0.0000000), wk = 0.0034364 k( 59) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0034364 k( 60) = ( 0.2631579 0.5000000 -0.0000000), wk = 0.0034364 k( 61) = ( 0.2763158 0.5000000 -0.0000000), wk = 0.0034364 k( 62) = ( 0.2894737 0.5000000 -0.0000000), wk = 0.0034364 k( 63) = ( 0.3026316 0.5000000 -0.0000000), wk = 0.0034364 k( 64) = ( 0.3157895 0.5000000 -0.0000000), wk = 0.0034364 k( 65) = ( 0.3289474 0.5000000 -0.0000000), wk = 0.0034364 k( 66) = ( 0.3421053 0.5000000 -0.0000000), wk = 0.0034364 k( 67) = ( 0.3552632 0.5000000 -0.0000000), wk = 0.0034364 k( 68) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0034364 k( 69) = ( 0.3815789 0.5000000 -0.0000000), wk = 0.0034364 k( 70) = ( 0.3947368 0.5000000 -0.0000000), wk = 0.0034364 k( 71) = ( 0.4078947 0.5000000 -0.0000000), wk = 0.0034364 k( 72) = ( 0.4210526 0.5000000 -0.0000000), wk = 0.0034364 k( 73) = ( 0.4342105 0.5000000 -0.0000000), wk = 0.0034364 k( 74) = ( 0.4473684 0.5000000 -0.0000000), wk = 0.0034364 k( 75) = ( 0.4605263 0.5000000 -0.0000000), wk = 0.0034364 k( 76) = ( 0.4736842 0.5000000 -0.0000000), wk = 0.0034364 k( 77) = ( 0.4868421 0.5000000 -0.0000000), wk = 0.0034364 k( 78) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0034364 k( 79) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0034364 k( 80) = ( 0.4905660 0.4905660 -0.0000000), wk = 0.0034364 k( 81) = ( 0.4811321 0.4811321 -0.0000000), wk = 0.0034364 k( 82) = ( 0.4716981 0.4716981 -0.0000000), wk = 0.0034364 k( 83) = ( 0.4622641 0.4622641 -0.0000000), wk = 0.0034364 k( 84) = ( 0.4528302 0.4528302 -0.0000000), wk = 0.0034364 k( 85) = ( 0.4433962 0.4433962 -0.0000000), wk = 0.0034364 k( 86) = ( 0.4339623 0.4339623 -0.0000000), wk = 0.0034364 k( 87) = ( 0.4245283 0.4245283 -0.0000000), wk = 0.0034364 k( 88) = ( 0.4150943 0.4150943 -0.0000000), wk = 0.0034364 k( 89) = ( 0.4056604 0.4056604 -0.0000000), wk = 0.0034364 k( 90) = ( 0.3962264 0.3962264 -0.0000000), wk = 0.0034364 k( 91) = ( 0.3867925 0.3867924 -0.0000000), wk = 0.0034364 k( 92) = ( 0.3773585 0.3773585 -0.0000000), wk = 0.0034364 k( 93) = ( 0.3679245 0.3679245 -0.0000000), wk = 0.0034364 k( 94) = ( 0.3584906 0.3584906 -0.0000000), wk = 0.0034364 k( 95) = ( 0.3490566 0.3490566 -0.0000000), wk = 0.0034364 k( 96) = ( 0.3396226 0.3396226 -0.0000000), wk = 0.0034364 k( 97) = ( 0.3301887 0.3301887 -0.0000000), wk = 0.0034364 k( 98) = ( 0.3207547 0.3207547 -0.0000000), wk = 0.0034364 k( 99) = ( 0.3113207 0.3113207 -0.0000000), wk = 0.0034364 k( 100) = ( 0.3018868 0.3018868 -0.0000000), wk = 0.0034364 k( 101) = ( 0.2924528 0.2924528 -0.0000000), wk = 0.0034364 k( 102) = ( 0.2830189 0.2830189 -0.0000000), wk = 0.0034364 k( 103) = ( 0.2735849 0.2735849 -0.0000000), wk = 0.0034364 k( 104) = ( 0.2641509 0.2641509 -0.0000000), wk = 0.0034364 k( 105) = ( 0.2547170 0.2547170 -0.0000000), wk = 0.0034364 k( 106) = ( 0.2452830 0.2452830 -0.0000000), wk = 0.0034364 k( 107) = ( 0.2358491 0.2358491 -0.0000000), wk = 0.0034364 k( 108) = ( 0.2264151 0.2264151 -0.0000000), wk = 0.0034364 k( 109) = ( 0.2169811 0.2169811 -0.0000000), wk = 0.0034364 k( 110) = ( 0.2075472 0.2075472 -0.0000000), wk = 0.0034364 k( 111) = ( 0.1981132 0.1981132 -0.0000000), wk = 0.0034364 k( 112) = ( 0.1886792 0.1886792 -0.0000000), wk = 0.0034364 k( 113) = ( 0.1792453 0.1792453 -0.0000000), wk = 0.0034364 k( 114) = ( 0.1698113 0.1698113 -0.0000000), wk = 0.0034364 k( 115) = ( 0.1603774 0.1603774 -0.0000000), wk = 0.0034364 k( 116) = ( 0.1509434 0.1509434 -0.0000000), wk = 0.0034364 k( 117) = ( 0.1415094 0.1415094 -0.0000000), wk = 0.0034364 k( 118) = ( 0.1320755 0.1320755 -0.0000000), wk = 0.0034364 k( 119) = ( 0.1226415 0.1226415 -0.0000000), wk = 0.0034364 k( 120) = ( 0.1132076 0.1132075 -0.0000000), wk = 0.0034364 k( 121) = ( 0.1037736 0.1037736 -0.0000000), wk = 0.0034364 k( 122) = ( 0.0943396 0.0943396 -0.0000000), wk = 0.0034364 k( 123) = ( 0.0849057 0.0849057 -0.0000000), wk = 0.0034364 k( 124) = ( 0.0754717 0.0754717 -0.0000000), wk = 0.0034364 k( 125) = ( 0.0660377 0.0660377 -0.0000000), wk = 0.0034364 k( 126) = ( 0.0566038 0.0566038 -0.0000000), wk = 0.0034364 k( 127) = ( 0.0471698 0.0471698 -0.0000000), wk = 0.0034364 k( 128) = ( 0.0377359 0.0377358 -0.0000000), wk = 0.0034364 k( 129) = ( 0.0283019 0.0283019 -0.0000000), wk = 0.0034364 k( 130) = ( 0.0188679 0.0188679 -0.0000000), wk = 0.0034364 k( 131) = ( 0.0094340 0.0094340 -0.0000000), wk = 0.0034364 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 134) = ( 0.0076923 0.0076923 0.0076923), wk = 0.0034364 k( 135) = ( 0.0153846 0.0153846 0.0153846), wk = 0.0034364 k( 136) = ( 0.0230769 0.0230769 0.0230769), wk = 0.0034364 k( 137) = ( 0.0307692 0.0307692 0.0307692), wk = 0.0034364 k( 138) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0034364 k( 139) = ( 0.0461539 0.0461538 0.0461538), wk = 0.0034364 k( 140) = ( 0.0538462 0.0538461 0.0538461), wk = 0.0034364 k( 141) = ( 0.0615385 0.0615385 0.0615385), wk = 0.0034364 k( 142) = ( 0.0692308 0.0692308 0.0692308), wk = 0.0034364 k( 143) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0034364 k( 144) = ( 0.0846154 0.0846154 0.0846154), wk = 0.0034364 k( 145) = ( 0.0923077 0.0923077 0.0923077), wk = 0.0034364 k( 146) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0034364 k( 147) = ( 0.1076923 0.1076923 0.1076923), wk = 0.0034364 k( 148) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0034364 k( 149) = ( 0.1230769 0.1230769 0.1230769), wk = 0.0034364 k( 150) = ( 0.1307692 0.1307692 0.1307692), wk = 0.0034364 k( 151) = ( 0.1384615 0.1384615 0.1384615), wk = 0.0034364 k( 152) = ( 0.1461539 0.1461538 0.1461538), wk = 0.0034364 k( 153) = ( 0.1538461 0.1538461 0.1538461), wk = 0.0034364 k( 154) = ( 0.1615385 0.1615385 0.1615385), wk = 0.0034364 k( 155) = ( 0.1692308 0.1692308 0.1692308), wk = 0.0034364 k( 156) = ( 0.1769231 0.1769231 0.1769231), wk = 0.0034364 k( 157) = ( 0.1846154 0.1846154 0.1846154), wk = 0.0034364 k( 158) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0034364 k( 159) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0034364 k( 160) = ( 0.2076923 0.2076923 0.2076923), wk = 0.0034364 k( 161) = ( 0.2153846 0.2153846 0.2153846), wk = 0.0034364 k( 162) = ( 0.2230769 0.2230769 0.2230769), wk = 0.0034364 k( 163) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0034364 k( 164) = ( 0.2384615 0.2384615 0.2384615), wk = 0.0034364 k( 165) = ( 0.2461539 0.2461538 0.2461538), wk = 0.0034364 k( 166) = ( 0.2538461 0.2538461 0.2538461), wk = 0.0034364 k( 167) = ( 0.2615385 0.2615385 0.2615385), wk = 0.0034364 k( 168) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0034364 k( 169) = ( 0.2769231 0.2769231 0.2769231), wk = 0.0034364 k( 170) = ( 0.2846154 0.2846154 0.2846154), wk = 0.0034364 k( 171) = ( 0.2923077 0.2923077 0.2923077), wk = 0.0034364 k( 172) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0034364 k( 173) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0034364 k( 174) = ( 0.3153846 0.3153846 0.3153846), wk = 0.0034364 k( 175) = ( 0.3230769 0.3230769 0.3230769), wk = 0.0034364 k( 176) = ( 0.3307692 0.3307692 0.3307692), wk = 0.0034364 k( 177) = ( 0.3384615 0.3384615 0.3384615), wk = 0.0034364 k( 178) = ( 0.3461538 0.3461538 0.3461538), wk = 0.0034364 k( 179) = ( 0.3538462 0.3538461 0.3538461), wk = 0.0034364 k( 180) = ( 0.3615385 0.3615385 0.3615385), wk = 0.0034364 k( 181) = ( 0.3692308 0.3692308 0.3692308), wk = 0.0034364 k( 182) = ( 0.3769231 0.3769231 0.3769231), wk = 0.0034364 k( 183) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0034364 k( 184) = ( 0.3923077 0.3923077 0.3923077), wk = 0.0034364 k( 185) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0034364 k( 186) = ( 0.4076923 0.4076923 0.4076923), wk = 0.0034364 k( 187) = ( 0.4153846 0.4153846 0.4153846), wk = 0.0034364 k( 188) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0034364 k( 189) = ( 0.4307692 0.4307692 0.4307692), wk = 0.0034364 k( 190) = ( 0.4384615 0.4384615 0.4384615), wk = 0.0034364 k( 191) = ( 0.4461539 0.4461538 0.4461538), wk = 0.0034364 k( 192) = ( 0.4538462 0.4538461 0.4538461), wk = 0.0034364 k( 193) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0034364 k( 194) = ( 0.4692308 0.4692308 0.4692308), wk = 0.0034364 k( 195) = ( 0.4769231 0.4769231 0.4769231), wk = 0.0034364 k( 196) = ( 0.4846154 0.4846154 0.4846154), wk = 0.0034364 k( 197) = ( 0.4923077 0.4923077 0.4923077), wk = 0.0034364 k( 198) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034364 k( 199) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034364 k( 200) = ( 0.4905660 0.5000000 0.4905660), wk = 0.0034364 k( 201) = ( 0.4811321 0.5000000 0.4811321), wk = 0.0034364 k( 202) = ( 0.4716981 0.5000000 0.4716981), wk = 0.0034364 k( 203) = ( 0.4622641 0.5000000 0.4622641), wk = 0.0034364 k( 204) = ( 0.4528302 0.5000000 0.4528302), wk = 0.0034364 k( 205) = ( 0.4433962 0.5000000 0.4433962), wk = 0.0034364 k( 206) = ( 0.4339623 0.5000000 0.4339623), wk = 0.0034364 k( 207) = ( 0.4245283 0.5000000 0.4245283), wk = 0.0034364 k( 208) = ( 0.4150943 0.5000000 0.4150943), wk = 0.0034364 k( 209) = ( 0.4056604 0.5000000 0.4056604), wk = 0.0034364 k( 210) = ( 0.3962264 0.5000000 0.3962264), wk = 0.0034364 k( 211) = ( 0.3867925 0.5000000 0.3867924), wk = 0.0034364 k( 212) = ( 0.3773585 0.5000000 0.3773585), wk = 0.0034364 k( 213) = ( 0.3679245 0.5000000 0.3679245), wk = 0.0034364 k( 214) = ( 0.3584906 0.5000000 0.3584906), wk = 0.0034364 k( 215) = ( 0.3490566 0.5000000 0.3490566), wk = 0.0034364 k( 216) = ( 0.3396226 0.5000000 0.3396226), wk = 0.0034364 k( 217) = ( 0.3301887 0.5000000 0.3301887), wk = 0.0034364 k( 218) = ( 0.3207547 0.5000000 0.3207547), wk = 0.0034364 k( 219) = ( 0.3113207 0.5000000 0.3113207), wk = 0.0034364 k( 220) = ( 0.3018868 0.5000000 0.3018868), wk = 0.0034364 k( 221) = ( 0.2924528 0.5000000 0.2924528), wk = 0.0034364 k( 222) = ( 0.2830189 0.5000000 0.2830189), wk = 0.0034364 k( 223) = ( 0.2735849 0.5000000 0.2735849), wk = 0.0034364 k( 224) = ( 0.2641509 0.5000000 0.2641509), wk = 0.0034364 k( 225) = ( 0.2547170 0.5000000 0.2547170), wk = 0.0034364 k( 226) = ( 0.2452830 0.5000000 0.2452830), wk = 0.0034364 k( 227) = ( 0.2358491 0.5000000 0.2358491), wk = 0.0034364 k( 228) = ( 0.2264151 0.5000000 0.2264151), wk = 0.0034364 k( 229) = ( 0.2169811 0.5000000 0.2169811), wk = 0.0034364 k( 230) = ( 0.2075472 0.5000000 0.2075472), wk = 0.0034364 k( 231) = ( 0.1981132 0.5000000 0.1981132), wk = 0.0034364 k( 232) = ( 0.1886792 0.5000000 0.1886792), wk = 0.0034364 k( 233) = ( 0.1792453 0.5000000 0.1792453), wk = 0.0034364 k( 234) = ( 0.1698113 0.5000000 0.1698113), wk = 0.0034364 k( 235) = ( 0.1603774 0.5000000 0.1603774), wk = 0.0034364 k( 236) = ( 0.1509434 0.5000000 0.1509434), wk = 0.0034364 k( 237) = ( 0.1415094 0.5000000 0.1415094), wk = 0.0034364 k( 238) = ( 0.1320755 0.5000000 0.1320755), wk = 0.0034364 k( 239) = ( 0.1226415 0.5000000 0.1226415), wk = 0.0034364 k( 240) = ( 0.1132076 0.5000000 0.1132075), wk = 0.0034364 k( 241) = ( 0.1037736 0.5000000 0.1037736), wk = 0.0034364 k( 242) = ( 0.0943396 0.5000000 0.0943396), wk = 0.0034364 k( 243) = ( 0.0849057 0.5000000 0.0849057), wk = 0.0034364 k( 244) = ( 0.0754717 0.5000000 0.0754717), wk = 0.0034364 k( 245) = ( 0.0660377 0.5000000 0.0660377), wk = 0.0034364 k( 246) = ( 0.0566038 0.5000000 0.0566038), wk = 0.0034364 k( 247) = ( 0.0471698 0.5000000 0.0471698), wk = 0.0034364 k( 248) = ( 0.0377359 0.5000000 0.0377358), wk = 0.0034364 k( 249) = ( 0.0283019 0.5000000 0.0283019), wk = 0.0034364 k( 250) = ( 0.0188679 0.5000000 0.0188679), wk = 0.0034364 k( 251) = ( 0.0094340 0.5000000 0.0094340), wk = 0.0034364 k( 252) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034364 k( 253) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0034364 k( 254) = ( 0.5000000 0.5000000 0.0131579), wk = 0.0034364 k( 255) = ( 0.5000000 0.5000000 0.0263158), wk = 0.0034364 k( 256) = ( 0.5000000 0.5000000 0.0394737), wk = 0.0034364 k( 257) = ( 0.5000000 0.5000000 0.0526316), wk = 0.0034364 k( 258) = ( 0.5000000 0.5000000 0.0657895), wk = 0.0034364 k( 259) = ( 0.5000000 0.5000000 0.0789474), wk = 0.0034364 k( 260) = ( 0.5000000 0.5000000 0.0921053), wk = 0.0034364 k( 261) = ( 0.5000000 0.5000000 0.1052632), wk = 0.0034364 k( 262) = ( 0.5000000 0.5000000 0.1184210), wk = 0.0034364 k( 263) = ( 0.5000000 0.5000000 0.1315789), wk = 0.0034364 k( 264) = ( 0.5000000 0.5000000 0.1447368), wk = 0.0034364 k( 265) = ( 0.5000000 0.5000000 0.1578947), wk = 0.0034364 k( 266) = ( 0.5000000 0.5000000 0.1710526), wk = 0.0034364 k( 267) = ( 0.5000000 0.5000000 0.1842105), wk = 0.0034364 k( 268) = ( 0.5000000 0.5000000 0.1973684), wk = 0.0034364 k( 269) = ( 0.5000000 0.5000000 0.2105263), wk = 0.0034364 k( 270) = ( 0.5000000 0.5000000 0.2236842), wk = 0.0034364 k( 271) = ( 0.5000000 0.5000000 0.2368421), wk = 0.0034364 k( 272) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0034364 k( 273) = ( 0.5000000 0.5000000 0.2631579), wk = 0.0034364 k( 274) = ( 0.5000000 0.5000000 0.2763158), wk = 0.0034364 k( 275) = ( 0.5000000 0.5000000 0.2894737), wk = 0.0034364 k( 276) = ( 0.5000000 0.5000000 0.3026316), wk = 0.0034364 k( 277) = ( 0.5000000 0.5000000 0.3157895), wk = 0.0034364 k( 278) = ( 0.5000000 0.5000000 0.3289474), wk = 0.0034364 k( 279) = ( 0.5000000 0.5000000 0.3421053), wk = 0.0034364 k( 280) = ( 0.5000000 0.5000000 0.3552632), wk = 0.0034364 k( 281) = ( 0.5000000 0.5000000 0.3684210), wk = 0.0034364 k( 282) = ( 0.5000000 0.5000000 0.3815789), wk = 0.0034364 k( 283) = ( 0.5000000 0.5000000 0.3947368), wk = 0.0034364 k( 284) = ( 0.5000000 0.5000000 0.4078947), wk = 0.0034364 k( 285) = ( 0.5000000 0.5000000 0.4210526), wk = 0.0034364 k( 286) = ( 0.5000000 0.5000000 0.4342105), wk = 0.0034364 k( 287) = ( 0.5000000 0.5000000 0.4473684), wk = 0.0034364 k( 288) = ( 0.5000000 0.5000000 0.4605263), wk = 0.0034364 k( 289) = ( 0.5000000 0.5000000 0.4736842), wk = 0.0034364 k( 290) = ( 0.5000000 0.5000000 0.4868421), wk = 0.0034364 k( 291) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034364 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 2) = ( 0.0000000 0.0131579 0.0000000), wk = 0.0034364 k( 3) = ( 0.0000000 0.0263158 0.0000000), wk = 0.0034364 k( 4) = ( 0.0000000 0.0394737 0.0000000), wk = 0.0034364 k( 5) = ( 0.0000000 0.0526316 0.0000000), wk = 0.0034364 k( 6) = ( 0.0000000 0.0657895 0.0000000), wk = 0.0034364 k( 7) = ( 0.0000000 0.0789474 0.0000000), wk = 0.0034364 k( 8) = ( 0.0000000 0.0921053 0.0000000), wk = 0.0034364 k( 9) = ( 0.0000000 0.1052632 0.0000000), wk = 0.0034364 k( 10) = ( 0.0000000 0.1184210 0.0000000), wk = 0.0034364 k( 11) = ( 0.0000000 0.1315790 0.0000000), wk = 0.0034364 k( 12) = ( 0.0000000 0.1447368 0.0000000), wk = 0.0034364 k( 13) = ( 0.0000000 0.1578947 0.0000000), wk = 0.0034364 k( 14) = ( 0.0000000 0.1710526 0.0000000), wk = 0.0034364 k( 15) = ( 0.0000000 0.1842105 0.0000000), wk = 0.0034364 k( 16) = ( 0.0000000 0.1973684 0.0000000), wk = 0.0034364 k( 17) = ( 0.0000000 0.2105263 0.0000000), wk = 0.0034364 k( 18) = ( 0.0000000 0.2236842 0.0000000), wk = 0.0034364 k( 19) = ( 0.0000000 0.2368421 0.0000000), wk = 0.0034364 k( 20) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0034364 k( 21) = ( 0.0000000 0.2631579 0.0000000), wk = 0.0034364 k( 22) = ( 0.0000000 0.2763158 0.0000000), wk = 0.0034364 k( 23) = ( 0.0000000 0.2894737 0.0000000), wk = 0.0034364 k( 24) = ( 0.0000000 0.3026316 0.0000000), wk = 0.0034364 k( 25) = ( 0.0000000 0.3157895 0.0000000), wk = 0.0034364 k( 26) = ( 0.0000000 0.3289474 0.0000000), wk = 0.0034364 k( 27) = ( 0.0000000 0.3421053 0.0000000), wk = 0.0034364 k( 28) = ( 0.0000000 0.3552632 0.0000000), wk = 0.0034364 k( 29) = ( 0.0000000 0.3684211 0.0000000), wk = 0.0034364 k( 30) = ( 0.0000000 0.3815789 0.0000000), wk = 0.0034364 k( 31) = ( 0.0000000 0.3947368 0.0000000), wk = 0.0034364 k( 32) = ( 0.0000000 0.4078947 0.0000000), wk = 0.0034364 k( 33) = ( 0.0000000 0.4210526 0.0000000), wk = 0.0034364 k( 34) = ( 0.0000000 0.4342105 0.0000000), wk = 0.0034364 k( 35) = ( 0.0000000 0.4473684 0.0000000), wk = 0.0034364 k( 36) = ( 0.0000000 0.4605263 0.0000000), wk = 0.0034364 k( 37) = ( 0.0000000 0.4736842 0.0000000), wk = 0.0034364 k( 38) = ( 0.0000000 0.4868421 0.0000000), wk = 0.0034364 k( 39) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0034364 k( 40) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0034364 k( 41) = ( 0.0131579 0.5000000 0.0000000), wk = 0.0034364 k( 42) = ( 0.0263158 0.5000000 0.0000000), wk = 0.0034364 k( 43) = ( 0.0394737 0.5000000 0.0000000), wk = 0.0034364 k( 44) = ( 0.0526316 0.5000000 0.0000000), wk = 0.0034364 k( 45) = ( 0.0657895 0.5000000 0.0000000), wk = 0.0034364 k( 46) = ( 0.0789474 0.5000000 0.0000000), wk = 0.0034364 k( 47) = ( 0.0921053 0.5000000 0.0000000), wk = 0.0034364 k( 48) = ( 0.1052632 0.5000000 0.0000000), wk = 0.0034364 k( 49) = ( 0.1184210 0.5000000 0.0000000), wk = 0.0034364 k( 50) = ( 0.1315790 0.5000000 0.0000000), wk = 0.0034364 k( 51) = ( 0.1447368 0.5000000 0.0000000), wk = 0.0034364 k( 52) = ( 0.1578947 0.5000000 0.0000000), wk = 0.0034364 k( 53) = ( 0.1710526 0.5000000 0.0000000), wk = 0.0034364 k( 54) = ( 0.1842105 0.5000000 0.0000000), wk = 0.0034364 k( 55) = ( 0.1973684 0.5000000 0.0000000), wk = 0.0034364 k( 56) = ( 0.2105263 0.5000000 0.0000000), wk = 0.0034364 k( 57) = ( 0.2236842 0.5000000 0.0000000), wk = 0.0034364 k( 58) = ( 0.2368421 0.5000000 0.0000000), wk = 0.0034364 k( 59) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0034364 k( 60) = ( 0.2631579 0.5000000 0.0000000), wk = 0.0034364 k( 61) = ( 0.2763158 0.5000000 0.0000000), wk = 0.0034364 k( 62) = ( 0.2894737 0.5000000 0.0000000), wk = 0.0034364 k( 63) = ( 0.3026316 0.5000000 0.0000000), wk = 0.0034364 k( 64) = ( 0.3157895 0.5000000 0.0000000), wk = 0.0034364 k( 65) = ( 0.3289474 0.5000000 0.0000000), wk = 0.0034364 k( 66) = ( 0.3421053 0.5000000 0.0000000), wk = 0.0034364 k( 67) = ( 0.3552632 0.5000000 0.0000000), wk = 0.0034364 k( 68) = ( 0.3684211 0.5000000 0.0000000), wk = 0.0034364 k( 69) = ( 0.3815789 0.5000000 0.0000000), wk = 0.0034364 k( 70) = ( 0.3947368 0.5000000 0.0000000), wk = 0.0034364 k( 71) = ( 0.4078947 0.5000000 0.0000000), wk = 0.0034364 k( 72) = ( 0.4210526 0.5000000 0.0000000), wk = 0.0034364 k( 73) = ( 0.4342105 0.5000000 -0.0000000), wk = 0.0034364 k( 74) = ( 0.4473684 0.5000000 0.0000000), wk = 0.0034364 k( 75) = ( 0.4605263 0.5000000 0.0000000), wk = 0.0034364 k( 76) = ( 0.4736842 0.5000000 0.0000000), wk = 0.0034364 k( 77) = ( 0.4868421 0.5000000 0.0000000), wk = 0.0034364 k( 78) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0034364 k( 79) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0034364 k( 80) = ( 0.4905660 0.4905660 0.0000000), wk = 0.0034364 k( 81) = ( 0.4811321 0.4811321 0.0000000), wk = 0.0034364 k( 82) = ( 0.4716981 0.4716981 0.0000000), wk = 0.0034364 k( 83) = ( 0.4622641 0.4622641 0.0000000), wk = 0.0034364 k( 84) = ( 0.4528302 0.4528302 0.0000000), wk = 0.0034364 k( 85) = ( 0.4433962 0.4433962 0.0000000), wk = 0.0034364 k( 86) = ( 0.4339623 0.4339623 0.0000000), wk = 0.0034364 k( 87) = ( 0.4245283 0.4245283 0.0000000), wk = 0.0034364 k( 88) = ( 0.4150943 0.4150943 0.0000000), wk = 0.0034364 k( 89) = ( 0.4056604 0.4056604 0.0000000), wk = 0.0034364 k( 90) = ( 0.3962264 0.3962264 0.0000000), wk = 0.0034364 k( 91) = ( 0.3867925 0.3867925 0.0000000), wk = 0.0034364 k( 92) = ( 0.3773585 0.3773585 0.0000000), wk = 0.0034364 k( 93) = ( 0.3679245 0.3679245 0.0000000), wk = 0.0034364 k( 94) = ( 0.3584906 0.3584906 0.0000000), wk = 0.0034364 k( 95) = ( 0.3490566 0.3490566 0.0000000), wk = 0.0034364 k( 96) = ( 0.3396226 0.3396226 0.0000000), wk = 0.0034364 k( 97) = ( 0.3301887 0.3301887 0.0000000), wk = 0.0034364 k( 98) = ( 0.3207547 0.3207547 0.0000000), wk = 0.0034364 k( 99) = ( 0.3113207 0.3113207 0.0000000), wk = 0.0034364 k( 100) = ( 0.3018868 0.3018868 0.0000000), wk = 0.0034364 k( 101) = ( 0.2924528 0.2924528 0.0000000), wk = 0.0034364 k( 102) = ( 0.2830189 0.2830189 0.0000000), wk = 0.0034364 k( 103) = ( 0.2735849 0.2735849 0.0000000), wk = 0.0034364 k( 104) = ( 0.2641509 0.2641509 0.0000000), wk = 0.0034364 k( 105) = ( 0.2547170 0.2547170 0.0000000), wk = 0.0034364 k( 106) = ( 0.2452830 0.2452830 0.0000000), wk = 0.0034364 k( 107) = ( 0.2358491 0.2358491 0.0000000), wk = 0.0034364 k( 108) = ( 0.2264151 0.2264151 0.0000000), wk = 0.0034364 k( 109) = ( 0.2169811 0.2169811 0.0000000), wk = 0.0034364 k( 110) = ( 0.2075472 0.2075472 0.0000000), wk = 0.0034364 k( 111) = ( 0.1981132 0.1981132 0.0000000), wk = 0.0034364 k( 112) = ( 0.1886792 0.1886792 0.0000000), wk = 0.0034364 k( 113) = ( 0.1792453 0.1792453 0.0000000), wk = 0.0034364 k( 114) = ( 0.1698113 0.1698113 0.0000000), wk = 0.0034364 k( 115) = ( 0.1603774 0.1603774 0.0000000), wk = 0.0034364 k( 116) = ( 0.1509434 0.1509434 0.0000000), wk = 0.0034364 k( 117) = ( 0.1415094 0.1415094 0.0000000), wk = 0.0034364 k( 118) = ( 0.1320755 0.1320755 0.0000000), wk = 0.0034364 k( 119) = ( 0.1226415 0.1226415 0.0000000), wk = 0.0034364 k( 120) = ( 0.1132076 0.1132076 0.0000000), wk = 0.0034364 k( 121) = ( 0.1037736 0.1037736 0.0000000), wk = 0.0034364 k( 122) = ( 0.0943396 0.0943396 0.0000000), wk = 0.0034364 k( 123) = ( 0.0849057 0.0849057 0.0000000), wk = 0.0034364 k( 124) = ( 0.0754717 0.0754717 0.0000000), wk = 0.0034364 k( 125) = ( 0.0660377 0.0660377 0.0000000), wk = 0.0034364 k( 126) = ( 0.0566038 0.0566038 0.0000000), wk = 0.0034364 k( 127) = ( 0.0471698 0.0471698 0.0000000), wk = 0.0034364 k( 128) = ( 0.0377359 0.0377359 0.0000000), wk = 0.0034364 k( 129) = ( 0.0283019 0.0283019 0.0000000), wk = 0.0034364 k( 130) = ( 0.0188679 0.0188679 0.0000000), wk = 0.0034364 k( 131) = ( 0.0094340 0.0094340 0.0000000), wk = 0.0034364 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 134) = ( 0.0076923 0.0076923 0.0076923), wk = 0.0034364 k( 135) = ( 0.0153846 0.0153846 0.0153846), wk = 0.0034364 k( 136) = ( 0.0230769 0.0230769 0.0230769), wk = 0.0034364 k( 137) = ( 0.0307692 0.0307692 0.0307692), wk = 0.0034364 k( 138) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0034364 k( 139) = ( 0.0461539 0.0461539 0.0461539), wk = 0.0034364 k( 140) = ( 0.0538462 0.0538462 0.0538462), wk = 0.0034364 k( 141) = ( 0.0615385 0.0615385 0.0615385), wk = 0.0034364 k( 142) = ( 0.0692308 0.0692308 0.0692308), wk = 0.0034364 k( 143) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0034364 k( 144) = ( 0.0846154 0.0846154 0.0846154), wk = 0.0034364 k( 145) = ( 0.0923077 0.0923077 0.0923077), wk = 0.0034364 k( 146) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0034364 k( 147) = ( 0.1076923 0.1076923 0.1076923), wk = 0.0034364 k( 148) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0034364 k( 149) = ( 0.1230769 0.1230769 0.1230769), wk = 0.0034364 k( 150) = ( 0.1307692 0.1307692 0.1307692), wk = 0.0034364 k( 151) = ( 0.1384615 0.1384615 0.1384615), wk = 0.0034364 k( 152) = ( 0.1461539 0.1461539 0.1461539), wk = 0.0034364 k( 153) = ( 0.1538461 0.1538461 0.1538461), wk = 0.0034364 k( 154) = ( 0.1615385 0.1615385 0.1615385), wk = 0.0034364 k( 155) = ( 0.1692308 0.1692308 0.1692308), wk = 0.0034364 k( 156) = ( 0.1769231 0.1769231 0.1769231), wk = 0.0034364 k( 157) = ( 0.1846154 0.1846154 0.1846154), wk = 0.0034364 k( 158) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0034364 k( 159) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0034364 k( 160) = ( 0.2076923 0.2076923 0.2076923), wk = 0.0034364 k( 161) = ( 0.2153846 0.2153846 0.2153846), wk = 0.0034364 k( 162) = ( 0.2230769 0.2230769 0.2230769), wk = 0.0034364 k( 163) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0034364 k( 164) = ( 0.2384615 0.2384615 0.2384615), wk = 0.0034364 k( 165) = ( 0.2461539 0.2461539 0.2461539), wk = 0.0034364 k( 166) = ( 0.2538461 0.2538461 0.2538461), wk = 0.0034364 k( 167) = ( 0.2615385 0.2615385 0.2615385), wk = 0.0034364 k( 168) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0034364 k( 169) = ( 0.2769231 0.2769231 0.2769231), wk = 0.0034364 k( 170) = ( 0.2846154 0.2846154 0.2846154), wk = 0.0034364 k( 171) = ( 0.2923077 0.2923077 0.2923077), wk = 0.0034364 k( 172) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0034364 k( 173) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0034364 k( 174) = ( 0.3153846 0.3153846 0.3153846), wk = 0.0034364 k( 175) = ( 0.3230769 0.3230769 0.3230769), wk = 0.0034364 k( 176) = ( 0.3307692 0.3307692 0.3307692), wk = 0.0034364 k( 177) = ( 0.3384615 0.3384615 0.3384615), wk = 0.0034364 k( 178) = ( 0.3461538 0.3461538 0.3461538), wk = 0.0034364 k( 179) = ( 0.3538462 0.3538462 0.3538462), wk = 0.0034364 k( 180) = ( 0.3615385 0.3615385 0.3615385), wk = 0.0034364 k( 181) = ( 0.3692308 0.3692308 0.3692308), wk = 0.0034364 k( 182) = ( 0.3769231 0.3769231 0.3769231), wk = 0.0034364 k( 183) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0034364 k( 184) = ( 0.3923077 0.3923077 0.3923077), wk = 0.0034364 k( 185) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0034364 k( 186) = ( 0.4076923 0.4076923 0.4076923), wk = 0.0034364 k( 187) = ( 0.4153846 0.4153846 0.4153846), wk = 0.0034364 k( 188) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0034364 k( 189) = ( 0.4307692 0.4307692 0.4307692), wk = 0.0034364 k( 190) = ( 0.4384615 0.4384615 0.4384615), wk = 0.0034364 k( 191) = ( 0.4461539 0.4461539 0.4461539), wk = 0.0034364 k( 192) = ( 0.4538462 0.4538462 0.4538462), wk = 0.0034364 k( 193) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0034364 k( 194) = ( 0.4692308 0.4692308 0.4692308), wk = 0.0034364 k( 195) = ( 0.4769231 0.4769231 0.4769231), wk = 0.0034364 k( 196) = ( 0.4846154 0.4846154 0.4846154), wk = 0.0034364 k( 197) = ( 0.4923077 0.4923077 0.4923077), wk = 0.0034364 k( 198) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034364 k( 199) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034364 k( 200) = ( 0.4905660 0.5000000 0.4905660), wk = 0.0034364 k( 201) = ( 0.4811321 0.5000000 0.4811321), wk = 0.0034364 k( 202) = ( 0.4716981 0.5000000 0.4716981), wk = 0.0034364 k( 203) = ( 0.4622641 0.5000000 0.4622641), wk = 0.0034364 k( 204) = ( 0.4528302 0.5000000 0.4528302), wk = 0.0034364 k( 205) = ( 0.4433962 0.5000000 0.4433962), wk = 0.0034364 k( 206) = ( 0.4339623 0.5000000 0.4339623), wk = 0.0034364 k( 207) = ( 0.4245283 0.5000000 0.4245283), wk = 0.0034364 k( 208) = ( 0.4150943 0.5000000 0.4150943), wk = 0.0034364 k( 209) = ( 0.4056604 0.5000000 0.4056604), wk = 0.0034364 k( 210) = ( 0.3962264 0.5000000 0.3962264), wk = 0.0034364 k( 211) = ( 0.3867925 0.5000000 0.3867925), wk = 0.0034364 k( 212) = ( 0.3773585 0.5000000 0.3773585), wk = 0.0034364 k( 213) = ( 0.3679245 0.5000000 0.3679245), wk = 0.0034364 k( 214) = ( 0.3584906 0.5000000 0.3584906), wk = 0.0034364 k( 215) = ( 0.3490566 0.5000000 0.3490566), wk = 0.0034364 k( 216) = ( 0.3396226 0.5000000 0.3396226), wk = 0.0034364 k( 217) = ( 0.3301887 0.5000000 0.3301887), wk = 0.0034364 k( 218) = ( 0.3207547 0.5000000 0.3207547), wk = 0.0034364 k( 219) = ( 0.3113207 0.5000000 0.3113207), wk = 0.0034364 k( 220) = ( 0.3018868 0.5000000 0.3018868), wk = 0.0034364 k( 221) = ( 0.2924528 0.5000000 0.2924528), wk = 0.0034364 k( 222) = ( 0.2830189 0.5000000 0.2830189), wk = 0.0034364 k( 223) = ( 0.2735849 0.5000000 0.2735849), wk = 0.0034364 k( 224) = ( 0.2641509 0.5000000 0.2641509), wk = 0.0034364 k( 225) = ( 0.2547170 0.5000000 0.2547170), wk = 0.0034364 k( 226) = ( 0.2452830 0.5000000 0.2452830), wk = 0.0034364 k( 227) = ( 0.2358491 0.5000000 0.2358491), wk = 0.0034364 k( 228) = ( 0.2264151 0.5000000 0.2264151), wk = 0.0034364 k( 229) = ( 0.2169811 0.5000000 0.2169811), wk = 0.0034364 k( 230) = ( 0.2075472 0.5000000 0.2075472), wk = 0.0034364 k( 231) = ( 0.1981132 0.5000000 0.1981132), wk = 0.0034364 k( 232) = ( 0.1886792 0.5000000 0.1886792), wk = 0.0034364 k( 233) = ( 0.1792453 0.5000000 0.1792453), wk = 0.0034364 k( 234) = ( 0.1698113 0.5000000 0.1698113), wk = 0.0034364 k( 235) = ( 0.1603774 0.5000000 0.1603774), wk = 0.0034364 k( 236) = ( 0.1509434 0.5000000 0.1509434), wk = 0.0034364 k( 237) = ( 0.1415094 0.5000000 0.1415094), wk = 0.0034364 k( 238) = ( 0.1320755 0.5000000 0.1320755), wk = 0.0034364 k( 239) = ( 0.1226415 0.5000000 0.1226415), wk = 0.0034364 k( 240) = ( 0.1132076 0.5000000 0.1132076), wk = 0.0034364 k( 241) = ( 0.1037736 0.5000000 0.1037736), wk = 0.0034364 k( 242) = ( 0.0943396 0.5000000 0.0943396), wk = 0.0034364 k( 243) = ( 0.0849057 0.5000000 0.0849057), wk = 0.0034364 k( 244) = ( 0.0754717 0.5000000 0.0754717), wk = 0.0034364 k( 245) = ( 0.0660377 0.5000000 0.0660377), wk = 0.0034364 k( 246) = ( 0.0566038 0.5000000 0.0566038), wk = 0.0034364 k( 247) = ( 0.0471698 0.5000000 0.0471698), wk = 0.0034364 k( 248) = ( 0.0377359 0.5000000 0.0377359), wk = 0.0034364 k( 249) = ( 0.0283019 0.5000000 0.0283019), wk = 0.0034364 k( 250) = ( 0.0188679 0.5000000 0.0188679), wk = 0.0034364 k( 251) = ( 0.0094340 0.5000000 0.0094340), wk = 0.0034364 k( 252) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0034364 k( 253) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0034364 k( 254) = ( 0.5000000 0.5000000 0.0131579), wk = 0.0034364 k( 255) = ( 0.5000000 0.5000000 0.0263158), wk = 0.0034364 k( 256) = ( 0.5000000 0.5000000 0.0394737), wk = 0.0034364 k( 257) = ( 0.5000000 0.5000000 0.0526316), wk = 0.0034364 k( 258) = ( 0.5000000 0.5000000 0.0657895), wk = 0.0034364 k( 259) = ( 0.5000000 0.5000000 0.0789474), wk = 0.0034364 k( 260) = ( 0.5000000 0.5000000 0.0921053), wk = 0.0034364 k( 261) = ( 0.5000000 0.5000000 0.1052632), wk = 0.0034364 k( 262) = ( 0.5000000 0.5000000 0.1184210), wk = 0.0034364 k( 263) = ( 0.5000000 0.5000000 0.1315790), wk = 0.0034364 k( 264) = ( 0.5000000 0.5000000 0.1447368), wk = 0.0034364 k( 265) = ( 0.5000000 0.5000000 0.1578947), wk = 0.0034364 k( 266) = ( 0.5000000 0.5000000 0.1710526), wk = 0.0034364 k( 267) = ( 0.5000000 0.5000000 0.1842105), wk = 0.0034364 k( 268) = ( 0.5000000 0.5000000 0.1973684), wk = 0.0034364 k( 269) = ( 0.5000000 0.5000000 0.2105263), wk = 0.0034364 k( 270) = ( 0.5000000 0.5000000 0.2236842), wk = 0.0034364 k( 271) = ( 0.5000000 0.5000000 0.2368421), wk = 0.0034364 k( 272) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0034364 k( 273) = ( 0.5000000 0.5000000 0.2631579), wk = 0.0034364 k( 274) = ( 0.5000000 0.5000000 0.2763158), wk = 0.0034364 k( 275) = ( 0.5000000 0.5000000 0.2894737), wk = 0.0034364 k( 276) = ( 0.5000000 0.5000000 0.3026316), wk = 0.0034364 k( 277) = ( 0.5000000 0.5000000 0.3157895), wk = 0.0034364 k( 278) = ( 0.5000000 0.5000000 0.3289474), wk = 0.0034364 k( 279) = ( 0.5000000 0.5000000 0.3421053), wk = 0.0034364 k( 280) = ( 0.5000000 0.5000000 0.3552632), wk = 0.0034364 k( 281) = ( 0.5000000 0.5000000 0.3684211), wk = 0.0034364 k( 282) = ( 0.5000000 0.5000000 0.3815789), wk = 0.0034364 k( 283) = ( 0.5000000 0.5000000 0.3947368), wk = 0.0034364 k( 284) = ( 0.5000000 0.5000000 0.4078947), wk = 0.0034364 k( 285) = ( 0.5000000 0.5000000 0.4210526), wk = 0.0034364 k( 286) = ( 0.5000000 0.5000000 0.4342105), wk = 0.0034364 k( 287) = ( 0.5000000 0.5000000 0.4473684), wk = 0.0034364 k( 288) = ( 0.5000000 0.5000000 0.4605263), wk = 0.0034364 k( 289) = ( 0.5000000 0.5000000 0.4736842), wk = 0.0034364 k( 290) = ( 0.5000000 0.5000000 0.4868421), wk = 0.0034364 k( 291) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034364 Dense grid: 64589 G-vectors FFT dimensions: ( 50, 50, 50) Smooth grid: 31103 G-vectors FFT dimensions: ( 40, 40, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.23 Mb ( 222, 68) NL pseudopotentials 0.17 Mb ( 111, 98) Each V/rho on FFT grid 0.08 Mb ( 5000) Each G-vector array 0.01 Mb ( 1794) G-vector shells 0.00 Mb ( 405) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.92 Mb ( 222, 272) Each subspace H/S matrix 0.07 Mb ( 68, 68) Each matrix 0.20 Mb ( 98, 2, 68) Check: negative/imaginary core charge= -0.000021 0.000000 The potential is recalculated from file : ./Mg3NF3.save/charge-density.dat Starting wfc are 62 randomized atomic wfcs + 6 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.0 secs Computing kpt #: 2 total cpu time spent up to now is 2.5 secs Computing kpt #: 3 total cpu time spent up to now is 3.0 secs Computing kpt #: 4 total cpu time spent up to now is 3.5 secs Computing kpt #: 5 total cpu time spent up to now is 3.9 secs Computing kpt #: 6 total cpu time spent up to now is 4.4 secs Computing kpt #: 7 total cpu time spent up to now is 4.9 secs Computing kpt #: 8 total cpu time spent up to now is 5.4 secs Computing kpt #: 9 total cpu time spent up to now is 5.8 secs Computing kpt #: 10 total cpu time spent up to now is 6.3 secs Computing kpt #: 11 total cpu time spent up to now is 6.8 secs Computing kpt #: 12 total cpu time spent up to now is 7.2 secs Computing kpt #: 13 total cpu time spent up to now is 7.7 secs Computing kpt #: 14 total cpu time spent up to now is 8.2 secs Computing kpt #: 15 total cpu time spent up to now is 8.7 secs Computing kpt #: 16 total cpu time spent up to now is 9.2 secs Computing kpt #: 17 total cpu time spent up to now is 9.7 secs Computing kpt #: 18 total cpu time spent up to now is 10.2 secs Computing kpt #: 19 total cpu time spent up to now is 10.6 secs Computing kpt #: 20 total cpu time spent up to now is 11.1 secs Computing kpt #: 21 total cpu time spent up to now is 11.6 secs Computing kpt #: 22 total cpu time spent up to now is 12.0 secs Computing kpt #: 23 total cpu time spent up to now is 12.5 secs Computing kpt #: 24 total cpu time spent up to now is 13.0 secs Computing kpt #: 25 total cpu time spent up to now is 13.4 secs Computing kpt #: 26 total cpu time spent up to now is 13.9 secs Computing kpt #: 27 total cpu time spent up to now is 14.3 secs Computing kpt #: 28 total cpu time spent up to now is 14.8 secs Computing kpt #: 29 total cpu time spent up to now is 15.3 secs Computing kpt #: 30 total cpu time spent up to now is 15.8 secs Computing kpt #: 31 total cpu time spent up to now is 16.3 secs Computing kpt #: 32 total cpu time spent up to now is 16.7 secs Computing kpt #: 33 total cpu time spent up to now is 17.2 secs Computing kpt #: 34 total cpu time spent up to now is 17.7 secs Computing kpt #: 35 total cpu time spent up to now is 18.2 secs Computing kpt #: 36 total cpu time spent up to now is 18.6 secs Computing kpt #: 37 total cpu time spent up to now is 19.1 secs Computing kpt #: 38 total cpu time spent up to now is 19.6 secs Computing kpt #: 39 total cpu time spent up to now is 20.2 secs Computing kpt #: 40 total cpu time spent up to now is 20.7 secs Computing kpt #: 41 total cpu time spent up to now is 21.2 secs Computing kpt #: 42 total cpu time spent up to now is 21.7 secs Computing kpt #: 43 total cpu time spent up to now is 22.2 secs Computing kpt #: 44 total cpu time spent up to now is 22.7 secs Computing kpt #: 45 total cpu time spent up to now is 23.1 secs Computing kpt #: 46 total cpu time spent up to now is 23.6 secs Computing kpt #: 47 total cpu time spent up to now is 24.1 secs Computing kpt #: 48 total cpu time spent up to now is 24.5 secs Computing kpt #: 49 total cpu time spent up to now is 25.0 secs Computing kpt #: 50 total cpu time spent up to now is 25.4 secs Computing kpt #: 51 total cpu time spent up to now is 25.8 secs Computing kpt #: 52 total cpu time spent up to now is 26.3 secs Computing kpt #: 53 total cpu time spent up to now is 26.7 secs Computing kpt #: 54 total cpu time spent up to now is 27.1 secs Computing kpt #: 55 total cpu time spent up to now is 27.6 secs Computing kpt #: 56 total cpu time spent up to now is 28.0 secs Computing kpt #: 57 total cpu time spent up to now is 28.5 secs Computing kpt #: 58 total cpu time spent up to now is 28.9 secs Computing kpt #: 59 total cpu time spent up to now is 29.3 secs Computing kpt #: 60 total cpu time spent up to now is 29.7 secs Computing kpt #: 61 total cpu time spent up to now is 30.2 secs Computing kpt #: 62 total cpu time spent up to now is 30.6 secs Computing kpt #: 63 total cpu time spent up to now is 31.0 secs Computing kpt #: 64 total cpu time spent up to now is 31.5 secs Computing kpt #: 65 total cpu time spent up to now is 31.9 secs Computing kpt #: 66 total cpu time spent up to now is 32.3 secs Computing kpt #: 67 total cpu time spent up to now is 32.7 secs Computing kpt #: 68 total cpu time spent up to now is 33.1 secs Computing kpt #: 69 total cpu time spent up to now is 33.6 secs Computing kpt #: 70 total cpu time spent up to now is 34.0 secs Computing kpt #: 71 total cpu time spent up to now is 34.4 secs Computing kpt #: 72 total cpu time spent up to now is 34.8 secs Computing kpt #: 73 total cpu time spent up to now is 35.2 secs Computing kpt #: 74 total cpu time spent up to now is 35.6 secs Computing kpt #: 75 total cpu time spent up to now is 36.0 secs Computing kpt #: 76 total cpu time spent up to now is 36.4 secs Computing kpt #: 77 total cpu time spent up to now is 36.8 secs Computing kpt #: 78 total cpu time spent up to now is 37.3 secs Computing kpt #: 79 total cpu time spent up to now is 37.7 secs Computing kpt #: 80 total cpu time spent up to now is 38.1 secs Computing kpt #: 81 total cpu time spent up to now is 38.5 secs Computing kpt #: 82 total cpu time spent up to now is 38.9 secs Computing kpt #: 83 total cpu time spent up to now is 39.3 secs Computing kpt #: 84 total cpu time spent up to now is 39.7 secs Computing kpt #: 85 total cpu time spent up to now is 40.1 secs Computing kpt #: 86 total cpu time spent up to now is 40.5 secs Computing kpt #: 87 total cpu time spent up to now is 40.9 secs Computing kpt #: 88 total cpu time spent up to now is 41.4 secs Computing kpt #: 89 total cpu time spent up to now is 41.8 secs Computing kpt #: 90 total cpu time spent up to now is 42.2 secs Computing kpt #: 91 total cpu time spent up to now is 42.6 secs Computing kpt #: 92 total cpu time spent up to now is 43.1 secs Computing kpt #: 93 total cpu time spent up to now is 43.5 secs Computing kpt #: 94 total cpu time spent up to now is 43.9 secs Computing kpt #: 95 total cpu time spent up to now is 44.4 secs Computing kpt #: 96 total cpu time spent up to now is 44.8 secs Computing kpt #: 97 total cpu time spent up to now is 45.3 secs Computing kpt #: 98 total cpu time spent up to now is 45.7 secs Computing kpt #: 99 total cpu time spent up to now is 46.2 secs Computing kpt #: 100 total cpu time spent up to now is 46.7 secs Computing kpt #: 101 total cpu time spent up to now is 47.2 secs Computing kpt #: 102 total cpu time spent up to now is 47.6 secs Computing kpt #: 103 total cpu time spent up to now is 48.1 secs Computing kpt #: 104 total cpu time spent up to now is 48.5 secs Computing kpt #: 105 total cpu time spent up to now is 49.0 secs Computing kpt #: 106 total cpu time spent up to now is 49.5 secs Computing kpt #: 107 total cpu time spent up to now is 49.9 secs Computing kpt #: 108 total cpu time spent up to now is 50.4 secs Computing kpt #: 109 total cpu time spent up to now is 50.8 secs Computing kpt #: 110 total cpu time spent up to now is 51.3 secs Computing kpt #: 111 total cpu time spent up to now is 51.7 secs Computing kpt #: 112 total cpu time spent up to now is 52.2 secs Computing kpt #: 113 total cpu time spent up to now is 52.6 secs Computing kpt #: 114 total cpu time spent up to now is 53.1 secs Computing kpt #: 115 total cpu time spent up to now is 53.6 secs Computing kpt #: 116 total cpu time spent up to now is 54.0 secs Computing kpt #: 117 total cpu time spent up to now is 54.5 secs Computing kpt #: 118 total cpu time spent up to now is 55.0 secs Computing kpt #: 119 total cpu time spent up to now is 55.4 secs Computing kpt #: 120 total cpu time spent up to now is 55.9 secs Computing kpt #: 121 total cpu time spent up to now is 56.4 secs Computing kpt #: 122 total cpu time spent up to now is 56.9 secs Computing kpt #: 123 total cpu time spent up to now is 57.4 secs Computing kpt #: 124 total cpu time spent up to now is 57.9 secs Computing kpt #: 125 total cpu time spent up to now is 58.4 secs Computing kpt #: 126 total cpu time spent up to now is 58.9 secs Computing kpt #: 127 total cpu time spent up to now is 59.4 secs Computing kpt #: 128 total cpu time spent up to now is 59.8 secs Computing kpt #: 129 total cpu time spent up to now is 60.3 secs Computing kpt #: 130 total cpu time spent up to now is 60.8 secs Computing kpt #: 131 total cpu time spent up to now is 61.3 secs Computing kpt #: 132 total cpu time spent up to now is 61.8 secs Computing kpt #: 133 total cpu time spent up to now is 62.3 secs Computing kpt #: 134 total cpu time spent up to now is 62.8 secs Computing kpt #: 135 total cpu time spent up to now is 63.2 secs Computing kpt #: 136 total cpu time spent up to now is 63.7 secs Computing kpt #: 137 total cpu time spent up to now is 64.2 secs Computing kpt #: 138 total cpu time spent up to now is 64.6 secs Computing kpt #: 139 total cpu time spent up to now is 65.1 secs Computing kpt #: 140 total cpu time spent up to now is 65.6 secs Computing kpt #: 141 total cpu time spent up to now is 66.1 secs Computing kpt #: 142 total cpu time spent up to now is 66.6 secs Computing kpt #: 143 total cpu time spent up to now is 67.1 secs Computing kpt #: 144 total cpu time spent up to now is 67.5 secs Computing kpt #: 145 total cpu time spent up to now is 68.0 secs Computing kpt #: 146 total cpu time spent up to now is 68.4 secs Computing kpt #: 147 total cpu time spent up to now is 68.9 secs Computing kpt #: 148 total cpu time spent up to now is 69.3 secs Computing kpt #: 149 total cpu time spent up to now is 69.8 secs Computing kpt #: 150 total cpu time spent up to now is 70.2 secs Computing kpt #: 151 total cpu time spent up to now is 70.7 secs Computing kpt #: 152 total cpu time spent up to now is 71.1 secs Computing kpt #: 153 total cpu time spent up to now is 71.6 secs Computing kpt #: 154 total cpu time spent up to now is 72.0 secs Computing kpt #: 155 total cpu time spent up to now is 72.4 secs Computing kpt #: 156 total cpu time spent up to now is 72.9 secs Computing kpt #: 157 total cpu time spent up to now is 73.3 secs Computing kpt #: 158 total cpu time spent up to now is 73.8 secs Computing kpt #: 159 total cpu time spent up to now is 74.2 secs Computing kpt #: 160 total cpu time spent up to now is 74.7 secs Computing kpt #: 161 total cpu time spent up to now is 75.1 secs Computing kpt #: 162 total cpu time spent up to now is 75.5 secs Computing kpt #: 163 total cpu time spent up to now is 76.0 secs Computing kpt #: 164 total cpu time spent up to now is 76.4 secs Computing kpt #: 165 total cpu time spent up to now is 76.9 secs Computing kpt #: 166 total cpu time spent up to now is 77.3 secs Computing kpt #: 167 total cpu time spent up to now is 77.8 secs Computing kpt #: 168 total cpu time spent up to now is 78.2 secs Computing kpt #: 169 total cpu time spent up to now is 78.7 secs Computing kpt #: 170 total cpu time spent up to now is 79.1 secs Computing kpt #: 171 total cpu time spent up to now is 79.6 secs Computing kpt #: 172 total cpu time spent up to now is 80.1 secs Computing kpt #: 173 total cpu time spent up to now is 80.7 secs Computing kpt #: 174 total cpu time spent up to now is 81.2 secs Computing kpt #: 175 total cpu time spent up to now is 81.8 secs Computing kpt #: 176 total cpu time spent up to now is 82.3 secs Computing kpt #: 177 total cpu time spent up to now is 82.9 secs Computing kpt #: 178 total cpu time spent up to now is 83.4 secs Computing kpt #: 179 total cpu time spent up to now is 84.0 secs Computing kpt #: 180 total cpu time spent up to now is 84.7 secs Computing kpt #: 181 total cpu time spent up to now is 85.5 secs Computing kpt #: 182 total cpu time spent up to now is 86.1 secs Computing kpt #: 183 total cpu time spent up to now is 86.7 secs Computing kpt #: 184 total cpu time spent up to now is 87.3 secs Computing kpt #: 185 total cpu time spent up to now is 87.9 secs Computing kpt #: 186 total cpu time spent up to now is 88.8 secs Computing kpt #: 187 total cpu time spent up to now is 89.6 secs Computing kpt #: 188 total cpu time spent up to now is 90.4 secs Computing kpt #: 189 total cpu time spent up to now is 91.2 secs Computing kpt #: 190 total cpu time spent up to now is 91.7 secs Computing kpt #: 191 total cpu time spent up to now is 92.2 secs Computing kpt #: 192 total cpu time spent up to now is 92.7 secs Computing kpt #: 193 total cpu time spent up to now is 93.2 secs Computing kpt #: 194 total cpu time spent up to now is 93.8 secs Computing kpt #: 195 total cpu time spent up to now is 94.3 secs Computing kpt #: 196 total cpu time spent up to now is 94.9 secs Computing kpt #: 197 total cpu time spent up to now is 95.4 secs Computing kpt #: 198 total cpu time spent up to now is 96.0 secs Computing kpt #: 199 total cpu time spent up to now is 96.5 secs Computing kpt #: 200 total cpu time spent up to now is 97.0 secs Computing kpt #: 201 total cpu time spent up to now is 97.6 secs Computing kpt #: 202 total cpu time spent up to now is 98.1 secs Computing kpt #: 203 total cpu time spent up to now is 98.7 secs Computing kpt #: 204 total cpu time spent up to now is 99.2 secs Computing kpt #: 205 total cpu time spent up to now is 99.7 secs Computing kpt #: 206 total cpu time spent up to now is 100.4 secs Computing kpt #: 207 total cpu time spent up to now is 100.9 secs Computing kpt #: 208 total cpu time spent up to now is 101.4 secs Computing kpt #: 209 total cpu time spent up to now is 102.0 secs Computing kpt #: 210 total cpu time spent up to now is 102.6 secs Computing kpt #: 211 total cpu time spent up to now is 103.4 secs Computing kpt #: 212 total cpu time spent up to now is 104.1 secs Computing kpt #: 213 total cpu time spent up to now is 104.9 secs Computing kpt #: 214 total cpu time spent up to now is 105.7 secs Computing kpt #: 215 total cpu time spent up to now is 106.4 secs Computing kpt #: 216 total cpu time spent up to now is 107.2 secs Computing kpt #: 217 total cpu time spent up to now is 107.8 secs Computing kpt #: 218 total cpu time spent up to now is 108.5 secs Computing kpt #: 219 total cpu time spent up to now is 109.0 secs Computing kpt #: 220 total cpu time spent up to now is 109.6 secs Computing kpt #: 221 total cpu time spent up to now is 110.1 secs Computing kpt #: 222 total cpu time spent up to now is 110.6 secs Computing kpt #: 223 total cpu time spent up to now is 111.1 secs Computing kpt #: 224 total cpu time spent up to now is 111.6 secs Computing kpt #: 225 total cpu time spent up to now is 112.0 secs Computing kpt #: 226 total cpu time spent up to now is 112.4 secs Computing kpt #: 227 total cpu time spent up to now is 112.8 secs Computing kpt #: 228 total cpu time spent up to now is 113.2 secs Computing kpt #: 229 total cpu time spent up to now is 113.7 secs Computing kpt #: 230 total cpu time spent up to now is 114.1 secs Computing kpt #: 231 total cpu time spent up to now is 114.5 secs Computing kpt #: 232 total cpu time spent up to now is 114.9 secs Computing kpt #: 233 total cpu time spent up to now is 115.3 secs Computing kpt #: 234 total cpu time spent up to now is 115.8 secs Computing kpt #: 235 total cpu time spent up to now is 116.2 secs Computing kpt #: 236 total cpu time spent up to now is 116.6 secs Computing kpt #: 237 total cpu time spent up to now is 117.1 secs Computing kpt #: 238 total cpu time spent up to now is 117.5 secs Computing kpt #: 239 total cpu time spent up to now is 117.9 secs Computing kpt #: 240 total cpu time spent up to now is 118.4 secs Computing kpt #: 241 total cpu time spent up to now is 118.8 secs Computing kpt #: 242 total cpu time spent up to now is 119.2 secs Computing kpt #: 243 total cpu time spent up to now is 119.6 secs Computing kpt #: 244 total cpu time spent up to now is 120.1 secs Computing kpt #: 245 total cpu time spent up to now is 120.5 secs Computing kpt #: 246 total cpu time spent up to now is 120.9 secs Computing kpt #: 247 total cpu time spent up to now is 121.4 secs Computing kpt #: 248 total cpu time spent up to now is 121.8 secs Computing kpt #: 249 total cpu time spent up to now is 122.3 secs Computing kpt #: 250 total cpu time spent up to now is 122.8 secs Computing kpt #: 251 total cpu time spent up to now is 123.3 secs Computing kpt #: 252 total cpu time spent up to now is 123.8 secs Computing kpt #: 253 total cpu time spent up to now is 124.2 secs Computing kpt #: 254 total cpu time spent up to now is 124.7 secs Computing kpt #: 255 total cpu time spent up to now is 125.1 secs Computing kpt #: 256 total cpu time spent up to now is 125.5 secs Computing kpt #: 257 total cpu time spent up to now is 125.9 secs Computing kpt #: 258 total cpu time spent up to now is 126.3 secs Computing kpt #: 259 total cpu time spent up to now is 126.7 secs Computing kpt #: 260 total cpu time spent up to now is 127.1 secs Computing kpt #: 261 total cpu time spent up to now is 127.6 secs Computing kpt #: 262 total cpu time spent up to now is 128.0 secs Computing kpt #: 263 total cpu time spent up to now is 128.5 secs Computing kpt #: 264 total cpu time spent up to now is 128.9 secs Computing kpt #: 265 total cpu time spent up to now is 129.5 secs Computing kpt #: 266 total cpu time spent up to now is 130.0 secs Computing kpt #: 267 total cpu time spent up to now is 130.7 secs Computing kpt #: 268 total cpu time spent up to now is 131.6 secs Computing kpt #: 269 total cpu time spent up to now is 132.0 secs Computing kpt #: 270 total cpu time spent up to now is 132.9 secs Computing kpt #: 271 total cpu time spent up to now is 133.7 secs Computing kpt #: 272 total cpu time spent up to now is 134.5 secs Computing kpt #: 273 total cpu time spent up to now is 135.4 secs Computing kpt #: 274 total cpu time spent up to now is 135.8 secs Computing kpt #: 275 total cpu time spent up to now is 136.6 secs Computing kpt #: 276 total cpu time spent up to now is 137.6 secs Computing kpt #: 277 total cpu time spent up to now is 138.4 secs Computing kpt #: 278 total cpu time spent up to now is 139.2 secs Computing kpt #: 279 total cpu time spent up to now is 139.7 secs Computing kpt #: 280 total cpu time spent up to now is 140.6 secs Computing kpt #: 281 total cpu time spent up to now is 141.4 secs Computing kpt #: 282 total cpu time spent up to now is 141.9 secs Computing kpt #: 283 total cpu time spent up to now is 142.3 secs Computing kpt #: 284 total cpu time spent up to now is 142.8 secs Computing kpt #: 285 total cpu time spent up to now is 143.3 secs Computing kpt #: 286 total cpu time spent up to now is 143.9 secs Computing kpt #: 287 total cpu time spent up to now is 144.4 secs Computing kpt #: 288 total cpu time spent up to now is 144.9 secs Computing kpt #: 289 total cpu time spent up to now is 145.5 secs Computing kpt #: 290 total cpu time spent up to now is 146.0 secs Computing kpt #: 291 total cpu time spent up to now is 146.5 secs ethr = 1.79E-08, avg # of iterations = 18.9 total cpu time spent up to now is 146.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0267 -34.0267 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2951 -17.2951 -16.8419 -16.8419 -16.8419 -16.8419 -5.1397 -5.1397 0.2711 0.2711 0.2711 0.2711 0.2771 0.2771 1.2979 1.2979 1.2979 1.2979 1.3276 1.3276 2.3995 2.3995 2.4384 2.4384 2.4384 2.4384 6.2770 6.2770 6.2889 6.2889 6.2889 6.2889 10.0795 10.0795 15.0029 15.0029 15.0029 15.0029 15.8997 15.8997 15.8997 15.8997 15.8997 15.8997 k = 0.0000 0.0132-0.0000 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2949 -17.2949 -16.8420 -16.8420 -16.8418 -16.8418 -5.1398 -5.1398 0.2716 0.2716 0.2717 0.2717 0.2777 0.2777 1.2975 1.2975 1.2976 1.2976 1.3273 1.3273 2.3991 2.3991 2.4378 2.4378 2.4381 2.4381 6.2755 6.2755 6.2868 6.2868 6.2883 6.2883 10.0832 10.0832 15.0041 15.0041 15.0050 15.0050 15.9007 15.9007 15.9007 15.9007 15.9009 15.9009 k = 0.0000 0.0263-0.0000 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2942 -17.2942 -16.8425 -16.8425 -16.8416 -16.8416 -5.1399 -5.1399 0.2731 0.2731 0.2735 0.2735 0.2794 0.2794 1.2964 1.2964 1.2969 1.2969 1.3263 1.3263 2.3978 2.3978 2.4360 2.4360 2.4373 2.4373 6.2697 6.2697 6.2821 6.2821 6.2865 6.2865 10.0945 10.0945 15.0079 15.0079 15.0114 15.0114 15.9038 15.9038 15.9039 15.9039 15.9046 15.9046 k = 0.0000 0.0395-0.0000 ( 3887 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7012 -33.7012 -33.6696 -33.6696 -33.6695 -33.6695 -17.2932 -17.2932 -16.8432 -16.8432 -16.8413 -16.8413 -5.1401 -5.1401 0.2755 0.2755 0.2765 0.2765 0.2822 0.2822 1.2946 1.2946 1.2957 1.2957 1.3248 1.3248 2.3956 2.3956 2.4332 2.4332 2.4360 2.4360 6.2570 6.2570 6.2773 6.2773 6.2837 6.2837 10.1132 10.1132 15.0140 15.0140 15.0221 15.0221 15.9090 15.9090 15.9091 15.9091 15.9108 15.9108 k = 0.0000 0.0526-0.0000 ( 3879 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0500 -34.0500 -34.0269 -34.0269 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7012 -33.7012 -33.6697 -33.6697 -33.6695 -33.6695 -17.2917 -17.2917 -16.8443 -16.8443 -16.8409 -16.8409 -5.1403 -5.1403 0.2790 0.2790 0.2806 0.2806 0.2863 0.2863 1.2922 1.2922 1.2940 1.2940 1.3228 1.3228 2.3925 2.3925 2.4293 2.4293 2.4341 2.4341 6.2378 6.2378 6.2726 6.2726 6.2797 6.2797 10.1391 10.1391 15.0222 15.0222 15.0370 15.0370 15.9161 15.9161 15.9163 15.9163 15.9193 15.9193 k = 0.0000 0.0658-0.0000 ( 3871 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0499 -34.0499 -34.0270 -34.0270 -33.7923 -33.7923 -33.7922 -33.7922 -33.7848 -33.7848 -33.7011 -33.7011 -33.6698 -33.6698 -33.6695 -33.6695 -17.2898 -17.2898 -16.8456 -16.8456 -16.8404 -16.8404 -5.1407 -5.1407 0.2834 0.2834 0.2857 0.2857 0.2917 0.2917 1.2890 1.2890 1.2917 1.2917 1.3201 1.3201 2.3883 2.3883 2.4245 2.4245 2.4317 2.4317 6.2130 6.2130 6.2671 6.2671 6.2746 6.2746 10.1718 10.1718 15.0322 15.0322 15.0561 15.0561 15.9252 15.9252 15.9255 15.9255 15.9304 15.9304 k = 0.0000 0.0789-0.0000 ( 3867 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0498 -34.0498 -34.0271 -34.0271 -33.7923 -33.7923 -33.7922 -33.7922 -33.7848 -33.7848 -33.7009 -33.7009 -33.6700 -33.6700 -33.6696 -33.6696 -17.2875 -17.2875 -16.8472 -16.8472 -16.8397 -16.8397 -5.1411 -5.1411 0.2888 0.2888 0.2916 0.2916 0.2986 0.2986 1.2849 1.2849 1.2890 1.2890 1.3168 1.3168 2.3828 2.3828 2.4190 2.4190 2.4289 2.4289 6.1831 6.1831 6.2608 6.2608 6.2685 6.2685 10.2112 10.2112 15.0434 15.0434 15.0793 15.0793 15.9361 15.9361 15.9366 15.9366 15.9439 15.9439 k = 0.0000 0.0921-0.0000 ( 3867 PWs) bands (ev): -67.0852 -67.0852 -67.0772 -67.0772 -67.0770 -67.0770 -34.0501 -34.0501 -34.0497 -34.0497 -34.0272 -34.0272 -33.7923 -33.7923 -33.7921 -33.7921 -33.7849 -33.7849 -33.7008 -33.7008 -33.6702 -33.6702 -33.6696 -33.6696 -17.2847 -17.2847 -16.8492 -16.8492 -16.8390 -16.8390 -5.1416 -5.1416 0.2952 0.2952 0.2983 0.2983 0.3070 0.3070 1.2802 1.2802 1.2858 1.2858 1.3130 1.3130 2.3759 2.3759 2.4130 2.4130 2.4255 2.4255 6.1487 6.1487 6.2535 6.2535 6.2613 6.2613 10.2569 10.2569 15.0552 15.0552 15.1066 15.1066 15.9488 15.9488 15.9494 15.9494 15.9597 15.9597 k = 0.0000 0.1053-0.0000 ( 3867 PWs) bands (ev): -67.0852 -67.0852 -67.0772 -67.0772 -67.0770 -67.0770 -34.0502 -34.0502 -34.0495 -34.0495 -34.0274 -34.0274 -33.7924 -33.7924 -33.7921 -33.7921 -33.7850 -33.7850 -33.7007 -33.7007 -33.6705 -33.6705 -33.6697 -33.6697 -17.2816 -17.2816 -16.8514 -16.8514 -16.8382 -16.8382 -5.1422 -5.1422 0.3025 0.3025 0.3058 0.3058 0.3167 0.3167 1.2747 1.2747 1.2819 1.2819 1.3086 1.3086 2.3675 2.3675 2.4068 2.4068 2.4218 2.4218 6.1102 6.1102 6.2453 6.2453 6.2533 6.2533 10.3084 10.3084 15.0671 15.0671 15.1379 15.1379 15.9630 15.9630 15.9639 15.9639 15.9780 15.9780 k = 0.0000 0.1184-0.0000 ( 3859 PWs) bands (ev): -67.0851 -67.0851 -67.0773 -67.0773 -67.0770 -67.0770 -34.0502 -34.0502 -34.0494 -34.0494 -34.0275 -34.0275 -33.7924 -33.7924 -33.7920 -33.7920 -33.7850 -33.7850 -33.7005 -33.7005 -33.6707 -33.6707 -33.6697 -33.6697 -17.2781 -17.2781 -16.8539 -16.8539 -16.8372 -16.8372 -5.1428 -5.1428 0.3107 0.3107 0.3143 0.3143 0.3278 0.3278 1.2687 1.2687 1.2775 1.2775 1.3036 1.3036 2.3575 2.3575 2.4004 2.4004 2.4176 2.4176 6.0682 6.0682 6.2363 6.2363 6.2443 6.2443 10.3655 10.3655 15.0782 15.0782 15.1731 15.1731 15.9788 15.9788 15.9799 15.9799 15.9986 15.9986 k = 0.0000 0.1316-0.0000 ( 3863 PWs) bands (ev): -67.0851 -67.0851 -67.0773 -67.0773 -67.0770 -67.0770 -34.0502 -34.0502 -34.0492 -34.0492 -34.0277 -34.0277 -33.7924 -33.7924 -33.7920 -33.7920 -33.7851 -33.7851 -33.7003 -33.7003 -33.6710 -33.6710 -33.6698 -33.6698 -17.2742 -17.2742 -16.8568 -16.8568 -16.8362 -16.8362 -5.1435 -5.1435 0.3199 0.3199 0.3236 0.3236 0.3400 0.3400 1.2619 1.2619 1.2725 1.2725 1.2981 1.2981 2.3459 2.3459 2.3940 2.3940 2.4131 2.4131 6.0231 6.0231 6.2264 6.2264 6.2345 6.2345 10.4276 10.4276 15.0874 15.0874 15.2121 15.2121 15.9960 15.9960 15.9973 15.9973 16.0215 16.0215 k = 0.0000 0.1447-0.0000 ( 3847 PWs) bands (ev): -67.0850 -67.0850 -67.0774 -67.0774 -67.0770 -67.0770 -34.0502 -34.0502 -34.0490 -34.0490 -34.0279 -34.0279 -33.7924 -33.7924 -33.7919 -33.7919 -33.7851 -33.7851 -33.7001 -33.7001 -33.6713 -33.6713 -33.6698 -33.6698 -17.2699 -17.2699 -16.8598 -16.8598 -16.8350 -16.8350 -5.1442 -5.1442 0.3300 0.3300 0.3338 0.3338 0.3537 0.3537 1.2546 1.2546 1.2671 1.2671 1.2922 1.2922 2.3326 2.3326 2.3876 2.3876 2.4082 2.4082 5.9754 5.9754 6.2159 6.2159 6.2241 6.2241 10.4944 10.4944 15.0940 15.0940 15.2548 15.2548 16.0145 16.0145 16.0160 16.0160 16.0468 16.0468 k = 0.0000 0.1579-0.0000 ( 3855 PWs) bands (ev): -67.0849 -67.0849 -67.0774 -67.0774 -67.0770 -67.0770 -34.0502 -34.0502 -34.0488 -34.0488 -34.0281 -34.0281 -33.7924 -33.7924 -33.7918 -33.7918 -33.7852 -33.7852 -33.6999 -33.6999 -33.6717 -33.6717 -33.6699 -33.6699 -17.2653 -17.2653 -16.8632 -16.8632 -16.8339 -16.8339 -5.1450 -5.1450 0.3409 0.3409 0.3448 0.3448 0.3686 0.3686 1.2467 1.2467 1.2609 1.2609 1.2855 1.2855 2.3178 2.3178 2.3811 2.3811 2.4030 2.4030 5.9255 5.9255 6.2047 6.2047 6.2130 6.2130 10.5656 10.5656 15.0967 15.0967 15.3010 15.3010 16.0339 16.0339 16.0357 16.0357 16.0743 16.0743 k = 0.0000 0.1711-0.0000 ( 3855 PWs) bands (ev): -67.0849 -67.0849 -67.0775 -67.0775 -67.0770 -67.0770 -34.0502 -34.0502 -34.0486 -34.0486 -34.0284 -34.0284 -33.7924 -33.7924 -33.7917 -33.7917 -33.7853 -33.7853 -33.6997 -33.6997 -33.6720 -33.6720 -33.6700 -33.6700 -17.2604 -17.2604 -16.8669 -16.8669 -16.8326 -16.8326 -5.1459 -5.1459 0.3527 0.3527 0.3567 0.3567 0.3847 0.3847 1.2384 1.2384 1.2541 1.2541 1.2782 1.2782 2.3017 2.3017 2.3746 2.3746 2.3976 2.3976 5.8739 5.8739 6.1929 6.1929 6.2012 6.2012 10.6408 10.6408 15.0946 15.0946 15.3507 15.3507 16.0543 16.0543 16.0564 16.0564 16.1039 16.1039 k = 0.0000 0.1842-0.0000 ( 3863 PWs) bands (ev): -67.0848 -67.0848 -67.0776 -67.0776 -67.0770 -67.0770 -34.0503 -34.0503 -34.0484 -34.0484 -34.0286 -34.0286 -33.7924 -33.7924 -33.7917 -33.7917 -33.7854 -33.7854 -33.6995 -33.6995 -33.6725 -33.6725 -33.6700 -33.6700 -17.2551 -17.2551 -16.8708 -16.8708 -16.8313 -16.8313 -5.1468 -5.1468 0.3653 0.3653 0.3693 0.3693 0.4021 0.4021 1.2293 1.2293 1.2466 1.2466 1.2703 1.2703 2.2842 2.2842 2.3680 2.3680 2.3919 2.3919 5.8210 5.8210 6.1806 6.1806 6.1890 6.1890 10.7195 10.7195 15.0866 15.0866 15.4036 15.4036 16.0754 16.0754 16.0778 16.0778 16.1358 16.1358 k = 0.0000 0.1974-0.0000 ( 3863 PWs) bands (ev): -67.0847 -67.0847 -67.0777 -67.0777 -67.0770 -67.0770 -34.0504 -34.0504 -34.0482 -34.0482 -34.0289 -34.0289 -33.7925 -33.7925 -33.7916 -33.7916 -33.7855 -33.7855 -33.6992 -33.6992 -33.6729 -33.6729 -33.6701 -33.6701 -17.2495 -17.2495 -16.8750 -16.8750 -16.8300 -16.8300 -5.1477 -5.1477 0.3788 0.3788 0.3829 0.3829 0.4204 0.4204 1.2202 1.2202 1.2385 1.2385 1.2617 1.2617 2.2655 2.2655 2.3615 2.3615 2.3861 2.3861 5.7673 5.7673 6.1679 6.1679 6.1764 6.1764 10.8016 10.8016 15.0721 15.0721 15.4596 15.4596 16.0971 16.0971 16.0998 16.0998 16.1697 16.1697 k = 0.0000 0.2105-0.0000 ( 3863 PWs) bands (ev): -67.0846 -67.0846 -67.0778 -67.0778 -67.0770 -67.0770 -34.0504 -34.0504 -34.0479 -34.0479 -34.0292 -34.0292 -33.7925 -33.7925 -33.7915 -33.7915 -33.7856 -33.7856 -33.6989 -33.6989 -33.6733 -33.6733 -33.6702 -33.6702 -17.2435 -17.2435 -16.8794 -16.8794 -16.8286 -16.8286 -5.1487 -5.1487 0.3931 0.3931 0.3972 0.3972 0.4398 0.4398 1.2107 1.2107 1.2297 1.2297 1.2526 1.2526 2.2458 2.2458 2.3549 2.3549 2.3802 2.3802 5.7131 5.7131 6.1549 6.1549 6.1635 6.1635 10.8868 10.8868 15.0502 15.0502 15.5185 15.5185 16.1192 16.1192 16.1222 16.1222 16.2057 16.2057 k = 0.0000 0.2237-0.0000 ( 3859 PWs) bands (ev): -67.0845 -67.0845 -67.0779 -67.0779 -67.0770 -67.0770 -34.0504 -34.0504 -34.0477 -34.0477 -34.0294 -34.0294 -33.7925 -33.7925 -33.7914 -33.7914 -33.7857 -33.7857 -33.6986 -33.6986 -33.6738 -33.6738 -33.6703 -33.6703 -17.2373 -17.2373 -16.8841 -16.8841 -16.8271 -16.8271 -5.1497 -5.1497 0.4081 0.4081 0.4123 0.4123 0.4602 0.4602 1.2010 1.2010 1.2201 1.2201 1.2428 1.2428 2.2252 2.2252 2.3483 2.3483 2.3742 2.3742 5.6589 5.6589 6.1417 6.1417 6.1504 6.1504 10.9747 10.9747 15.0207 15.0207 15.5800 15.5800 16.1415 16.1415 16.1449 16.1449 16.2436 16.2436 k = 0.0000 0.2368-0.0000 ( 3867 PWs) bands (ev): -67.0844 -67.0844 -67.0780 -67.0780 -67.0770 -67.0770 -34.0505 -34.0505 -34.0474 -34.0474 -34.0297 -34.0297 -33.7925 -33.7925 -33.7913 -33.7913 -33.7859 -33.7859 -33.6983 -33.6983 -33.6743 -33.6743 -33.6704 -33.6704 -17.2309 -17.2309 -16.8891 -16.8891 -16.8257 -16.8257 -5.1507 -5.1507 0.4239 0.4239 0.4281 0.4281 0.4815 0.4815 1.1910 1.1910 1.2098 1.2098 1.2324 1.2324 2.2035 2.2035 2.3417 2.3417 2.3682 2.3682 5.6049 5.6049 6.1283 6.1283 6.1371 6.1371 11.0651 11.0651 14.9835 14.9835 15.6440 15.6440 16.1639 16.1639 16.1676 16.1676 16.2833 16.2833 k = 0.0000 0.2500-0.0000 ( 3867 PWs) bands (ev): -67.0843 -67.0843 -67.0781 -67.0781 -67.0770 -67.0770 -34.0505 -34.0505 -34.0471 -34.0471 -34.0300 -34.0300 -33.7926 -33.7926 -33.7912 -33.7912 -33.7860 -33.7860 -33.6980 -33.6980 -33.6748 -33.6748 -33.6704 -33.6704 -17.2242 -17.2242 -16.8942 -16.8942 -16.8242 -16.8242 -5.1518 -5.1518 0.4403 0.4403 0.4447 0.4447 0.5037 0.5037 1.1810 1.1810 1.1988 1.1988 1.2213 1.2213 2.1810 2.1810 2.3353 2.3353 2.3622 2.3622 5.5515 5.5515 6.1150 6.1150 6.1238 6.1238 11.1577 11.1577 14.9386 14.9386 15.7102 15.7102 16.1862 16.1862 16.1902 16.1902 16.3247 16.3247 k = 0.0000 0.2632-0.0000 ( 3868 PWs) bands (ev): -67.0842 -67.0842 -67.0782 -67.0782 -67.0770 -67.0770 -34.0506 -34.0506 -34.0468 -34.0468 -34.0304 -34.0304 -33.7926 -33.7926 -33.7911 -33.7911 -33.7861 -33.7861 -33.6976 -33.6976 -33.6753 -33.6753 -33.6705 -33.6705 -17.2172 -17.2172 -16.8996 -16.8996 -16.8228 -16.8228 -5.1528 -5.1528 0.4574 0.4574 0.4619 0.4619 0.5266 0.5266 1.1708 1.1708 1.1870 1.1870 1.2096 1.2096 2.1579 2.1579 2.3289 2.3289 2.3563 2.3563 5.4990 5.4990 6.1017 6.1017 6.1106 6.1106 11.2523 11.2523 14.8865 14.8865 15.7784 15.7784 16.2082 16.2082 16.2126 16.2126 16.3677 16.3677 k = 0.0000 0.2763-0.0000 ( 3864 PWs) bands (ev): -67.0841 -67.0841 -67.0783 -67.0783 -67.0770 -67.0770 -34.0506 -34.0506 -34.0465 -34.0465 -34.0307 -34.0307 -33.7926 -33.7926 -33.7910 -33.7910 -33.7862 -33.7862 -33.6973 -33.6973 -33.6758 -33.6758 -33.6706 -33.6706 -17.2101 -17.2101 -16.9052 -16.9052 -16.8213 -16.8213 -5.1538 -5.1538 0.4752 0.4752 0.4798 0.4798 0.5502 0.5502 1.1607 1.1607 1.1746 1.1746 1.1974 1.1974 2.1341 2.1341 2.3226 2.3226 2.3504 2.3504 5.4478 5.4478 6.0885 6.0885 6.0975 6.0975 11.3488 11.3488 14.8275 14.8275 15.8481 15.8481 16.2299 16.2299 16.2346 16.2346 16.4122 16.4122 k = 0.0000 0.2895-0.0000 ( 3868 PWs) bands (ev): -67.0840 -67.0840 -67.0784 -67.0784 -67.0770 -67.0770 -34.0506 -34.0506 -34.0462 -34.0462 -34.0311 -34.0311 -33.7926 -33.7926 -33.7909 -33.7909 -33.7864 -33.7864 -33.6969 -33.6969 -33.6763 -33.6763 -33.6707 -33.6707 -17.2028 -17.2028 -16.9110 -16.9110 -16.8199 -16.8199 -5.1549 -5.1549 0.4934 0.4934 0.4981 0.4981 0.5743 0.5743 1.1503 1.1503 1.1613 1.1613 1.1847 1.1847 2.1099 2.1099 2.3165 2.3165 2.3447 2.3447 5.3980 5.3980 6.0756 6.0756 6.0846 6.0846 11.4469 11.4469 14.7623 14.7623 15.9191 15.9191 16.2510 16.2510 16.2560 16.2560 16.4579 16.4579 k = 0.0000 0.3026-0.0000 ( 3872 PWs) bands (ev): -67.0839 -67.0839 -67.0785 -67.0785 -67.0770 -67.0770 -34.0507 -34.0507 -34.0458 -34.0458 -34.0315 -34.0315 -33.7927 -33.7927 -33.7908 -33.7908 -33.7865 -33.7865 -33.6965 -33.6965 -33.6769 -33.6769 -33.6708 -33.6708 -17.1954 -17.1954 -16.9170 -16.9170 -16.8185 -16.8185 -5.1559 -5.1559 0.5123 0.5123 0.5171 0.5171 0.5989 0.5989 1.1399 1.1399 1.1474 1.1474 1.1717 1.1717 2.0852 2.0852 2.3106 2.3106 2.3392 2.3392 5.3500 5.3500 6.0630 6.0630 6.0721 6.0721 11.5463 11.5463 14.6914 14.6914 15.9910 15.9910 16.2714 16.2714 16.2768 16.2768 16.5046 16.5046 k = 0.0000 0.3158-0.0000 ( 3876 PWs) bands (ev): -67.0838 -67.0838 -67.0786 -67.0786 -67.0770 -67.0770 -34.0507 -34.0507 -34.0455 -34.0455 -34.0318 -34.0318 -33.7927 -33.7927 -33.7907 -33.7907 -33.7866 -33.7866 -33.6961 -33.6961 -33.6775 -33.6775 -33.6709 -33.6709 -17.1878 -17.1878 -16.9231 -16.9231 -16.8172 -16.8172 -5.1569 -5.1569 0.5316 0.5316 0.5367 0.5367 0.6237 0.6237 1.1292 1.1292 1.1328 1.1328 1.1585 1.1585 2.0603 2.0603 2.3049 2.3049 2.3339 2.3339 5.3039 5.3039 6.0508 6.0508 6.0600 6.0600 11.6470 11.6470 14.6155 14.6155 16.0633 16.0633 16.2911 16.2911 16.2968 16.2968 16.5522 16.5522 k = 0.0000 0.3289-0.0000 ( 3884 PWs) bands (ev): -67.0836 -67.0836 -67.0787 -67.0787 -67.0770 -67.0770 -34.0508 -34.0508 -34.0451 -34.0451 -34.0322 -34.0322 -33.7927 -33.7927 -33.7907 -33.7907 -33.7868 -33.7868 -33.6957 -33.6957 -33.6781 -33.6781 -33.6710 -33.6710 -17.1802 -17.1802 -16.9294 -16.9294 -16.8159 -16.8159 -5.1579 -5.1579 0.5513 0.5513 0.5566 0.5566 0.6488 0.6488 1.1174 1.1174 1.1179 1.1179 1.1456 1.1456 2.0354 2.0354 2.2995 2.2995 2.3288 2.3288 5.2601 5.2601 6.0390 6.0390 6.0483 6.0483 11.7488 11.7488 14.5353 14.5353 16.1355 16.1355 16.3098 16.3098 16.3158 16.3158 16.6002 16.6002 k = 0.0000 0.3421-0.0000 ( 3876 PWs) bands (ev): -67.0835 -67.0835 -67.0788 -67.0788 -67.0770 -67.0770 -34.0508 -34.0508 -34.0448 -34.0448 -34.0326 -34.0326 -33.7927 -33.7927 -33.7905 -33.7905 -33.7869 -33.7869 -33.6953 -33.6953 -33.6786 -33.6786 -33.6710 -33.6710 -17.1725 -17.1725 -16.9358 -16.9358 -16.8146 -16.8146 -5.1588 -5.1588 0.5715 0.5715 0.5771 0.5771 0.6736 0.6736 1.1014 1.1014 1.1057 1.1057 1.1335 1.1335 2.0107 2.0107 2.2945 2.2945 2.3240 2.3240 5.2187 5.2187 6.0279 6.0279 6.0373 6.0373 11.8514 11.8514 14.4512 14.4512 16.2072 16.2072 16.3276 16.3276 16.3338 16.3338 16.6485 16.6485 k = 0.0000 0.3553-0.0000 ( 3884 PWs) bands (ev): -67.0834 -67.0834 -67.0790 -67.0790 -67.0770 -67.0770 -34.0508 -34.0508 -34.0444 -34.0444 -34.0329 -34.0329 -33.7928 -33.7928 -33.7904 -33.7904 -33.7870 -33.7870 -33.6949 -33.6949 -33.6792 -33.6792 -33.6711 -33.6711 -17.1647 -17.1647 -16.9423 -16.9423 -16.8134 -16.8134 -5.1597 -5.1597 0.5919 0.5919 0.5978 0.5978 0.6979 0.6979 1.0847 1.0847 1.0922 1.0922 1.1225 1.1225 1.9862 1.9862 2.2897 2.2897 2.3195 2.3195 5.1799 5.1799 6.0174 6.0174 6.0268 6.0268 11.9546 11.9546 14.3639 14.3639 16.2775 16.2775 16.3444 16.3444 16.3507 16.3507 16.6965 16.6965 k = 0.0000 0.3684-0.0000 ( 3876 PWs) bands (ev): -67.0833 -67.0833 -67.0791 -67.0791 -67.0770 -67.0770 -34.0508 -34.0508 -34.0441 -34.0441 -34.0333 -34.0333 -33.7928 -33.7928 -33.7902 -33.7902 -33.7871 -33.7871 -33.6944 -33.6944 -33.6797 -33.6797 -33.6712 -33.6712 -17.1571 -17.1571 -16.9488 -16.9488 -16.8123 -16.8123 -5.1605 -5.1605 0.6125 0.6125 0.6189 0.6189 0.7220 0.7220 1.0675 1.0675 1.0775 1.0775 1.1130 1.1130 1.9624 1.9624 2.2853 2.2853 2.3154 2.3154 5.1439 5.1439 6.0076 6.0076 6.0170 6.0170 12.0581 12.0581 14.2739 14.2739 16.3443 16.3443 16.3619 16.3619 16.3664 16.3664 16.7438 16.7438 k = 0.0000 0.3816-0.0000 ( 3876 PWs) bands (ev): -67.0832 -67.0832 -67.0792 -67.0792 -67.0770 -67.0770 -34.0508 -34.0508 -34.0437 -34.0437 -34.0337 -34.0337 -33.7928 -33.7928 -33.7901 -33.7901 -33.7873 -33.7873 -33.6940 -33.6940 -33.6803 -33.6803 -33.6712 -33.6712 -17.1495 -17.1495 -16.9552 -16.9552 -16.8112 -16.8112 -5.1613 -5.1613 0.6332 0.6332 0.6402 0.6402 0.7453 0.7453 1.0497 1.0497 1.0616 1.0616 1.1046 1.1046 1.9393 1.9393 2.2812 2.2812 2.3116 2.3116 5.1108 5.1108 5.9985 5.9985 6.0080 6.0080 12.1617 12.1617 14.1819 14.1819 16.3724 16.3724 16.3808 16.3808 16.4141 16.4141 16.7900 16.7900 k = 0.0000 0.3947-0.0000 ( 3884 PWs) bands (ev): -67.0831 -67.0831 -67.0793 -67.0793 -67.0770 -67.0770 -34.0509 -34.0509 -34.0434 -34.0434 -34.0340 -34.0340 -33.7928 -33.7928 -33.7900 -33.7900 -33.7874 -33.7874 -33.6936 -33.6936 -33.6808 -33.6808 -33.6713 -33.6713 -17.1421 -17.1421 -16.9616 -16.9616 -16.8103 -16.8103 -5.1620 -5.1620 0.6539 0.6539 0.6616 0.6616 0.7675 0.7675 1.0314 1.0314 1.0449 1.0449 1.0973 1.0973 1.9173 1.9173 2.2776 2.2776 2.3081 2.3081 5.0809 5.0809 5.9902 5.9902 5.9997 5.9997 12.2650 12.2650 14.0883 14.0883 16.3857 16.3857 16.3938 16.3938 16.4765 16.4765 16.8344 16.8344 k = 0.0000 0.4079-0.0000 ( 3876 PWs) bands (ev): -67.0830 -67.0830 -67.0794 -67.0794 -67.0770 -67.0770 -34.0509 -34.0509 -34.0431 -34.0431 -34.0344 -34.0344 -33.7928 -33.7928 -33.7899 -33.7899 -33.7876 -33.7876 -33.6932 -33.6932 -33.6813 -33.6813 -33.6713 -33.6713 -17.1350 -17.1350 -16.9679 -16.9679 -16.8095 -16.8095 -5.1627 -5.1627 0.6743 0.6743 0.6829 0.6829 0.7884 0.7884 1.0128 1.0128 1.0278 1.0278 1.0910 1.0910 1.8968 1.8968 2.2743 2.2743 2.3050 2.3050 5.0541 5.0541 5.9828 5.9828 5.9924 5.9924 12.3675 12.3675 13.9940 13.9940 16.3973 16.3973 16.4054 16.4054 16.5351 16.5351 16.8764 16.8764 k = 0.0000 0.4211-0.0000 ( 3884 PWs) bands (ev): -67.0829 -67.0829 -67.0795 -67.0795 -67.0770 -67.0770 -34.0509 -34.0509 -34.0428 -34.0428 -34.0347 -34.0347 -33.7928 -33.7928 -33.7898 -33.7898 -33.7877 -33.7877 -33.6928 -33.6928 -33.6818 -33.6818 -33.6714 -33.6714 -17.1282 -17.1282 -16.9738 -16.9738 -16.8087 -16.8087 -5.1633 -5.1633 0.6943 0.6943 0.7042 0.7042 0.8074 0.8074 0.9940 0.9940 1.0105 1.0105 1.0855 1.0855 1.8779 1.8779 2.2714 2.2714 2.3023 2.3023 5.0307 5.0307 5.9762 5.9762 5.9858 5.9858 12.4685 12.4685 13.8998 13.8998 16.4073 16.4073 16.4156 16.4156 16.5886 16.5886 16.9151 16.9151 k = 0.0000 0.4342-0.0000 ( 3884 PWs) bands (ev): -67.0828 -67.0828 -67.0796 -67.0796 -67.0770 -67.0770 -34.0509 -34.0509 -34.0425 -34.0425 -34.0350 -34.0350 -33.7928 -33.7928 -33.7896 -33.7896 -33.7878 -33.7878 -33.6924 -33.6924 -33.6823 -33.6823 -33.6714 -33.6714 -17.1220 -17.1220 -16.9794 -16.9794 -16.8080 -16.8080 -5.1638 -5.1638 0.7137 0.7137 0.7250 0.7250 0.8244 0.8244 0.9752 0.9752 0.9935 0.9935 1.0809 1.0809 1.8612 1.8612 2.2690 2.2690 2.3000 2.3000 5.0107 5.0107 5.9706 5.9706 5.9802 5.9802 12.5670 12.5670 13.8068 13.8068 16.4159 16.4159 16.4243 16.4243 16.6361 16.6361 16.9498 16.9498 k = 0.0000 0.4474-0.0000 ( 3888 PWs) bands (ev): -67.0827 -67.0827 -67.0796 -67.0796 -67.0770 -67.0770 -34.0509 -34.0509 -34.0422 -34.0422 -34.0353 -34.0353 -33.7929 -33.7929 -33.7895 -33.7895 -33.7880 -33.7880 -33.6920 -33.6920 -33.6827 -33.6827 -33.6715 -33.6715 -17.1164 -17.1164 -16.9844 -16.9844 -16.8075 -16.8075 -5.1642 -5.1642 0.7317 0.7317 0.7451 0.7451 0.8390 0.8390 0.9567 0.9567 0.9773 0.9773 1.0772 1.0772 1.8468 1.8468 2.2669 2.2669 2.2981 2.2981 4.9943 4.9943 5.9659 5.9659 5.9756 5.9756 12.6612 12.6612 13.7170 13.7170 16.4229 16.4229 16.4314 16.4314 16.6765 16.6765 16.9797 16.9797 k = 0.0000 0.4605-0.0000 ( 3896 PWs) bands (ev): -67.0827 -67.0827 -67.0797 -67.0797 -67.0770 -67.0770 -34.0509 -34.0509 -34.0420 -34.0420 -34.0356 -34.0356 -33.7929 -33.7929 -33.7894 -33.7894 -33.7881 -33.7881 -33.6918 -33.6918 -33.6830 -33.6830 -33.6715 -33.6715 -17.1118 -17.1118 -16.9887 -16.9887 -16.8071 -16.8071 -5.1645 -5.1645 0.7479 0.7479 0.7638 0.7638 0.8508 0.8508 0.9391 0.9391 0.9626 0.9626 1.0742 1.0742 1.8352 1.8352 2.2654 2.2654 2.2966 2.2966 4.9814 4.9814 5.9623 5.9623 5.9720 5.9720 12.7481 12.7481 13.6334 13.6334 16.4284 16.4284 16.4370 16.4370 16.7091 16.7091 17.0041 17.0041 k = 0.0000 0.4737-0.0000 ( 3876 PWs) bands (ev): -67.0826 -67.0826 -67.0797 -67.0797 -67.0769 -67.0769 -34.0509 -34.0509 -34.0418 -34.0418 -34.0358 -34.0358 -33.7929 -33.7929 -33.7893 -33.7893 -33.7881 -33.7881 -33.6915 -33.6915 -33.6832 -33.6832 -33.6715 -33.6715 -17.1082 -17.1082 -16.9919 -16.9919 -16.8068 -16.8068 -5.1647 -5.1647 0.7612 0.7612 0.7801 0.7801 0.8597 0.8597 0.9236 0.9236 0.9505 0.9505 1.0723 1.0723 1.8267 1.8267 2.2642 2.2642 2.2955 2.2955 4.9722 4.9722 5.9598 5.9598 5.9695 5.9695 12.8224 12.8224 13.5614 13.5614 16.4324 16.4324 16.4411 16.4411 16.7331 16.7331 17.0220 17.0220 k = 0.0000 0.4868-0.0000 ( 3868 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0769 -67.0769 -34.0508 -34.0508 -34.0417 -34.0417 -34.0359 -34.0359 -33.7929 -33.7929 -33.7892 -33.7892 -33.7882 -33.7882 -33.6914 -33.6914 -33.6834 -33.6834 -33.6715 -33.6715 -17.1059 -17.1059 -16.9940 -16.9940 -16.8066 -16.8066 -5.1649 -5.1649 0.7701 0.7701 0.7919 0.7919 0.8654 0.8654 0.9121 0.9121 0.9422 0.9422 1.0711 1.0711 1.8215 1.8215 2.2636 2.2636 2.2949 2.2949 4.9666 4.9666 5.9582 5.9582 5.9679 5.9679 12.8752 12.8752 13.5099 13.5099 16.4348 16.4348 16.4435 16.4435 16.7477 16.7477 17.0331 17.0331 k = 0.0000 0.5000-0.0000 ( 3868 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0769 -67.0769 -34.0508 -34.0508 -34.0416 -34.0416 -34.0359 -34.0359 -33.7929 -33.7929 -33.7891 -33.7891 -33.7882 -33.7882 -33.6913 -33.6913 -33.6834 -33.6834 -33.6715 -33.6715 -17.1051 -17.1051 -16.9947 -16.9947 -16.8065 -16.8065 -5.1649 -5.1649 0.7733 0.7733 0.7963 0.7963 0.8674 0.8674 0.9076 0.9076 0.9392 0.9392 1.0707 1.0707 1.8198 1.8198 2.2634 2.2634 2.2947 2.2947 4.9648 4.9648 5.9577 5.9577 5.9674 5.9674 12.8949 12.8949 13.4907 13.4907 16.4355 16.4355 16.4443 16.4443 16.7526 16.7526 17.0368 17.0368 k = 0.0000 0.5000-0.0000 ( 3868 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0769 -67.0769 -34.0508 -34.0508 -34.0416 -34.0416 -34.0359 -34.0359 -33.7929 -33.7929 -33.7891 -33.7891 -33.7882 -33.7882 -33.6913 -33.6913 -33.6834 -33.6834 -33.6715 -33.6715 -17.1051 -17.1051 -16.9947 -16.9947 -16.8065 -16.8065 -5.1649 -5.1649 0.7733 0.7733 0.7963 0.7963 0.8674 0.8674 0.9076 0.9076 0.9392 0.9392 1.0707 1.0707 1.8198 1.8198 2.2634 2.2634 2.2947 2.2947 4.9648 4.9648 5.9577 5.9577 5.9674 5.9674 12.8949 12.8949 13.4907 13.4907 16.4355 16.4355 16.4443 16.4443 16.7526 16.7526 17.0368 17.0368 k = 0.0132 0.5000-0.0000 ( 3868 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0769 -67.0769 -34.0508 -34.0508 -34.0417 -34.0417 -34.0359 -34.0359 -33.7929 -33.7929 -33.7893 -33.7893 -33.7881 -33.7881 -33.6913 -33.6913 -33.6834 -33.6834 -33.6715 -33.6715 -17.1050 -17.1050 -16.9946 -16.9946 -16.8066 -16.8066 -5.1648 -5.1648 0.7732 0.7732 0.7962 0.7962 0.8657 0.8657 0.9062 0.9062 0.9370 0.9370 1.0758 1.0758 1.8178 1.8178 2.2639 2.2639 2.2952 2.2952 4.9659 4.9659 5.9570 5.9570 5.9667 5.9667 12.8972 12.8972 13.4910 13.4910 16.4335 16.4335 16.4432 16.4432 16.7542 16.7542 17.0363 17.0363 k = 0.0263 0.5000-0.0000 ( 3876 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0417 -34.0417 -34.0359 -34.0359 -33.7930 -33.7930 -33.7896 -33.7896 -33.7877 -33.7877 -33.6914 -33.6914 -33.6834 -33.6834 -33.6715 -33.6715 -17.1045 -17.1045 -16.9944 -16.9944 -16.8069 -16.8069 -5.1643 -5.1643 0.7729 0.7729 0.7961 0.7961 0.8599 0.8599 0.9018 0.9018 0.9329 0.9329 1.0895 1.0895 1.8118 1.8118 2.2652 2.2652 2.2971 2.2971 4.9691 4.9691 5.9548 5.9548 5.9646 5.9646 12.9041 12.9041 13.4916 13.4916 16.4243 16.4243 16.4430 16.4430 16.7587 16.7587 17.0347 17.0347 k = 0.0395 0.5000-0.0000 ( 3882 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0418 -34.0418 -34.0359 -34.0359 -33.7931 -33.7931 -33.7900 -33.7900 -33.7873 -33.7873 -33.6916 -33.6916 -33.6833 -33.6833 -33.6714 -33.6714 -17.1037 -17.1037 -16.9941 -16.9941 -16.8074 -16.8074 -5.1636 -5.1636 0.7720 0.7720 0.7960 0.7960 0.8492 0.8492 0.8953 0.8953 0.9300 0.9300 1.1086 1.1086 1.8022 1.8022 2.2662 2.2662 2.3012 2.3012 4.9745 4.9745 5.9513 5.9513 5.9611 5.9611 12.9155 12.9155 13.4927 13.4927 16.4071 16.4071 16.4448 16.4448 16.7663 16.7663 17.0321 17.0321 k = 0.0526 0.5000-0.0000 ( 3878 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0418 -34.0418 -34.0359 -34.0359 -33.7933 -33.7933 -33.7902 -33.7902 -33.7868 -33.7868 -33.6918 -33.6918 -33.6833 -33.6833 -33.6713 -33.6713 -17.1026 -17.1026 -16.9936 -16.9936 -16.8081 -16.8081 -5.1625 -5.1625 0.7704 0.7704 0.7961 0.7961 0.8338 0.8338 0.8884 0.8884 0.9290 0.9290 1.1310 1.1310 1.7894 1.7894 2.2659 2.2659 2.3081 2.3081 4.9821 4.9821 5.9463 5.9463 5.9564 5.9564 12.9315 12.9315 13.4941 13.4941 16.3831 16.3831 16.4481 16.4481 16.7767 16.7767 17.0286 17.0286 k = 0.0658 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0419 -34.0419 -34.0358 -34.0358 -33.7936 -33.7936 -33.7905 -33.7905 -33.7863 -33.7863 -33.6920 -33.6920 -33.6832 -33.6832 -33.6712 -33.6712 -17.1012 -17.1012 -16.9930 -16.9930 -16.8089 -16.8089 -5.1611 -5.1611 0.7677 0.7677 0.7956 0.7956 0.8160 0.8160 0.8819 0.8819 0.9294 0.9294 1.1551 1.1551 1.7736 1.7736 2.2640 2.2640 2.3177 2.3177 4.9916 4.9916 5.9398 5.9398 5.9506 5.9506 12.9519 12.9519 13.4960 13.4960 16.3531 16.3531 16.4524 16.4524 16.7898 16.7898 17.0242 17.0242 k = 0.0789 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0420 -34.0420 -34.0358 -34.0358 -33.7939 -33.7939 -33.7907 -33.7907 -33.7859 -33.7859 -33.6922 -33.6922 -33.6831 -33.6831 -33.6711 -33.6711 -17.0995 -17.0995 -16.9923 -16.9923 -16.8100 -16.8100 -5.1595 -5.1595 0.7634 0.7634 0.7866 0.7866 0.8058 0.8058 0.8755 0.8755 0.9306 0.9306 1.1800 1.1800 1.7554 1.7554 2.2606 2.2606 2.3296 2.3296 5.0031 5.0031 5.9317 5.9317 5.9436 5.9436 12.9767 12.9767 13.4981 13.4981 16.3178 16.3178 16.4578 16.4578 16.8052 16.8052 17.0190 17.0190 k = 0.0921 0.5000-0.0000 ( 3872 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0771 -67.0771 -34.0508 -34.0508 -34.0421 -34.0421 -34.0358 -34.0358 -33.7942 -33.7942 -33.7908 -33.7908 -33.7854 -33.7854 -33.6925 -33.6925 -33.6830 -33.6830 -33.6709 -33.6709 -17.0974 -17.0974 -16.9914 -16.9914 -16.8112 -16.8112 -5.1576 -5.1576 0.7555 0.7555 0.7690 0.7690 0.8067 0.8067 0.8689 0.8689 0.9323 0.9323 1.2054 1.2054 1.7352 1.7352 2.2559 2.2559 2.3432 2.3432 5.0164 5.0164 5.9223 5.9223 5.9358 5.9358 13.0058 13.0058 13.5006 13.5006 16.2780 16.2780 16.4642 16.4642 16.8226 16.8226 17.0132 17.0132 k = 0.1053 0.5000-0.0000 ( 3876 PWs) bands (ev): -67.0824 -67.0824 -67.0798 -67.0798 -67.0771 -67.0771 -34.0508 -34.0508 -34.0422 -34.0422 -34.0359 -34.0359 -33.7946 -33.7946 -33.7909 -33.7909 -33.7849 -33.7849 -33.6928 -33.6928 -33.6829 -33.6829 -33.6707 -33.6707 -17.0951 -17.0951 -16.9904 -16.9904 -16.8126 -16.8126 -5.1554 -5.1554 0.7377 0.7377 0.7580 0.7580 0.8101 0.8101 0.8619 0.8619 0.9345 0.9345 1.2309 1.2309 1.7132 1.7132 2.2502 2.2502 2.3579 2.3579 5.0315 5.0315 5.9115 5.9115 5.9270 5.9270 13.0390 13.0390 13.5033 13.5033 16.2346 16.2346 16.4715 16.4715 16.8416 16.8416 17.0067 17.0067 k = 0.1184 0.5000-0.0000 ( 3880 PWs) bands (ev): -67.0824 -67.0824 -67.0798 -67.0798 -67.0772 -67.0772 -34.0508 -34.0508 -34.0423 -34.0423 -34.0359 -34.0359 -33.7950 -33.7950 -33.7910 -33.7910 -33.7844 -33.7844 -33.6932 -33.6932 -33.6829 -33.6829 -33.6706 -33.6706 -17.0925 -17.0925 -16.9894 -16.9894 -16.8142 -16.8142 -5.1530 -5.1530 0.7149 0.7149 0.7506 0.7506 0.8148 0.8148 0.8543 0.8543 0.9370 0.9370 1.2563 1.2563 1.6899 1.6899 2.2436 2.2436 2.3735 2.3735 5.0481 5.0481 5.8995 5.8995 5.9173 5.9173 13.0763 13.0763 13.5061 13.5061 16.1879 16.1879 16.4798 16.4798 16.8615 16.8615 16.9999 16.9999 k = 0.1316 0.5000-0.0000 ( 3880 PWs) bands (ev): -67.0823 -67.0823 -67.0798 -67.0798 -67.0772 -67.0772 -34.0508 -34.0508 -34.0425 -34.0425 -34.0359 -34.0359 -33.7954 -33.7954 -33.7911 -33.7911 -33.7840 -33.7840 -33.6935 -33.6935 -33.6828 -33.6828 -33.6704 -33.6704 -17.0897 -17.0897 -16.9882 -16.9882 -16.8160 -16.8160 -5.1504 -5.1504 0.6915 0.6915 0.7433 0.7433 0.8202 0.8202 0.8461 0.8461 0.9399 0.9399 1.2815 1.2815 1.6657 1.6657 2.2361 2.2361 2.3896 2.3896 5.0663 5.0663 5.8864 5.8864 5.9069 5.9069 13.1175 13.1175 13.5091 13.5091 16.1390 16.1390 16.4890 16.4890 16.8815 16.8815 16.9927 16.9927 k = 0.1447 0.5000-0.0000 ( 3880 PWs) bands (ev): -67.0823 -67.0823 -67.0798 -67.0798 -67.0772 -67.0772 -34.0508 -34.0508 -34.0426 -34.0426 -34.0359 -34.0359 -33.7959 -33.7959 -33.7912 -33.7912 -33.7835 -33.7835 -33.6939 -33.6939 -33.6827 -33.6827 -33.6701 -33.6701 -17.0865 -17.0865 -16.9869 -16.9869 -16.8180 -16.8180 -5.1476 -5.1476 0.6681 0.6681 0.7354 0.7354 0.8262 0.8262 0.8373 0.8373 0.9430 0.9430 1.3062 1.3062 1.6407 1.6407 2.2279 2.2279 2.4061 2.4061 5.0857 5.0857 5.8723 5.8723 5.8956 5.8956 13.1625 13.1625 13.5121 13.5121 16.0884 16.0884 16.4991 16.4991 16.9006 16.9006 16.9853 16.9853 k = 0.1579 0.5000-0.0000 ( 3878 PWs) bands (ev): -67.0822 -67.0822 -67.0798 -67.0798 -67.0773 -67.0773 -34.0508 -34.0508 -34.0427 -34.0427 -34.0359 -34.0359 -33.7963 -33.7963 -33.7913 -33.7913 -33.7831 -33.7831 -33.6942 -33.6942 -33.6827 -33.6827 -33.6699 -33.6699 -17.0831 -17.0831 -16.9855 -16.9855 -16.8201 -16.8201 -5.1445 -5.1445 0.6451 0.6451 0.7272 0.7272 0.8274 0.8274 0.8335 0.8335 0.9464 0.9464 1.3305 1.3305 1.6151 1.6151 2.2190 2.2190 2.4227 2.4227 5.1063 5.1063 5.8575 5.8575 5.8838 5.8838 13.2111 13.2111 13.5152 13.5152 16.0367 16.0367 16.5101 16.5101 16.9176 16.9176 16.9778 16.9778 k = 0.1711 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0822 -67.0822 -67.0798 -67.0798 -67.0774 -67.0774 -34.0508 -34.0508 -34.0429 -34.0429 -34.0359 -34.0359 -33.7967 -33.7967 -33.7913 -33.7913 -33.7826 -33.7826 -33.6946 -33.6946 -33.6826 -33.6826 -33.6696 -33.6696 -17.0794 -17.0794 -16.9841 -16.9841 -16.8225 -16.8225 -5.1413 -5.1413 0.6227 0.6227 0.7186 0.7186 0.8176 0.8176 0.8405 0.8405 0.9500 0.9500 1.3542 1.3542 1.5893 1.5893 2.2094 2.2094 2.4393 2.4393 5.1280 5.1280 5.8419 5.8419 5.8712 5.8712 13.2631 13.2631 13.5181 13.5181 15.9846 15.9846 16.5219 16.5219 16.9308 16.9308 16.9703 16.9703 k = 0.1842 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0821 -67.0821 -67.0798 -67.0798 -67.0774 -67.0774 -34.0508 -34.0508 -34.0430 -34.0430 -34.0359 -34.0359 -33.7972 -33.7972 -33.7914 -33.7914 -33.7822 -33.7822 -33.6950 -33.6950 -33.6826 -33.6826 -33.6694 -33.6694 -17.0755 -17.0755 -16.9826 -16.9826 -16.8250 -16.8250 -5.1380 -5.1380 0.6010 0.6010 0.7097 0.7097 0.8071 0.8071 0.8483 0.8483 0.9538 0.9538 1.3772 1.3772 1.5633 1.5633 2.1993 2.1993 2.4557 2.4557 5.1504 5.1504 5.8258 5.8258 5.8582 5.8582 13.3185 13.3185 13.5209 13.5209 15.9324 15.9324 16.5346 16.5346 16.9386 16.9386 16.9628 16.9628 k = 0.1974 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0820 -67.0820 -67.0798 -67.0798 -67.0775 -67.0775 -34.0507 -34.0507 -34.0432 -34.0432 -34.0360 -34.0360 -33.7976 -33.7976 -33.7914 -33.7914 -33.7818 -33.7818 -33.6954 -33.6954 -33.6826 -33.6826 -33.6691 -33.6691 -17.0713 -17.0713 -16.9810 -16.9810 -16.8277 -16.8277 -5.1345 -5.1345 0.5802 0.5802 0.7005 0.7005 0.7959 0.7959 0.8565 0.8565 0.9577 0.9577 1.3994 1.3994 1.5375 1.5375 2.1887 2.1887 2.4720 2.4720 5.1736 5.1736 5.8093 5.8093 5.8447 5.8447 13.3770 13.3770 13.5235 13.5235 15.8808 15.8808 16.5480 16.5480 16.9391 16.9391 16.9555 16.9555 k = 0.2105 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0820 -67.0820 -67.0798 -67.0798 -67.0776 -67.0776 -34.0507 -34.0507 -34.0433 -34.0433 -34.0360 -34.0360 -33.7980 -33.7980 -33.7915 -33.7915 -33.7814 -33.7814 -33.6957 -33.6957 -33.6825 -33.6825 -33.6688 -33.6688 -17.0670 -17.0670 -16.9794 -16.9794 -16.8306 -16.8306 -5.1310 -5.1310 0.5602 0.5602 0.6911 0.6911 0.7843 0.7843 0.8652 0.8652 0.9618 0.9618 1.4205 1.4205 1.5122 1.5122 2.1775 2.1775 2.4879 2.4879 5.1972 5.1972 5.7924 5.7924 5.8308 5.8308 13.4385 13.4385 13.5258 13.5258 15.8300 15.8300 16.5622 16.5622 16.9309 16.9309 16.9483 16.9483 k = 0.2237 0.5000-0.0000 ( 3876 PWs) bands (ev): -67.0819 -67.0819 -67.0798 -67.0798 -67.0776 -67.0776 -34.0507 -34.0507 -34.0435 -34.0435 -34.0361 -34.0361 -33.7984 -33.7984 -33.7915 -33.7915 -33.7810 -33.7810 -33.6961 -33.6961 -33.6825 -33.6825 -33.6686 -33.6686 -17.0624 -17.0624 -16.9778 -16.9778 -16.8337 -16.8337 -5.1273 -5.1273 0.5412 0.5412 0.6816 0.6816 0.7722 0.7722 0.8742 0.8742 0.9660 0.9660 1.4392 1.4392 1.4888 1.4888 2.1660 2.1660 2.5035 2.5035 5.2212 5.2212 5.7755 5.7755 5.8168 5.8168 13.5028 13.5028 13.5277 13.5277 15.7804 15.7804 16.5771 16.5771 16.9128 16.9128 16.9411 16.9411 k = 0.2368 0.5000-0.0000 ( 3876 PWs) bands (ev): -67.0818 -67.0818 -67.0798 -67.0798 -67.0777 -67.0777 -34.0507 -34.0507 -34.0436 -34.0436 -34.0361 -34.0361 -33.7988 -33.7988 -33.7915 -33.7915 -33.7806 -33.7806 -33.6965 -33.6965 -33.6825 -33.6825 -33.6683 -33.6683 -17.0576 -17.0576 -16.9761 -16.9761 -16.8370 -16.8370 -5.1236 -5.1236 0.5232 0.5232 0.6720 0.6720 0.7597 0.7597 0.8835 0.8835 0.9702 0.9702 1.4466 1.4466 1.4763 1.4763 2.1542 2.1542 2.5186 2.5186 5.2454 5.2454 5.7585 5.7585 5.8025 5.8025 13.5292 13.5292 13.5699 13.5699 15.7324 15.7324 16.5927 16.5927 16.8841 16.8841 16.9341 16.9341 k = 0.2500 0.5000-0.0000 ( 3894 PWs) bands (ev): -67.0817 -67.0817 -67.0798 -67.0798 -67.0778 -67.0778 -34.0508 -34.0508 -34.0437 -34.0437 -34.0362 -34.0362 -33.7992 -33.7992 -33.7916 -33.7916 -33.7802 -33.7802 -33.6969 -33.6969 -33.6826 -33.6826 -33.6681 -33.6681 -17.0526 -17.0526 -16.9744 -16.9744 -16.8404 -16.8404 -5.1199 -5.1199 0.5062 0.5062 0.6622 0.6622 0.7469 0.7469 0.8930 0.8930 0.9745 0.9745 1.4298 1.4298 1.4876 1.4876 2.1420 2.1420 2.5332 2.5332 5.2696 5.2696 5.7415 5.7415 5.7881 5.7881 13.5303 13.5303 13.6394 13.6394 15.6863 15.6863 16.6087 16.6087 16.8449 16.8449 16.9274 16.9274 k = 0.2632 0.5000-0.0000 ( 3876 PWs) bands (ev): -67.0817 -67.0817 -67.0798 -67.0798 -67.0779 -67.0779 -34.0507 -34.0507 -34.0438 -34.0438 -34.0362 -34.0362 -33.7996 -33.7996 -33.7916 -33.7916 -33.7799 -33.7799 -33.6972 -33.6972 -33.6826 -33.6826 -33.6678 -33.6678 -17.0475 -17.0475 -16.9727 -16.9727 -16.8440 -16.8440 -5.1162 -5.1162 0.4903 0.4903 0.6527 0.6527 0.7338 0.7338 0.9028 0.9028 0.9788 0.9788 1.4073 1.4073 1.5046 1.5046 2.1297 2.1297 2.5474 2.5474 5.2936 5.2936 5.7248 5.7248 5.7738 5.7738 13.5309 13.5309 13.7113 13.7113 15.6422 15.6422 16.6255 16.6255 16.7961 16.7961 16.9212 16.9212 k = 0.2763 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0816 -67.0816 -67.0798 -67.0798 -67.0780 -67.0780 -34.0508 -34.0508 -34.0439 -34.0439 -34.0363 -34.0363 -33.7999 -33.7999 -33.7917 -33.7917 -33.7795 -33.7795 -33.6975 -33.6975 -33.6826 -33.6826 -33.6675 -33.6675 -17.0422 -17.0422 -16.9711 -16.9711 -16.8477 -16.8477 -5.1125 -5.1125 0.4756 0.4756 0.6433 0.6433 0.7206 0.7206 0.9128 0.9128 0.9832 0.9832 1.3844 1.3844 1.5217 1.5217 2.1174 2.1174 2.5610 2.5610 5.3174 5.3174 5.7084 5.7084 5.7596 5.7596 13.5311 13.5311 13.7854 13.7854 15.6003 15.6003 16.6426 16.6426 16.7389 16.7389 16.9153 16.9153 k = 0.2895 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0815 -67.0815 -67.0798 -67.0798 -67.0780 -67.0780 -34.0508 -34.0508 -34.0440 -34.0440 -34.0364 -34.0364 -33.8002 -33.8002 -33.7917 -33.7917 -33.7792 -33.7792 -33.6978 -33.6978 -33.6826 -33.6826 -33.6672 -33.6672 -17.0367 -17.0367 -16.9694 -16.9694 -16.8517 -16.8517 -5.1089 -5.1089 0.4621 0.4621 0.6340 0.6340 0.7072 0.7072 0.9228 0.9228 0.9874 0.9874 1.3621 1.3621 1.5382 1.5382 2.1049 2.1049 2.5739 2.5739 5.3407 5.3407 5.6924 5.6924 5.7456 5.7456 13.5307 13.5307 13.8616 13.8616 15.5608 15.5608 16.6594 16.6594 16.6751 16.6751 16.9097 16.9097 k = 0.3026 0.5000-0.0000 ( 3866 PWs) bands (ev): -67.0814 -67.0814 -67.0798 -67.0798 -67.0781 -67.0781 -34.0508 -34.0508 -34.0441 -34.0441 -34.0364 -34.0364 -33.8005 -33.8005 -33.7917 -33.7917 -33.7789 -33.7789 -33.6981 -33.6981 -33.6826 -33.6826 -33.6670 -33.6670 -17.0312 -17.0312 -16.9678 -16.9678 -16.8557 -16.8557 -5.1053 -5.1053 0.4497 0.4497 0.6249 0.6249 0.6938 0.6938 0.9328 0.9328 0.9917 0.9917 1.3406 1.3406 1.5538 1.5538 2.0925 2.0925 2.5863 2.5863 5.3633 5.3633 5.6770 5.6770 5.7320 5.7320 13.5299 13.5299 13.9398 13.9398 15.5238 15.5238 16.6036 16.6036 16.6782 16.6782 16.9044 16.9044 k = 0.3158 0.5000-0.0000 ( 3870 PWs) bands (ev): -67.0813 -67.0813 -67.0798 -67.0798 -67.0782 -67.0782 -34.0508 -34.0508 -34.0442 -34.0442 -34.0365 -34.0365 -33.8008 -33.8008 -33.7918 -33.7918 -33.7786 -33.7786 -33.6984 -33.6984 -33.6826 -33.6826 -33.6667 -33.6667 -17.0255 -17.0255 -16.9662 -16.9662 -16.8600 -16.8600 -5.1018 -5.1018 0.4384 0.4384 0.6161 0.6161 0.6805 0.6805 0.9426 0.9426 0.9957 0.9957 1.3201 1.3201 1.5686 1.5686 2.0803 2.0803 2.5979 2.5979 5.3852 5.3852 5.6621 5.6621 5.7186 5.7186 13.5285 13.5285 14.0197 14.0197 15.4893 15.4893 16.5281 16.5281 16.6960 16.6960 16.8996 16.8996 k = 0.3289 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0812 -67.0812 -67.0798 -67.0798 -67.0783 -67.0783 -34.0508 -34.0508 -34.0442 -34.0442 -34.0366 -34.0366 -33.8011 -33.8011 -33.7918 -33.7918 -33.7783 -33.7783 -33.6987 -33.6987 -33.6827 -33.6827 -33.6665 -33.6665 -17.0197 -17.0197 -16.9647 -16.9647 -16.8644 -16.8644 -5.0985 -5.0985 0.4284 0.4284 0.6076 0.6076 0.6674 0.6674 0.9523 0.9523 0.9996 0.9996 1.3006 1.3006 1.5824 1.5824 2.0682 2.0682 2.6089 2.6089 5.4063 5.4063 5.6480 5.6480 5.7059 5.7059 13.5267 13.5267 14.1013 14.1013 15.4575 15.4575 16.4486 16.4486 16.7139 16.7139 16.8950 16.8950 k = 0.3421 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0811 -67.0811 -67.0798 -67.0798 -67.0784 -67.0784 -34.0509 -34.0509 -34.0443 -34.0443 -34.0367 -34.0367 -33.8014 -33.8014 -33.7918 -33.7918 -33.7781 -33.7781 -33.6990 -33.6990 -33.6827 -33.6827 -33.6663 -33.6663 -17.0138 -17.0138 -16.9633 -16.9633 -16.8689 -16.8689 -5.0953 -5.0953 0.4195 0.4195 0.5994 0.5994 0.6545 0.6545 0.9618 0.9618 1.0034 1.0034 1.2823 1.2823 1.5953 1.5953 2.0565 2.0565 2.6192 2.6192 5.4263 5.4263 5.6346 5.6346 5.6936 5.6936 13.5246 13.5246 14.1845 14.1845 15.4283 15.4283 16.3658 16.3658 16.7318 16.7318 16.8908 16.8908 k = 0.3553 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0810 -67.0810 -67.0798 -67.0798 -67.0785 -67.0785 -34.0509 -34.0509 -34.0443 -34.0443 -34.0368 -34.0368 -33.8016 -33.8016 -33.7919 -33.7919 -33.7778 -33.7778 -33.6992 -33.6992 -33.6827 -33.6827 -33.6661 -33.6661 -17.0079 -17.0079 -16.9619 -16.9619 -16.8736 -16.8736 -5.0923 -5.0923 0.4118 0.4118 0.5917 0.5917 0.6421 0.6421 0.9711 0.9711 1.0070 1.0070 1.2651 1.2651 1.6072 1.6072 2.0453 2.0453 2.6287 2.6287 5.4452 5.4452 5.6220 5.6220 5.6821 5.6821 13.5222 13.5222 14.2691 14.2691 15.4017 15.4017 16.2803 16.2803 16.7494 16.7494 16.8870 16.8870 k = 0.3684 0.5000-0.0000 ( 3872 PWs) bands (ev): -67.0809 -67.0809 -67.0798 -67.0798 -67.0786 -67.0786 -34.0509 -34.0509 -34.0444 -34.0444 -34.0368 -34.0368 -33.8019 -33.8019 -33.7919 -33.7919 -33.7776 -33.7776 -33.6994 -33.6994 -33.6828 -33.6828 -33.6659 -33.6659 -17.0020 -17.0020 -16.9606 -16.9606 -16.8783 -16.8783 -5.0895 -5.0895 0.4051 0.4051 0.5842 0.5842 0.6302 0.6302 0.9799 0.9799 1.0104 1.0104 1.2493 1.2493 1.6181 1.6181 2.0345 2.0345 2.6375 2.6375 5.4629 5.4629 5.6103 5.6103 5.6712 5.6712 13.5195 13.5195 14.3551 14.3551 15.3778 15.3778 16.1927 16.1927 16.7665 16.7665 16.8836 16.8836 k = 0.3816 0.5000-0.0000 ( 3874 PWs) bands (ev): -67.0808 -67.0808 -67.0798 -67.0798 -67.0787 -67.0787 -34.0510 -34.0510 -34.0444 -34.0444 -34.0369 -34.0369 -33.8021 -33.8021 -33.7919 -33.7919 -33.7774 -33.7774 -33.6996 -33.6996 -33.6828 -33.6828 -33.6658 -33.6658 -16.9960 -16.9960 -16.9594 -16.9594 -16.8832 -16.8832 -5.0868 -5.0868 0.3994 0.3994 0.5772 0.5772 0.6190 0.6190 0.9882 0.9882 1.0136 1.0136 1.2348 1.2348 1.6280 1.6280 2.0244 2.0244 2.6454 2.6454 5.4792 5.4792 5.5996 5.5996 5.6612 5.6612 13.5167 13.5167 14.4422 14.4422 15.3564 15.3564 16.1034 16.1034 16.7831 16.7831 16.8805 16.8805 k = 0.3947 0.5000-0.0000 ( 3878 PWs) bands (ev): -67.0807 -67.0807 -67.0798 -67.0798 -67.0788 -67.0788 -34.0510 -34.0510 -34.0444 -34.0444 -34.0370 -34.0370 -33.8023 -33.8023 -33.7919 -33.7919 -33.7773 -33.7773 -33.6998 -33.6998 -33.6829 -33.6829 -33.6656 -33.6656 -16.9901 -16.9901 -16.9583 -16.9583 -16.8882 -16.8882 -5.0844 -5.0844 0.3948 0.3948 0.5705 0.5705 0.6087 0.6087 0.9959 0.9959 1.0164 1.0164 1.2217 1.2217 1.6369 1.6369 2.0150 2.0150 2.6526 2.6526 5.4940 5.4940 5.5899 5.5899 5.6520 5.6520 13.5139 13.5139 14.5305 14.5305 15.3375 15.3375 16.0127 16.0127 16.7988 16.7988 16.8776 16.8777 k = 0.4079 0.5000-0.0000 ( 3878 PWs) bands (ev): -67.0806 -67.0806 -67.0798 -67.0798 -67.0790 -67.0790 -34.0510 -34.0510 -34.0444 -34.0444 -34.0370 -34.0370 -33.8024 -33.8024 -33.7920 -33.7920 -33.7771 -33.7771 -33.7000 -33.7000 -33.6829 -33.6829 -33.6655 -33.6655 -16.9841 -16.9841 -16.9573 -16.9573 -16.8932 -16.8932 -5.0823 -5.0823 0.3910 0.3910 0.5642 0.5642 0.5994 0.5994 1.0029 1.0029 1.0191 1.0191 1.2101 1.2101 1.6447 1.6447 2.0064 2.0064 2.6590 2.6590 5.5073 5.5073 5.5812 5.5812 5.6439 5.6439 13.5111 13.5111 14.6198 14.6198 15.3211 15.3211 15.9209 15.9209 16.8134 16.8134 16.8753 16.8753 k = 0.4211 0.5000-0.0000 ( 3884 PWs) bands (ev): -67.0804 -67.0804 -67.0798 -67.0798 -67.0791 -67.0791 -34.0511 -34.0511 -34.0444 -34.0444 -34.0371 -34.0371 -33.8026 -33.8026 -33.7920 -33.7920 -33.7770 -33.7770 -33.7002 -33.7002 -33.6829 -33.6829 -33.6654 -33.6654 -16.9783 -16.9783 -16.9565 -16.9565 -16.8982 -16.8982 -5.0804 -5.0804 0.3881 0.3881 0.5584 0.5584 0.5913 0.5913 1.0091 1.0091 1.0213 1.0213 1.1999 1.1999 1.6515 1.6515 1.9988 1.9988 2.6645 2.6645 5.5190 5.5190 5.5736 5.5736 5.6366 5.6366 13.5084 13.5084 14.7099 14.7099 15.3070 15.3070 15.8282 15.8282 16.8267 16.8267 16.8731 16.8731 k = 0.4342 0.5000-0.0000 ( 3892 PWs) bands (ev): -67.0803 -67.0803 -67.0798 -67.0798 -67.0792 -67.0792 -34.0511 -34.0511 -34.0445 -34.0445 -34.0372 -34.0372 -33.8027 -33.8027 -33.7920 -33.7920 -33.7769 -33.7769 -33.7003 -33.7003 -33.6829 -33.6829 -33.6653 -33.6653 -16.9727 -16.9727 -16.9557 -16.9557 -16.9032 -16.9032 -5.0787 -5.0787 0.3858 0.3858 0.5531 0.5531 0.5844 0.5844 1.0146 1.0146 1.0233 1.0233 1.1912 1.1912 1.6572 1.6572 1.9921 1.9921 2.6693 2.6693 5.5290 5.5290 5.5671 5.5671 5.6304 5.6304 13.5059 13.5059 14.8009 14.8009 15.2952 15.2952 15.7349 15.7349 16.8385 16.8385 16.8714 16.8714 k = 0.4474 0.5000-0.0000 ( 3888 PWs) bands (ev): -67.0802 -67.0802 -67.0798 -67.0798 -67.0793 -67.0793 -34.0511 -34.0511 -34.0444 -34.0444 -34.0372 -34.0372 -33.8028 -33.8028 -33.7920 -33.7920 -33.7768 -33.7768 -33.7004 -33.7004 -33.6830 -33.6830 -33.6652 -33.6652 -16.9673 -16.9673 -16.9551 -16.9551 -16.9080 -16.9080 -5.0774 -5.0774 0.3842 0.3842 0.5484 0.5484 0.5789 0.5789 1.0190 1.0190 1.0250 1.0250 1.1842 1.1842 1.6619 1.6619 1.9866 1.9866 2.6731 2.6731 5.5373 5.5373 5.5618 5.5618 5.6253 5.6253 13.5039 13.5039 14.8927 14.8927 15.2858 15.2858 15.6412 15.6412 16.8486 16.8486 16.8699 16.8699 k = 0.4605 0.5000-0.0000 ( 3884 PWs) bands (ev): -67.0801 -67.0801 -67.0798 -67.0798 -67.0794 -67.0794 -34.0511 -34.0511 -34.0444 -34.0444 -34.0372 -34.0372 -33.8029 -33.8029 -33.7920 -33.7920 -33.7767 -33.7767 -33.7005 -33.7005 -33.6830 -33.6830 -33.6651 -33.6651 -16.9623 -16.9623 -16.9546 -16.9546 -16.9126 -16.9126 -5.0763 -5.0763 0.3831 0.3831 0.5445 0.5445 0.5746 0.5746 1.0225 1.0225 1.0265 1.0265 1.1787 1.1787 1.6656 1.6656 1.9822 1.9822 2.6762 2.6762 5.5437 5.5437 5.5576 5.5576 5.6212 5.6212 13.5023 13.5023 14.9852 14.9852 15.2784 15.2784 15.5473 15.5473 16.8567 16.8567 16.8688 16.8688 k = 0.4737 0.5000-0.0000 ( 3888 PWs) bands (ev): -67.0800 -67.0800 -67.0798 -67.0798 -67.0795 -67.0795 -34.0512 -34.0512 -34.0444 -34.0444 -34.0373 -34.0373 -33.8029 -33.8029 -33.7920 -33.7920 -33.7767 -33.7767 -33.7005 -33.7005 -33.6830 -33.6830 -33.6651 -33.6651 -16.9581 -16.9581 -16.9543 -16.9543 -16.9165 -16.9165 -5.0756 -5.0756 0.3824 0.3824 0.5415 0.5415 0.5716 0.5716 1.0247 1.0247 1.0278 1.0278 1.1748 1.1748 1.6682 1.6682 1.9790 1.9790 2.6783 2.6783 5.5484 5.5484 5.5546 5.5546 5.6184 5.6184 13.5010 13.5010 15.0781 15.0781 15.2732 15.2732 15.4533 15.4533 16.8626 16.8626 16.8680 16.8680 k = 0.4868 0.5000-0.0000 ( 3900 PWs) bands (ev): -67.0799 -67.0799 -67.0798 -67.0798 -67.0796 -67.0796 -34.0512 -34.0512 -34.0445 -34.0445 -34.0373 -34.0373 -33.8030 -33.8030 -33.7921 -33.7921 -33.7766 -33.7766 -33.7006 -33.7006 -33.6830 -33.6830 -33.6651 -33.6651 -16.9552 -16.9552 -16.9540 -16.9540 -16.9193 -16.9193 -5.0751 -5.0751 0.3820 0.3820 0.5396 0.5396 0.5698 0.5698 1.0259 1.0259 1.0287 1.0287 1.1723 1.1723 1.6698 1.6698 1.9770 1.9770 2.6796 2.6796 5.5510 5.5510 5.5529 5.5529 5.6166 5.6166 13.5002 13.5002 15.1714 15.1714 15.2701 15.2701 15.3593 15.3593 16.8661 16.8661 16.8675 16.8675 k = 0.5000 0.5000-0.0000 ( 3900 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0512 -34.0512 -34.0445 -34.0445 -34.0373 -34.0373 -33.8030 -33.8030 -33.7921 -33.7921 -33.7766 -33.7766 -33.7006 -33.7006 -33.6830 -33.6830 -33.6650 -33.6650 -16.9544 -16.9544 -16.9537 -16.9537 -16.9203 -16.9203 -5.0750 -5.0750 0.3818 0.3818 0.5390 0.5390 0.5692 0.5692 1.0263 1.0263 1.0290 1.0290 1.1715 1.1715 1.6703 1.6703 1.9764 1.9764 2.6800 2.6800 5.5516 5.5516 5.5527 5.5527 5.6160 5.6160 13.5000 13.5000 15.2613 15.2613 15.2667 15.2667 15.2715 15.2715 16.8673 16.8673 16.8674 16.8674 k = 0.5000 0.5000-0.0000 ( 3900 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0512 -34.0512 -34.0445 -34.0445 -34.0373 -34.0373 -33.8030 -33.8030 -33.7921 -33.7921 -33.7766 -33.7766 -33.7006 -33.7006 -33.6830 -33.6830 -33.6650 -33.6650 -16.9544 -16.9544 -16.9537 -16.9537 -16.9203 -16.9203 -5.0750 -5.0750 0.3818 0.3818 0.5390 0.5390 0.5692 0.5692 1.0263 1.0263 1.0290 1.0290 1.1715 1.1715 1.6703 1.6703 1.9764 1.9764 2.6800 2.6800 5.5516 5.5516 5.5527 5.5527 5.6160 5.6160 13.5000 13.5000 15.2613 15.2613 15.2667 15.2667 15.2715 15.2715 16.8673 16.8673 16.8674 16.8674 k = 0.4906 0.4906-0.0000 ( 3900 PWs) bands (ev): -67.0799 -67.0799 -67.0798 -67.0798 -67.0796 -67.0796 -34.0512 -34.0512 -34.0445 -34.0445 -34.0373 -34.0373 -33.8030 -33.8030 -33.7921 -33.7921 -33.7766 -33.7766 -33.7006 -33.7006 -33.6830 -33.6830 -33.6651 -33.6651 -16.9554 -16.9554 -16.9538 -16.9538 -16.9192 -16.9192 -5.0751 -5.0751 0.3820 0.3820 0.5397 0.5397 0.5698 0.5698 1.0258 1.0258 1.0288 1.0288 1.1724 1.1724 1.6698 1.6698 1.9770 1.9770 2.6796 2.6796 5.5510 5.5510 5.5530 5.5530 5.6166 5.6166 13.5002 13.5002 15.1703 15.1703 15.2700 15.2700 15.3606 15.3606 16.8666 16.8666 16.8670 16.8670 k = 0.4811 0.4811-0.0000 ( 3892 PWs) bands (ev): -67.0800 -67.0800 -67.0798 -67.0798 -67.0795 -67.0795 -34.0512 -34.0512 -34.0444 -34.0444 -34.0373 -34.0373 -33.8030 -33.8030 -33.7920 -33.7920 -33.7767 -33.7767 -33.7005 -33.7005 -33.6830 -33.6830 -33.6651 -33.6651 -16.9588 -16.9588 -16.9536 -16.9536 -16.9164 -16.9164 -5.0756 -5.0756 0.3824 0.3824 0.5414 0.5414 0.5718 0.5718 1.0234 1.0234 1.0290 1.0290 1.1748 1.1748 1.6682 1.6682 1.9790 1.9790 2.6783 2.6783 5.5483 5.5483 5.5547 5.5547 5.6184 5.6184 13.5009 13.5009 15.0766 15.0766 15.2727 15.2727 15.4556 15.4556 16.8644 16.8644 16.8660 16.8660 k = 0.4717 0.4717-0.0000 ( 3888 PWs) bands (ev): -67.0801 -67.0801 -67.0797 -67.0797 -67.0794 -67.0794 -34.0511 -34.0511 -34.0444 -34.0444 -34.0372 -34.0372 -33.8029 -33.8029 -33.7920 -33.7920 -33.7767 -33.7767 -33.7005 -33.7005 -33.6830 -33.6830 -33.6651 -33.6651 -16.9638 -16.9638 -16.9531 -16.9531 -16.9126 -16.9126 -5.0764 -5.0764 0.3832 0.3832 0.5439 0.5439 0.5753 0.5753 1.0188 1.0188 1.0300 1.0300 1.1790 1.1790 1.6655 1.6655 1.9823 1.9823 2.6761 2.6761 5.5436 5.5436 5.5577 5.5577 5.6214 5.6214 13.5015 13.5015 14.9848 14.9848 15.2771 15.2771 15.5500 15.5500 16.8606 16.8606 16.8643 16.8643 k = 0.4623 0.4623-0.0000 ( 3872 PWs) bands (ev): -67.0802 -67.0802 -67.0797 -67.0797 -67.0793 -67.0793 -34.0511 -34.0511 -34.0444 -34.0444 -34.0372 -34.0372 -33.8028 -33.8028 -33.7920 -33.7920 -33.7768 -33.7768 -33.7004 -33.7004 -33.6829 -33.6829 -33.6652 -33.6652 -16.9697 -16.9697 -16.9524 -16.9524 -16.9083 -16.9083 -5.0774 -5.0774 0.3846 0.3846 0.5465 0.5465 0.5808 0.5808 1.0122 1.0122 1.0316 1.0316 1.1848 1.1848 1.6618 1.6618 1.9869 1.9869 2.6731 2.6731 5.5372 5.5372 5.5620 5.5620 5.6256 5.6256 13.5014 13.5014 14.8960 14.8960 15.2832 15.2832 15.6432 15.6432 16.8555 16.8555 16.8620 16.8620 k = 0.4528 0.4528-0.0000 ( 3872 PWs) bands (ev): -67.0804 -67.0804 -67.0797 -67.0797 -67.0792 -67.0792 -34.0511 -34.0511 -34.0444 -34.0444 -34.0371 -34.0371 -33.8027 -33.8027 -33.7920 -33.7920 -33.7768 -33.7768 -33.7003 -33.7003 -33.6829 -33.6829 -33.6652 -33.6652 -16.9763 -16.9763 -16.9516 -16.9516 -16.9038 -16.9038 -5.0788 -5.0788 0.3865 0.3865 0.5488 0.5488 0.5882 0.5882 1.0038 1.0038 1.0337 1.0337 1.1925 1.1925 1.6570 1.6570 1.9926 1.9926 2.6692 2.6692 5.5290 5.5290 5.5675 5.5675 5.6309 5.6309 13.4996 13.4996 14.8114 14.8114 15.2909 15.2909 15.7348 15.7348 16.8488 16.8488 16.8590 16.8590 k = 0.4434 0.4434-0.0000 ( 3862 PWs) bands (ev): -67.0805 -67.0805 -67.0797 -67.0797 -67.0791 -67.0791 -34.0510 -34.0510 -34.0444 -34.0444 -34.0370 -34.0370 -33.8025 -33.8025 -33.7919 -33.7919 -33.7770 -33.7770 -33.7001 -33.7001 -33.6829 -33.6829 -33.6653 -33.6653 -16.9833 -16.9833 -16.9505 -16.9505 -16.8993 -16.8993 -5.0804 -5.0804 0.3893 0.3893 0.5507 0.5507 0.5976 0.5976 0.9937 0.9937 1.0363 1.0363 1.2020 1.2020 1.6512 1.6512 1.9994 1.9994 2.6646 2.6646 5.5194 5.5194 5.5742 5.5742 5.6373 5.6373 13.4949 13.4949 14.7326 14.7326 15.3002 15.3002 15.8245 15.8245 16.8407 16.8407 16.8552 16.8552 k = 0.4340 0.4340-0.0000 ( 3862 PWs) bands (ev): -67.0806 -67.0806 -67.0796 -67.0796 -67.0790 -67.0790 -34.0510 -34.0510 -34.0444 -34.0444 -34.0370 -34.0370 -33.8024 -33.8024 -33.7919 -33.7919 -33.7771 -33.7771 -33.7000 -33.7000 -33.6828 -33.6828 -33.6655 -33.6655 -16.9906 -16.9906 -16.9493 -16.9493 -16.8949 -16.8949 -5.0824 -5.0824 0.3929 0.3929 0.5522 0.5522 0.6083 0.6083 0.9819 0.9819 1.0393 1.0393 1.2133 1.2133 1.6444 1.6444 2.0071 2.0071 2.6593 2.6593 5.5085 5.5085 5.5819 5.5819 5.6449 5.6449 13.4855 13.4855 14.6612 14.6612 15.3108 15.3108 15.9120 15.9120 16.8310 16.8310 16.8507 16.8507 k = 0.4245 0.4245-0.0000 ( 3870 PWs) bands (ev): -67.0808 -67.0808 -67.0796 -67.0796 -67.0789 -67.0789 -34.0510 -34.0510 -34.0445 -34.0445 -34.0369 -34.0369 -33.8022 -33.8022 -33.7919 -33.7919 -33.7773 -33.7773 -33.6998 -33.6998 -33.6828 -33.6828 -33.6656 -33.6656 -16.9983 -16.9983 -16.9479 -16.9479 -16.8907 -16.8907 -5.0845 -5.0845 0.3974 0.3974 0.5534 0.5534 0.6202 0.6202 0.9687 0.9687 1.0428 1.0428 1.2266 1.2266 1.6367 1.6367 2.0158 2.0158 2.6533 2.6533 5.4965 5.4965 5.5908 5.5908 5.6535 5.6535 13.4695 13.4695 14.5990 14.5990 15.3228 15.3228 15.9966 15.9966 16.8200 16.8200 16.8455 16.8455 k = 0.4151 0.4151-0.0000 ( 3862 PWs) bands (ev): -67.0809 -67.0809 -67.0796 -67.0796 -67.0788 -67.0788 -34.0509 -34.0509 -34.0445 -34.0445 -34.0368 -34.0368 -33.8020 -33.8020 -33.7919 -33.7919 -33.7774 -33.7774 -33.6997 -33.6997 -33.6827 -33.6827 -33.6657 -33.6657 -17.0062 -17.0062 -16.9463 -16.9463 -16.8866 -16.8866 -5.0868 -5.0868 0.4030 0.4030 0.5544 0.5544 0.6328 0.6328 0.9541 0.9541 1.0467 1.0467 1.2421 1.2421 1.6280 1.6280 2.0254 2.0254 2.6468 2.6468 5.4836 5.4836 5.6008 5.6008 5.6633 5.6633 13.4451 13.4451 14.5480 14.5480 15.3359 15.3359 16.0783 16.0783 16.8075 16.8075 16.8395 16.8395 k = 0.4057 0.4057-0.0000 ( 3860 PWs) bands (ev): -67.0810 -67.0810 -67.0795 -67.0795 -67.0787 -67.0787 -34.0509 -34.0509 -34.0445 -34.0445 -34.0367 -34.0367 -33.8018 -33.8018 -33.7918 -33.7918 -33.7776 -33.7776 -33.6995 -33.6995 -33.6827 -33.6827 -33.6659 -33.6659 -17.0143 -17.0143 -16.9446 -16.9446 -16.8827 -16.8827 -5.0894 -5.0894 0.4096 0.4096 0.5551 0.5551 0.6459 0.6459 0.9382 0.9382 1.0510 1.0510 1.2596 1.2596 1.6185 1.6185 2.0357 2.0357 2.6397 2.6397 5.4701 5.4701 5.6119 5.6119 5.6740 5.6740 13.4108 13.4108 14.5097 14.5097 15.3499 15.3499 16.1565 16.1565 16.7937 16.7937 16.8327 16.8327 k = 0.3962 0.3962-0.0000 ( 3864 PWs) bands (ev): -67.0812 -67.0812 -67.0795 -67.0795 -67.0786 -67.0786 -34.0508 -34.0508 -34.0445 -34.0445 -34.0365 -34.0365 -33.8016 -33.8016 -33.7918 -33.7918 -33.7778 -33.7778 -33.6993 -33.6993 -33.6826 -33.6826 -33.6661 -33.6661 -17.0226 -17.0226 -16.9427 -16.9427 -16.8790 -16.8790 -5.0921 -5.0921 0.4170 0.4170 0.5555 0.5555 0.6592 0.6592 0.9212 0.9212 1.0557 1.0557 1.2793 1.2793 1.6082 1.6082 2.0466 2.0466 2.6322 2.6322 5.4563 5.4563 5.6239 5.6239 5.6857 5.6857 13.3657 13.3657 14.4847 14.4847 15.3647 15.3647 16.2311 16.2311 16.7784 16.7784 16.8251 16.8251 k = 0.3868 0.3868-0.0000 ( 3870 PWs) bands (ev): -67.0813 -67.0813 -67.0794 -67.0794 -67.0785 -67.0785 -34.0508 -34.0508 -34.0446 -34.0446 -34.0364 -34.0364 -33.8014 -33.8014 -33.7918 -33.7918 -33.7781 -33.7781 -33.6991 -33.6991 -33.6826 -33.6826 -33.6663 -33.6663 -17.0311 -17.0311 -16.9406 -16.9406 -16.8755 -16.8755 -5.0949 -5.0949 0.4254 0.4254 0.5557 0.5557 0.6724 0.6724 0.9033 0.9033 1.0608 1.0608 1.3011 1.3011 1.5972 1.5972 2.0581 2.0581 2.6242 2.6242 5.4424 5.4424 5.6369 5.6369 5.6983 5.6983 13.3097 13.3097 14.4731 14.4731 15.3801 15.3801 16.3018 16.3018 16.7619 16.7619 16.8166 16.8166 k = 0.3774 0.3774-0.0000 ( 3876 PWs) bands (ev): -67.0815 -67.0815 -67.0794 -67.0794 -67.0785 -67.0785 -34.0508 -34.0508 -34.0446 -34.0446 -34.0362 -34.0362 -33.8011 -33.8011 -33.7918 -33.7918 -33.7783 -33.7783 -33.6989 -33.6989 -33.6825 -33.6825 -33.6664 -33.6664 -17.0397 -17.0397 -16.9384 -16.9384 -16.8722 -16.8722 -5.0979 -5.0979 0.4345 0.4345 0.5556 0.5556 0.6856 0.6856 0.8844 0.8844 1.0662 1.0662 1.3250 1.3250 1.5855 1.5855 2.0700 2.0700 2.6160 2.6160 5.4287 5.4287 5.6508 5.6508 5.7118 5.7118 13.2436 13.2436 14.4740 14.4740 15.3958 15.3958 16.3681 16.3681 16.7442 16.7442 16.8071 16.8071 k = 0.3679 0.3679-0.0000 ( 3878 PWs) bands (ev): -67.0816 -67.0816 -67.0793 -67.0793 -67.0784 -67.0784 -34.0507 -34.0507 -34.0447 -34.0447 -34.0361 -34.0361 -33.8009 -33.8009 -33.7918 -33.7918 -33.7786 -33.7786 -33.6987 -33.6987 -33.6824 -33.6824 -33.6666 -33.6666 -17.0485 -17.0485 -16.9361 -16.9361 -16.8691 -16.8691 -5.1009 -5.1009 0.4442 0.4442 0.5553 0.5553 0.6987 0.6987 0.8648 0.8648 1.0720 1.0720 1.3509 1.3509 1.5732 1.5732 2.0823 2.0823 2.6076 2.6076 5.4156 5.4156 5.6656 5.6656 5.7261 5.7261 13.1687 13.1687 14.4858 14.4858 15.4117 15.4117 16.4299 16.4299 16.7252 16.7252 16.7967 16.7967 k = 0.3585 0.3585-0.0000 ( 3868 PWs) bands (ev): -67.0817 -67.0817 -67.0792 -67.0792 -67.0783 -67.0783 -34.0507 -34.0507 -34.0448 -34.0448 -34.0358 -34.0358 -33.8006 -33.8006 -33.7917 -33.7917 -33.7788 -33.7788 -33.6985 -33.6985 -33.6822 -33.6822 -33.6668 -33.6668 -17.0573 -17.0573 -16.9336 -16.9336 -16.8661 -16.8661 -5.1040 -5.1040 0.4543 0.4543 0.5546 0.5546 0.7115 0.7115 0.8447 0.8447 1.0781 1.0781 1.3788 1.3788 1.5605 1.5605 2.0951 2.0951 2.5990 2.5990 5.4033 5.4033 5.6813 5.6813 5.7412 5.7412 13.0863 13.0863 14.5070 14.5070 15.4275 15.4275 16.4869 16.4869 16.7050 16.7050 16.7852 16.7852 k = 0.3491 0.3491-0.0000 ( 3870 PWs) bands (ev): -67.0819 -67.0819 -67.0792 -67.0792 -67.0782 -67.0782 -34.0506 -34.0506 -34.0449 -34.0449 -34.0356 -34.0356 -33.8003 -33.8003 -33.7917 -33.7917 -33.7791 -33.7791 -33.6983 -33.6983 -33.6821 -33.6821 -33.6670 -33.6670 -17.0663 -17.0663 -16.9310 -16.9310 -16.8635 -16.8635 -5.1071 -5.1071 0.4645 0.4645 0.5534 0.5534 0.7242 0.7242 0.8239 0.8239 1.0845 1.0845 1.4084 1.4084 1.5476 1.5476 2.1080 2.1080 2.5904 2.5904 5.3922 5.3922 5.6977 5.6977 5.7570 5.7570 12.9980 12.9980 14.5359 14.5359 15.4428 15.4428 16.5386 16.5386 16.6838 16.6838 16.7726 16.7726 k = 0.3396 0.3396-0.0000 ( 3870 PWs) bands (ev): -67.0820 -67.0820 -67.0791 -67.0791 -67.0782 -67.0782 -34.0506 -34.0506 -34.0450 -34.0450 -34.0354 -34.0354 -33.8000 -33.8000 -33.7916 -33.7916 -33.7794 -33.7794 -33.6981 -33.6981 -33.6819 -33.6819 -33.6672 -33.6672 -17.0753 -17.0753 -16.9282 -16.9282 -16.8609 -16.8609 -5.1102 -5.1102 0.4747 0.4747 0.5519 0.5519 0.7368 0.7368 0.8030 0.8030 1.0912 1.0912 1.4395 1.4395 1.5346 1.5346 2.1210 2.1210 2.5816 2.5816 5.3826 5.3826 5.7148 5.7148 5.7734 5.7734 12.9050 12.9050 14.5710 14.5710 15.4575 15.4575 16.5850 16.5850 16.6615 16.6615 16.7587 16.7587 k = 0.3302 0.3302-0.0000 ( 3858 PWs) bands (ev): -67.0822 -67.0822 -67.0790 -67.0790 -67.0781 -67.0781 -34.0505 -34.0505 -34.0450 -34.0450 -34.0351 -34.0351 -33.7996 -33.7996 -33.7916 -33.7916 -33.7797 -33.7797 -33.6979 -33.6979 -33.6817 -33.6817 -33.6674 -33.6674 -17.0844 -17.0844 -16.9254 -16.9254 -16.8586 -16.8586 -5.1133 -5.1133 0.4845 0.4845 0.5498 0.5498 0.7487 0.7487 0.7826 0.7826 1.0983 1.0983 1.4710 1.4710 1.5225 1.5225 2.1343 2.1343 2.5729 2.5729 5.3747 5.3747 5.7326 5.7326 5.7905 5.7905 12.8083 12.8083 14.6111 14.6111 15.4714 15.4714 16.6252 16.6252 16.6387 16.6387 16.7435 16.7435 k = 0.3208 0.3208-0.0000 ( 3866 PWs) bands (ev): -67.0823 -67.0823 -67.0790 -67.0790 -67.0780 -67.0780 -34.0505 -34.0505 -34.0452 -34.0452 -34.0348 -34.0348 -33.7993 -33.7993 -33.7915 -33.7915 -33.7800 -33.7800 -33.6978 -33.6978 -33.6815 -33.6815 -33.6675 -33.6675 -17.0935 -17.0935 -16.9225 -16.9225 -16.8565 -16.8565 -5.1163 -5.1163 0.4934 0.4934 0.5472 0.5472 0.7521 0.7521 0.7710 0.7710 1.1054 1.1054 1.4938 1.4938 1.5203 1.5203 2.1475 2.1475 2.5643 2.5643 5.3688 5.3688 5.7509 5.7509 5.8081 5.8081 12.7090 12.7090 14.6547 14.6547 15.4838 15.4838 16.6134 16.6134 16.6608 16.6608 16.7270 16.7270 k = 0.3113 0.3113-0.0000 ( 3862 PWs) bands (ev): -67.0824 -67.0824 -67.0789 -67.0789 -67.0780 -67.0780 -34.0504 -34.0504 -34.0453 -34.0453 -34.0346 -34.0346 -33.7989 -33.7989 -33.7915 -33.7915 -33.7804 -33.7804 -33.6977 -33.6977 -33.6813 -33.6813 -33.6677 -33.6677 -17.1026 -17.1026 -16.9195 -16.9195 -16.8545 -16.8545 -5.1193 -5.1193 0.5014 0.5014 0.5439 0.5439 0.7345 0.7345 0.7810 0.7810 1.1128 1.1128 1.4881 1.4881 1.5478 1.5478 2.1607 2.1607 2.5558 2.5558 5.3652 5.3652 5.7699 5.7699 5.8262 5.8262 12.6075 12.6075 14.7012 14.7012 15.4949 15.4949 16.5883 16.5883 16.6889 16.6889 16.7094 16.7094 k = 0.3019 0.3019-0.0000 ( 3866 PWs) bands (ev): -67.0826 -67.0826 -67.0788 -67.0788 -67.0779 -67.0779 -34.0504 -34.0504 -34.0454 -34.0454 -34.0343 -34.0343 -33.7986 -33.7986 -33.7914 -33.7914 -33.7807 -33.7807 -33.6976 -33.6976 -33.6810 -33.6810 -33.6679 -33.6679 -17.1117 -17.1117 -16.9164 -16.9164 -16.8527 -16.8527 -5.1221 -5.1221 0.5081 0.5081 0.5400 0.5400 0.7130 0.7130 0.7954 0.7954 1.1204 1.1204 1.4757 1.4757 1.5831 1.5831 2.1740 2.1740 2.5474 2.5474 5.3641 5.3641 5.7893 5.7893 5.8446 5.8446 12.5046 12.5046 14.7496 14.7496 15.5042 15.5042 16.5624 16.5624 16.6889 16.6889 16.7117 16.7117 k = 0.2925 0.2925-0.0000 ( 3866 PWs) bands (ev): -67.0827 -67.0827 -67.0787 -67.0787 -67.0778 -67.0778 -34.0504 -34.0504 -34.0456 -34.0456 -34.0340 -34.0340 -33.7983 -33.7983 -33.7914 -33.7914 -33.7810 -33.7810 -33.6975 -33.6975 -33.6807 -33.6807 -33.6681 -33.6681 -17.1208 -17.1208 -16.9132 -16.9132 -16.8511 -16.8511 -5.1249 -5.1249 0.5132 0.5132 0.5355 0.5355 0.6911 0.6911 0.8113 0.8113 1.1282 1.1282 1.4627 1.4627 1.6200 1.6200 2.1871 2.1871 2.5393 2.5393 5.3658 5.3658 5.8092 5.8092 5.8635 5.8635 12.4007 12.4007 14.7992 14.7992 15.5115 15.5115 16.5357 16.5357 16.6682 16.6682 16.7262 16.7262 k = 0.2830 0.2830-0.0000 ( 3860 PWs) bands (ev): -67.0829 -67.0829 -67.0787 -67.0787 -67.0778 -67.0778 -34.0503 -34.0503 -34.0457 -34.0457 -34.0337 -34.0337 -33.7979 -33.7979 -33.7913 -33.7913 -33.7813 -33.7813 -33.6975 -33.6975 -33.6804 -33.6804 -33.6682 -33.6682 -17.1299 -17.1299 -16.9100 -16.9100 -16.8496 -16.8496 -5.1275 -5.1275 0.5165 0.5165 0.5303 0.5303 0.6693 0.6693 0.8284 0.8284 1.1362 1.1362 1.4498 1.4498 1.6577 1.6577 2.2002 2.2002 2.5314 2.5314 5.3704 5.3704 5.8295 5.8295 5.8826 5.8826 12.2962 12.2962 14.8493 14.8493 15.5165 15.5165 16.5084 16.5084 16.6458 16.6458 16.7332 16.7332 k = 0.2736 0.2736-0.0000 ( 3862 PWs) bands (ev): -67.0830 -67.0830 -67.0786 -67.0786 -67.0777 -67.0777 -34.0503 -34.0503 -34.0459 -34.0459 -34.0334 -34.0334 -33.7976 -33.7976 -33.7913 -33.7913 -33.7816 -33.7816 -33.6974 -33.6974 -33.6801 -33.6801 -33.6684 -33.6684 -17.1389 -17.1389 -16.9067 -16.9067 -16.8483 -16.8483 -5.1299 -5.1299 0.5179 0.5179 0.5246 0.5246 0.6473 0.6473 0.8467 0.8467 1.1442 1.1442 1.4371 1.4371 1.6959 1.6959 2.2131 2.2131 2.5237 2.5237 5.3781 5.3781 5.8502 5.8502 5.9020 5.9020 12.1914 12.1914 14.8992 14.8992 15.5191 15.5191 16.4806 16.4806 16.6217 16.6217 16.7319 16.7319 k = 0.2642 0.2642-0.0000 ( 3858 PWs) bands (ev): -67.0831 -67.0831 -67.0785 -67.0785 -67.0777 -67.0777 -34.0503 -34.0503 -34.0461 -34.0461 -34.0330 -34.0330 -33.7972 -33.7972 -33.7913 -33.7913 -33.7820 -33.7820 -33.6975 -33.6975 -33.6797 -33.6797 -33.6685 -33.6685 -17.1478 -17.1478 -16.9034 -16.9034 -16.8471 -16.8471 -5.1321 -5.1321 0.5159 0.5159 0.5196 0.5196 0.6256 0.6256 0.8661 0.8661 1.1524 1.1524 1.4249 1.4249 1.7344 1.7344 2.2258 2.2258 2.5163 2.5163 5.3890 5.3890 5.8711 5.8711 5.9215 5.9215 12.0865 12.0865 14.9483 14.9483 15.5190 15.5190 16.4523 16.4523 16.5961 16.5961 16.7217 16.7217 k = 0.2547 0.2547-0.0000 ( 3874 PWs) bands (ev): -67.0833 -67.0833 -67.0784 -67.0784 -67.0776 -67.0776 -34.0503 -34.0503 -34.0463 -34.0463 -34.0327 -34.0327 -33.7969 -33.7969 -33.7912 -33.7912 -33.7823 -33.7823 -33.6975 -33.6975 -33.6793 -33.6793 -33.6686 -33.6686 -17.1567 -17.1567 -16.9001 -16.9001 -16.8461 -16.8461 -5.1342 -5.1342 0.5092 0.5092 0.5165 0.5165 0.6041 0.6041 0.8865 0.8865 1.1604 1.1604 1.4132 1.4132 1.7729 1.7729 2.2383 2.2383 2.5092 2.5092 5.4031 5.4031 5.8922 5.8922 5.9411 5.9411 11.9819 11.9819 14.9961 14.9961 15.5162 15.5162 16.4236 16.4236 16.5691 16.5691 16.7021 16.7021 k = 0.2453 0.2453-0.0000 ( 3874 PWs) bands (ev): -67.0834 -67.0834 -67.0783 -67.0783 -67.0776 -67.0776 -34.0502 -34.0502 -34.0465 -34.0465 -34.0324 -34.0324 -33.7965 -33.7965 -33.7912 -33.7912 -33.7826 -33.7826 -33.6976 -33.6976 -33.6789 -33.6789 -33.6688 -33.6688 -17.1654 -17.1654 -16.8968 -16.8968 -16.8452 -16.8452 -5.1361 -5.1361 0.5011 0.5011 0.5125 0.5125 0.5829 0.5829 0.9078 0.9078 1.1687 1.1687 1.4021 1.4021 1.8113 1.8113 2.2505 2.2505 2.5024 2.5024 5.4206 5.4206 5.9134 5.9134 5.9607 5.9607 11.8778 11.8778 15.0419 15.0419 15.5104 15.5104 16.3947 16.3947 16.5407 16.5407 16.6733 16.6733 k = 0.2358 0.2358-0.0000 ( 3870 PWs) bands (ev): -67.0835 -67.0835 -67.0783 -67.0783 -67.0775 -67.0775 -34.0502 -34.0502 -34.0466 -34.0466 -34.0320 -34.0320 -33.7962 -33.7962 -33.7912 -33.7912 -33.7829 -33.7829 -33.6977 -33.6977 -33.6784 -33.6784 -33.6688 -33.6688 -17.1739 -17.1739 -16.8935 -16.8935 -16.8444 -16.8444 -5.1378 -5.1378 0.4924 0.4924 0.5071 0.5071 0.5620 0.5620 0.9298 0.9298 1.1769 1.1769 1.3918 1.3918 1.8494 1.8494 2.2626 2.2626 2.4960 2.4960 5.4415 5.4415 5.9347 5.9347 5.9803 5.9803 11.7742 11.7742 15.0851 15.0851 15.5018 15.5018 16.3658 16.3658 16.5109 16.5109 16.6361 16.6361 k = 0.2264 0.2264-0.0000 ( 3870 PWs) bands (ev): -67.0837 -67.0837 -67.0782 -67.0782 -67.0775 -67.0775 -34.0502 -34.0502 -34.0468 -34.0468 -34.0317 -34.0317 -33.7959 -33.7959 -33.7911 -33.7911 -33.7832 -33.7832 -33.6978 -33.6978 -33.6780 -33.6780 -33.6689 -33.6689 -17.1823 -17.1823 -16.8902 -16.8902 -16.8437 -16.8437 -5.1393 -5.1393 0.4827 0.4827 0.5001 0.5001 0.5416 0.5416 0.9524 0.9524 1.1852 1.1852 1.3822 1.3822 1.8871 1.8871 2.2743 2.2743 2.4899 2.4899 5.4657 5.4657 5.9561 5.9561 5.9998 5.9998 11.6715 11.6715 15.1253 15.1253 15.4902 15.4902 16.3368 16.3368 16.4800 16.4800 16.5923 16.5923 k = 0.2170 0.2170-0.0000 ( 3870 PWs) bands (ev): -67.0838 -67.0838 -67.0781 -67.0781 -67.0774 -67.0774 -34.0502 -34.0502 -34.0470 -34.0470 -34.0314 -34.0314 -33.7956 -33.7956 -33.7911 -33.7911 -33.7835 -33.7835 -33.6979 -33.6979 -33.6775 -33.6775 -33.6690 -33.6690 -17.1906 -17.1906 -16.8869 -16.8869 -16.8431 -16.8431 -5.1406 -5.1406 0.4725 0.4725 0.4919 0.4919 0.5216 0.5216 0.9753 0.9753 1.1934 1.1934 1.3732 1.3732 1.9243 1.9243 2.2857 2.2857 2.4841 2.4841 5.4931 5.4931 5.9773 5.9773 6.0192 6.0192 11.5699 11.5699 15.1617 15.1617 15.4757 15.4757 16.3079 16.3079 16.4481 16.4481 16.5437 16.5437 k = 0.2075 0.2075-0.0000 ( 3872 PWs) bands (ev): -67.0839 -67.0839 -67.0780 -67.0780 -67.0774 -67.0774 -34.0502 -34.0502 -34.0472 -34.0472 -34.0310 -34.0310 -33.7953 -33.7953 -33.7911 -33.7911 -33.7838 -33.7838 -33.6981 -33.6981 -33.6770 -33.6770 -33.6691 -33.6691 -17.1986 -17.1986 -16.8837 -16.8837 -16.8426 -16.8426 -5.1417 -5.1417 0.4617 0.4617 0.4824 0.4824 0.5022 0.5022 0.9983 0.9983 1.2014 1.2014 1.3650 1.3650 1.9608 1.9608 2.2967 2.2967 2.4786 2.4786 5.5236 5.5236 5.9985 5.9985 6.0383 6.0383 11.4694 11.4694 15.1938 15.1938 15.4585 15.4585 16.2792 16.2792 16.4153 16.4153 16.4923 16.4923 k = 0.1981 0.1981-0.0000 ( 3870 PWs) bands (ev): -67.0840 -67.0840 -67.0779 -67.0779 -67.0774 -67.0774 -34.0501 -34.0501 -34.0474 -34.0474 -34.0307 -34.0307 -33.7950 -33.7950 -33.7911 -33.7911 -33.7840 -33.7840 -33.6982 -33.6982 -33.6765 -33.6765 -33.6692 -33.6692 -17.2064 -17.2064 -16.8805 -16.8805 -16.8422 -16.8422 -5.1426 -5.1426 0.4504 0.4504 0.4719 0.4719 0.4834 0.4834 1.0213 1.0213 1.2094 1.2094 1.3577 1.3577 1.9965 1.9965 2.3074 2.3074 2.4735 2.4735 5.5571 5.5571 6.0194 6.0194 6.0571 6.0571 11.3703 11.3703 15.2209 15.2209 15.4388 15.4388 16.2508 16.2508 16.3819 16.3819 16.4398 16.4398 k = 0.1887 0.1887-0.0000 ( 3874 PWs) bands (ev): -67.0842 -67.0842 -67.0779 -67.0779 -67.0773 -67.0773 -34.0501 -34.0501 -34.0476 -34.0476 -34.0304 -34.0304 -33.7947 -33.7947 -33.7911 -33.7911 -33.7842 -33.7842 -33.6984 -33.6984 -33.6760 -33.6760 -33.6692 -33.6692 -17.2140 -17.2140 -16.8773 -16.8773 -16.8418 -16.8418 -5.1433 -5.1433 0.4387 0.4387 0.4605 0.4605 0.4651 0.4651 1.0442 1.0442 1.2172 1.2172 1.3510 1.3510 2.0314 2.0314 2.3178 2.3178 2.4687 2.4687 5.5933 5.5933 6.0401 6.0401 6.0756 6.0756 11.2728 11.2728 15.2428 15.2428 15.4168 15.4168 16.2228 16.2228 16.3479 16.3479 16.3876 16.3876 k = 0.1792 0.1792-0.0000 ( 3876 PWs) bands (ev): -67.0843 -67.0843 -67.0778 -67.0778 -67.0773 -67.0773 -34.0501 -34.0501 -34.0478 -34.0478 -34.0301 -34.0301 -33.7944 -33.7944 -33.7911 -33.7911 -33.7844 -33.7844 -33.6986 -33.6986 -33.6755 -33.6755 -33.6693 -33.6693 -17.2213 -17.2213 -16.8743 -16.8743 -16.8416 -16.8416 -5.1438 -5.1438 0.4267 0.4267 0.4475 0.4475 0.4485 0.4485 1.0667 1.0667 1.2248 1.2248 1.3451 1.3451 2.0654 2.0654 2.3277 2.3277 2.4643 2.4643 5.6321 5.6321 6.0604 6.0604 6.0937 6.0937 11.1771 11.1771 15.2589 15.2589 15.3927 15.3927 16.1954 16.1954 16.3136 16.3136 16.3367 16.3367 k = 0.1698 0.1698-0.0000 ( 3868 PWs) bands (ev): -67.0844 -67.0844 -67.0777 -67.0777 -67.0773 -67.0773 -34.0501 -34.0501 -34.0480 -34.0480 -34.0298 -34.0298 -33.7942 -33.7942 -33.7911 -33.7911 -33.7846 -33.7846 -33.6988 -33.6988 -33.6749 -33.6749 -33.6693 -33.6693 -17.2284 -17.2284 -16.8713 -16.8713 -16.8414 -16.8414 -5.1442 -5.1442 0.4145 0.4145 0.4307 0.4307 0.4360 0.4360 1.0888 1.0888 1.2323 1.2323 1.3398 1.3398 2.0984 2.0984 2.3372 2.3372 2.4602 2.4602 5.6731 5.6731 6.0803 6.0803 6.1113 6.1113 11.0834 11.0834 15.2689 15.2689 15.3670 15.3670 16.1686 16.1686 16.2790 16.2790 16.2882 16.2882 k = 0.1604 0.1604-0.0000 ( 3868 PWs) bands (ev): -67.0845 -67.0845 -67.0777 -67.0777 -67.0772 -67.0772 -34.0501 -34.0501 -34.0482 -34.0482 -34.0295 -34.0295 -33.7939 -33.7939 -33.7911 -33.7911 -33.7847 -33.7847 -33.6990 -33.6990 -33.6744 -33.6744 -33.6694 -33.6694 -17.2352 -17.2352 -16.8684 -16.8684 -16.8412 -16.8412 -5.1444 -5.1444 0.4022 0.4022 0.4146 0.4146 0.4230 0.4230 1.1102 1.1102 1.2395 1.2395 1.3352 1.3352 2.1302 2.1302 2.3463 2.3463 2.4564 2.4564 5.7159 5.7159 6.0997 6.0997 6.1284 6.1284 10.9919 10.9919 15.2728 15.2728 15.3398 15.3398 16.1426 16.1426 16.2405 16.2405 16.2466 16.2466 k = 0.1509 0.1509-0.0000 ( 3872 PWs) bands (ev): -67.0846 -67.0846 -67.0776 -67.0776 -67.0772 -67.0772 -34.0501 -34.0501 -34.0484 -34.0484 -34.0292 -34.0292 -33.7938 -33.7938 -33.7912 -33.7912 -33.7848 -33.7848 -33.6992 -33.6992 -33.6739 -33.6739 -33.6694 -33.6694 -17.2417 -17.2417 -16.8656 -16.8656 -16.8412 -16.8412 -5.1445 -5.1445 0.3899 0.3899 0.3992 0.3992 0.4098 0.4098 1.1309 1.1309 1.2464 1.2464 1.3313 1.3313 2.1607 2.1607 2.3549 2.3549 2.4529 2.4529 5.7603 5.7603 6.1185 6.1185 6.1448 6.1448 10.9028 10.9028 15.2707 15.2707 15.3117 15.3117 16.1174 16.1174 16.1980 16.1980 16.2125 16.2125 k = 0.1415 0.1415-0.0000 ( 3862 PWs) bands (ev): -67.0847 -67.0847 -67.0775 -67.0775 -67.0772 -67.0772 -34.0501 -34.0501 -34.0486 -34.0486 -34.0289 -34.0289 -33.7935 -33.7935 -33.7912 -33.7912 -33.7849 -33.7849 -33.6994 -33.6994 -33.6734 -33.6734 -33.6694 -33.6694 -17.2478 -17.2478 -16.8629 -16.8629 -16.8411 -16.8411 -5.1444 -5.1444 0.3776 0.3776 0.3848 0.3848 0.3966 0.3966 1.1508 1.1508 1.2531 1.2531 1.3279 1.3279 2.1899 2.1899 2.3631 2.3631 2.4499 2.4499 5.8058 5.8058 6.1366 6.1366 6.1607 6.1607 10.8164 10.8164 15.2630 15.2630 15.2830 15.2830 16.0932 16.0932 16.1585 16.1585 16.1795 16.1795 k = 0.1321 0.1321-0.0000 ( 3866 PWs) bands (ev): -67.0848 -67.0848 -67.0775 -67.0775 -67.0772 -67.0772 -34.0501 -34.0501 -34.0488 -34.0488 -34.0286 -34.0286 -33.7934 -33.7934 -33.7913 -33.7913 -33.7849 -33.7849 -33.6996 -33.6996 -33.6730 -33.6730 -33.6694 -33.6694 -17.2537 -17.2537 -16.8604 -16.8604 -16.8411 -16.8411 -5.1442 -5.1442 0.3655 0.3655 0.3712 0.3712 0.3834 0.3834 1.1697 1.1697 1.2594 1.2594 1.3251 1.3251 2.2177 2.2177 2.3708 2.3708 2.4471 2.4471 5.8519 5.8519 6.1540 6.1540 6.1758 6.1758 10.7331 10.7331 15.2501 15.2501 15.2540 15.2540 16.0700 16.0700 16.1222 16.1222 16.1475 16.1475 k = 0.1226 0.1226-0.0000 ( 3870 PWs) bands (ev): -67.0848 -67.0848 -67.0774 -67.0774 -67.0771 -67.0771 -34.0501 -34.0501 -34.0489 -34.0489 -34.0284 -34.0284 -33.7932 -33.7932 -33.7914 -33.7914 -33.7850 -33.7850 -33.6998 -33.6998 -33.6725 -33.6725 -33.6694 -33.6694 -17.2592 -17.2592 -16.8580 -16.8580 -16.8411 -16.8411 -5.1440 -5.1440 0.3536 0.3536 0.3584 0.3584 0.3705 0.3705 1.1875 1.1875 1.2653 1.2653 1.3228 1.3228 2.2441 2.2441 2.3780 2.3780 2.4446 2.4446 5.8983 5.8983 6.1706 6.1706 6.1902 6.1902 10.6530 10.6530 15.2252 15.2252 15.2330 15.2330 16.0479 16.0479 16.0893 16.0893 16.1166 16.1166 k = 0.1132 0.1132-0.0000 ( 3858 PWs) bands (ev): -67.0849 -67.0849 -67.0773 -67.0773 -67.0771 -67.0771 -34.0501 -34.0501 -34.0491 -34.0491 -34.0281 -34.0281 -33.7931 -33.7931 -33.7915 -33.7915 -33.7849 -33.7849 -33.7000 -33.7000 -33.6721 -33.6721 -33.6694 -33.6694 -17.2644 -17.2644 -16.8557 -16.8557 -16.8411 -16.8411 -5.1436 -5.1436 0.3423 0.3423 0.3466 0.3466 0.3580 0.3580 1.2043 1.2043 1.2709 1.2709 1.3211 1.3211 2.2688 2.2688 2.3848 2.3848 2.4426 2.4426 5.9445 5.9445 6.1863 6.1863 6.2037 6.2037 10.5765 10.5765 15.1969 15.1969 15.2124 15.2124 16.0271 16.0271 16.0596 16.0596 16.0872 16.0872 k = 0.1038 0.1038-0.0000 ( 3861 PWs) bands (ev): -67.0850 -67.0850 -67.0773 -67.0773 -67.0771 -67.0771 -34.0501 -34.0501 -34.0492 -34.0492 -34.0279 -34.0279 -33.7929 -33.7929 -33.7916 -33.7916 -33.7850 -33.7850 -33.7002 -33.7002 -33.6717 -33.6717 -33.6694 -33.6694 -17.2692 -17.2692 -16.8536 -16.8536 -16.8412 -16.8412 -5.1433 -5.1433 0.3315 0.3315 0.3356 0.3356 0.3460 0.3460 1.2198 1.2198 1.2760 1.2760 1.3197 1.3197 2.2918 2.2918 2.3911 2.3911 2.4407 2.4407 5.9898 5.9898 6.2010 6.2010 6.2165 6.2165 10.5041 10.5041 15.1695 15.1695 15.1893 15.1893 16.0077 16.0077 16.0329 16.0329 16.0593 16.0593 k = 0.0943 0.0943-0.0000 ( 3857 PWs) bands (ev): -67.0851 -67.0851 -67.0772 -67.0772 -67.0771 -67.0771 -34.0501 -34.0501 -34.0493 -34.0493 -34.0277 -34.0277 -33.7928 -33.7928 -33.7917 -33.7917 -33.7849 -33.7849 -33.7004 -33.7004 -33.6713 -33.6713 -33.6694 -33.6694 -17.2736 -17.2736 -16.8516 -16.8516 -16.8413 -16.8413 -5.1428 -5.1428 0.3214 0.3214 0.3253 0.3253 0.3346 0.3346 1.2341 1.2341 1.2806 1.2806 1.3189 1.3189 2.3129 2.3129 2.3969 2.3969 2.4393 2.4393 6.0339 6.0339 6.2146 6.2146 6.2283 6.2283 10.4359 10.4359 15.1433 15.1433 15.1648 15.1648 15.9896 15.9896 16.0090 16.0090 16.0332 16.0332 k = 0.0849 0.0849-0.0000 ( 3859 PWs) bands (ev): -67.0851 -67.0851 -67.0772 -67.0772 -67.0771 -67.0771 -34.0501 -34.0501 -34.0495 -34.0495 -34.0275 -34.0275 -33.7927 -33.7927 -33.7918 -33.7918 -33.7849 -33.7849 -33.7005 -33.7005 -33.6710 -33.6710 -33.6694 -33.6694 -17.2776 -17.2776 -16.8498 -16.8498 -16.8414 -16.8414 -5.1424 -5.1424 0.3121 0.3121 0.3158 0.3158 0.3240 0.3240 1.2469 1.2469 1.2847 1.2847 1.3186 1.3186 2.3320 2.3320 2.4023 2.4023 2.4382 2.4382 6.0760 6.0760 6.2271 6.2271 6.2392 6.2392 10.3725 10.3725 15.1186 15.1186 15.1397 15.1397 15.9730 15.9730 15.9878 15.9878 16.0090 16.0090 k = 0.0755 0.0755-0.0000 ( 3861 PWs) bands (ev): -67.0852 -67.0852 -67.0772 -67.0772 -67.0771 -67.0771 -34.0501 -34.0501 -34.0496 -34.0496 -34.0274 -34.0274 -33.7926 -33.7926 -33.7919 -33.7919 -33.7849 -33.7849 -33.7007 -33.7007 -33.6707 -33.6707 -33.6694 -33.6694 -17.2812 -17.2812 -16.8482 -16.8482 -16.8414 -16.8414 -5.1419 -5.1419 0.3037 0.3037 0.3072 0.3072 0.3143 0.3143 1.2583 1.2583 1.2881 1.2881 1.3187 1.3187 2.3489 2.3489 2.4073 2.4073 2.4375 2.4375 6.1157 6.1157 6.2385 6.2385 6.2491 6.2491 10.3142 10.3142 15.0957 15.0957 15.1150 15.1150 15.9580 15.9580 15.9690 15.9690 15.9868 15.9868 k = 0.0660 0.0660-0.0000 ( 3867 PWs) bands (ev): -67.0852 -67.0852 -67.0771 -67.0771 -67.0771 -67.0771 -34.0501 -34.0501 -34.0497 -34.0497 -34.0272 -34.0272 -33.7926 -33.7926 -33.7920 -33.7920 -33.7849 -33.7849 -33.7008 -33.7008 -33.6704 -33.6704 -33.6694 -33.6694 -17.2844 -17.2844 -16.8467 -16.8467 -16.8415 -16.8415 -5.1415 -5.1415 0.2962 0.2962 0.2992 0.2992 0.3056 0.3056 1.2683 1.2683 1.2910 1.2910 1.3193 1.3193 2.3634 2.3634 2.4123 2.4123 2.4370 2.4370 6.1524 6.1524 6.2485 6.2485 6.2581 6.2581 10.2615 10.2615 15.0749 15.0749 15.0914 15.0914 15.9446 15.9446 15.9526 15.9526 15.9670 15.9670 k = 0.0566 0.0566-0.0000 ( 3871 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0498 -34.0498 -34.0271 -34.0271 -33.7925 -33.7925 -33.7920 -33.7920 -33.7848 -33.7848 -33.7009 -33.7009 -33.6702 -33.6702 -33.6694 -33.6694 -17.2872 -17.2872 -16.8454 -16.8454 -16.8416 -16.8416 -5.1410 -5.1410 0.2896 0.2896 0.2922 0.2922 0.2980 0.2980 1.2767 1.2767 1.2932 1.2932 1.3204 1.3204 2.3752 2.3752 2.4172 2.4172 2.4369 2.4369 6.1854 6.1854 6.2574 6.2574 6.2660 6.2660 10.2147 10.2147 15.0564 15.0564 15.0696 15.0696 15.9328 15.9328 15.9385 15.9385 15.9495 15.9495 k = 0.0472 0.0472-0.0000 ( 3871 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0499 -34.0499 -34.0270 -34.0270 -33.7924 -33.7924 -33.7921 -33.7921 -33.7848 -33.7848 -33.7011 -33.7011 -33.6699 -33.6699 -33.6694 -33.6694 -17.2896 -17.2896 -16.8444 -16.8444 -16.8417 -16.8417 -5.1407 -5.1407 0.2840 0.2840 0.2860 0.2860 0.2915 0.2915 1.2836 1.2836 1.2949 1.2949 1.3218 1.3218 2.3844 2.3844 2.4222 2.4222 2.4371 2.4371 6.2144 6.2144 6.2649 6.2649 6.2728 6.2728 10.1743 10.1743 15.0404 15.0404 15.0502 15.0502 15.9228 15.9228 15.9266 15.9266 15.9345 15.9345 k = 0.0377 0.0377-0.0000 ( 3879 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0500 -34.0500 -34.0269 -34.0269 -33.7924 -33.7924 -33.7922 -33.7922 -33.7848 -33.7848 -33.7011 -33.7011 -33.6698 -33.6698 -33.6695 -33.6695 -17.2916 -17.2916 -16.8435 -16.8435 -16.8418 -16.8418 -5.1403 -5.1403 0.2794 0.2794 0.2808 0.2808 0.2863 0.2863 1.2890 1.2890 1.2961 1.2961 1.3234 1.3234 2.3908 2.3908 2.4271 2.4271 2.4374 2.4374 6.2386 6.2386 6.2713 6.2713 6.2785 6.2785 10.1407 10.1407 15.0271 15.0271 15.0336 15.0336 15.9145 15.9145 15.9169 15.9169 15.9221 15.9221 k = 0.0283 0.0283-0.0000 ( 3887 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7924 -33.7924 -33.7923 -33.7923 -33.7848 -33.7848 -33.7012 -33.7012 -33.6696 -33.6696 -33.6695 -33.6695 -17.2931 -17.2931 -16.8428 -16.8428 -16.8418 -16.8418 -5.1401 -5.1401 0.2758 0.2758 0.2766 0.2766 0.2823 0.2823 1.2929 1.2929 1.2969 1.2969 1.3250 1.3250 2.3951 2.3951 2.4316 2.4316 2.4377 2.4377 6.2573 6.2573 6.2767 6.2767 6.2830 6.2830 10.1141 10.1141 15.0166 15.0166 15.0204 15.0204 15.9080 15.9080 15.9094 15.9094 15.9123 15.9123 k = 0.0189 0.0189-0.0000 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2942 -17.2942 -16.8423 -16.8423 -16.8418 -16.8418 -5.1399 -5.1399 0.2732 0.2732 0.2736 0.2736 0.2794 0.2794 1.2957 1.2957 1.2975 1.2975 1.3264 1.3264 2.3977 2.3977 2.4353 2.4353 2.4381 2.4381 6.2697 6.2697 6.2819 6.2819 6.2862 6.2862 10.0949 10.0949 15.0090 15.0090 15.0107 15.0107 15.9034 15.9034 15.9040 15.9040 15.9053 15.9053 k = 0.0094 0.0094-0.0000 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2949 -17.2949 -16.8420 -16.8420 -16.8419 -16.8419 -5.1398 -5.1398 0.2716 0.2716 0.2717 0.2717 0.2777 0.2777 1.2973 1.2973 1.2978 1.2978 1.3273 1.3273 2.3991 2.3991 2.4376 2.4376 2.4383 2.4383 6.2755 6.2755 6.2868 6.2868 6.2882 6.2882 10.0834 10.0834 15.0044 15.0044 15.0048 15.0048 15.9006 15.9006 15.9008 15.9008 15.9011 15.9011 k = 0.0000 0.0000 0.0000 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0267 -34.0267 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2951 -17.2951 -16.8419 -16.8419 -16.8419 -16.8419 -5.1397 -5.1397 0.2711 0.2711 0.2711 0.2711 0.2771 0.2771 1.2979 1.2979 1.2979 1.2979 1.3276 1.3276 2.3995 2.3995 2.4384 2.4384 2.4384 2.4384 6.2770 6.2770 6.2889 6.2889 6.2889 6.2889 10.0795 10.0795 15.0029 15.0029 15.0029 15.0029 15.8997 15.8997 15.8997 15.8997 15.8997 15.8997 k = 0.0000 0.0000 0.0000 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0267 -34.0267 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2951 -17.2951 -16.8419 -16.8419 -16.8419 -16.8419 -5.1397 -5.1397 0.2711 0.2711 0.2711 0.2711 0.2771 0.2771 1.2979 1.2979 1.2979 1.2979 1.3276 1.3276 2.3995 2.3995 2.4384 2.4384 2.4384 2.4384 6.2770 6.2770 6.2889 6.2889 6.2889 6.2889 10.0795 10.0795 15.0029 15.0029 15.0029 15.0029 15.8997 15.8997 15.8997 15.8997 15.8997 15.8997 k = 0.0077 0.0077 0.0077 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2949 -17.2949 -16.8419 -16.8419 -16.8419 -16.8419 -5.1398 -5.1398 0.2716 0.2716 0.2717 0.2717 0.2777 0.2777 1.2973 1.2973 1.2978 1.2978 1.3273 1.3273 2.3991 2.3991 2.4376 2.4376 2.4383 2.4383 6.2755 6.2755 6.2868 6.2868 6.2882 6.2882 10.0833 10.0833 15.0046 15.0046 15.0046 15.0046 15.9007 15.9007 15.9007 15.9007 15.9011 15.9011 k = 0.0154 0.0154 0.0154 ( 3887 PWs) bands (ev): -67.0854 -67.0854 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7923 -33.7923 -33.7923 -33.7923 -33.7848 -33.7848 -33.7013 -33.7013 -33.6695 -33.6695 -33.6695 -33.6695 -17.2942 -17.2942 -16.8421 -16.8421 -16.8421 -16.8421 -5.1399 -5.1399 0.2732 0.2732 0.2735 0.2735 0.2794 0.2794 1.2956 1.2956 1.2975 1.2975 1.3264 1.3264 2.3977 2.3977 2.4352 2.4352 2.4382 2.4382 6.2698 6.2698 6.2819 6.2819 6.2861 6.2861 10.0949 10.0949 15.0098 15.0098 15.0098 15.0098 15.9036 15.9036 15.9036 15.9036 15.9055 15.9055 k = 0.0231 0.0231 0.0231 ( 3887 PWs) bands (ev): -67.0853 -67.0853 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0501 -34.0501 -34.0268 -34.0268 -33.7924 -33.7924 -33.7922 -33.7922 -33.7848 -33.7848 -33.7012 -33.7012 -33.6696 -33.6696 -33.6695 -33.6695 -17.2931 -17.2931 -16.8423 -16.8423 -16.8423 -16.8423 -5.1401 -5.1401 0.2758 0.2758 0.2765 0.2765 0.2822 0.2822 1.2929 1.2929 1.2969 1.2969 1.3251 1.3251 2.3949 2.3949 2.4315 2.4315 2.4380 2.4380 6.2577 6.2577 6.2767 6.2767 6.2828 6.2828 10.1140 10.1140 15.0184 15.0184 15.0184 15.0184 15.9085 15.9085 15.9085 15.9085 15.9127 15.9127 k = 0.0308 0.0308 0.0308 ( 3875 PWs) bands (ev): -67.0853 -67.0853 -67.0770 -67.0770 -67.0770 -67.0770 -34.0501 -34.0501 -34.0500 -34.0500 -34.0269 -34.0269 -33.7924 -33.7924 -33.7922 -33.7922 -33.7848 -33.7848 -33.7011 -33.7011 -33.6698 -33.6698 -33.6694 -33.6694 -17.2916 -17.2916 -16.8426 -16.8426 -16.8426 -16.8426 -5.1403 -5.1403 0.2794 0.2794 0.2807 0.2807 0.2862 0.2862 1.2891 1.2891 1.2956 1.2956 1.3239 1.3239 2.3902 2.3902 2.4274 2.4274 2.4378 2.4378 6.2392 6.2392 6.2712 6.2712 6.2781 6.2781 10.1405 10.1405 15.0303 15.0303 15.0303 15.0303 15.9154 15.9154 15.9154 15.9154 15.9227 15.9227 k = 0.0385 0.0385 0.0385 ( 3878 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0771 -67.0771 -34.0501 -34.0501 -34.0499 -34.0499 -34.0270 -34.0270 -33.7925 -33.7925 -33.7921 -33.7921 -33.7848 -33.7848 -33.7011 -33.7011 -33.6700 -33.6700 -33.6694 -33.6694 -17.2896 -17.2896 -16.8430 -16.8430 -16.8430 -16.8430 -5.1406 -5.1406 0.2841 0.2841 0.2859 0.2859 0.2913 0.2913 1.2842 1.2842 1.2932 1.2932 1.3230 1.3230 2.3828 2.3828 2.4234 2.4234 2.4375 2.4375 6.2153 6.2153 6.2649 6.2649 6.2722 6.2722 10.1740 10.1740 15.0452 15.0452 15.0452 15.0452 15.9242 15.9242 15.9243 15.9243 15.9353 15.9353 k = 0.0462 0.0462 0.0462 ( 3866 PWs) bands (ev): -67.0853 -67.0853 -67.0771 -67.0771 -67.0771 -67.0771 -34.0501 -34.0501 -34.0498 -34.0498 -34.0271 -34.0271 -33.7925 -33.7925 -33.7920 -33.7920 -33.7848 -33.7848 -33.7009 -33.7009 -33.6702 -33.6702 -33.6694 -33.6694 -17.2873 -17.2873 -16.8435 -16.8435 -16.8435 -16.8435 -5.1410 -5.1410 0.2897 0.2897 0.2920 0.2920 0.2976 0.2976 1.2783 1.2783 1.2894 1.2894 1.3229 1.3229 2.3722 2.3722 2.4202 2.4202 2.4371 2.4371 6.1866 6.1866 6.2577 6.2577 6.2650 6.2650 10.2143 10.2143 15.0628 15.0628 15.0629 15.0629 15.9351 15.9351 15.9352 15.9352 15.9505 15.9505 k = 0.0538 0.0538 0.0538 ( 3860 PWs) bands (ev): -67.0852 -67.0852 -67.0771 -67.0771 -67.0771 -67.0771 -34.0500 -34.0500 -34.0497 -34.0497 -34.0272 -34.0272 -33.7926 -33.7926 -33.7919 -33.7919 -33.7848 -33.7848 -33.7008 -33.7008 -33.6704 -33.6704 -33.6694 -33.6694 -17.2845 -17.2845 -16.8441 -16.8441 -16.8441 -16.8441 -5.1414 -5.1414 0.2961 0.2961 0.2990 0.2990 0.3050 0.3050 1.2714 1.2714 1.2840 1.2840 1.3237 1.3237 2.3584 2.3584 2.4178 2.4178 2.4367 2.4367 6.1537 6.1537 6.2494 6.2494 6.2568 6.2568 10.2609 10.2609 15.0829 15.0829 15.0830 15.0830 15.9480 15.9480 15.9482 15.9482 15.9680 15.9680 k = 0.0615 0.0615 0.0615 ( 3860 PWs) bands (ev): -67.0852 -67.0852 -67.0771 -67.0771 -67.0771 -67.0771 -34.0500 -34.0500 -34.0496 -34.0496 -34.0274 -34.0274 -33.7927 -33.7927 -33.7918 -33.7918 -33.7849 -33.7849 -33.7007 -33.7007 -33.6707 -33.6707 -33.6694 -33.6694 -17.2812 -17.2812 -16.8448 -16.8448 -16.8448 -16.8448 -5.1418 -5.1418 0.3035 0.3035 0.3068 0.3068 0.3135 0.3135 1.2634 1.2634 1.2771 1.2771 1.3254 1.3254 2.3416 2.3416 2.4160 2.4160 2.4363 2.4363 6.1170 6.1170 6.2400 6.2400 6.2474 6.2474 10.3134 10.3134 15.1051 15.1051 15.1051 15.1051 15.9631 15.9631 15.9633 15.9633 15.9877 15.9877 k = 0.0692 0.0692 0.0692 ( 3857 PWs) bands (ev): -67.0851 -67.0851 -67.0771 -67.0771 -67.0771 -67.0771 -34.0500 -34.0500 -34.0495 -34.0495 -34.0275 -34.0275 -33.7929 -33.7929 -33.7916 -33.7916 -33.7849 -33.7849 -33.7005 -33.7005 -33.6710 -33.6710 -33.6694 -33.6694 -17.2776 -17.2776 -16.8455 -16.8455 -16.8455 -16.8455 -5.1422 -5.1422 0.3116 0.3116 0.3153 0.3153 0.3230 0.3230 1.2547 1.2547 1.2689 1.2689 1.3277 1.3277 2.3221 2.3221 2.4148 2.4148 2.4359 2.4359 6.0771 6.0771 6.2296 6.2296 6.2371 6.2371 10.3713 10.3713 15.1289 15.1289 15.1289 15.1289 15.9804 15.9804 15.9807 15.9807 16.0092 16.0092 k = 0.0769 0.0769 0.0769 ( 3863 PWs) bands (ev): -67.0851 -67.0851 -67.0772 -67.0772 -67.0772 -67.0772 -34.0500 -34.0500 -34.0494 -34.0494 -34.0277 -34.0277 -33.7930 -33.7930 -33.7915 -33.7915 -33.7849 -33.7849 -33.7004 -33.7004 -33.6714 -33.6714 -33.6694 -33.6694 -17.2736 -17.2736 -16.8464 -16.8464 -16.8463 -16.8463 -5.1425 -5.1425 0.3204 0.3204 0.3245 0.3245 0.3334 0.3334 1.2450 1.2450 1.2595 1.2595 1.3307 1.3307 2.3000 2.3000 2.4138 2.4138 2.4355 2.4355 6.0345 6.0345 6.2185 6.2185 6.2258 6.2258 10.4343 10.4343 15.1537 15.1537 15.1537 15.1537 16.0000 16.0000 16.0004 16.0004 16.0321 16.0321 k = 0.0846 0.0846 0.0846 ( 3863 PWs) bands (ev): -67.0850 -67.0850 -67.0772 -67.0772 -67.0772 -67.0772 -34.0500 -34.0500 -34.0493 -34.0493 -34.0279 -34.0279 -33.7932 -33.7932 -33.7913 -33.7913 -33.7849 -33.7849 -33.7002 -33.7002 -33.6718 -33.6718 -33.6693 -33.6693 -17.2692 -17.2692 -16.8473 -16.8473 -16.8473 -16.8473 -5.1428 -5.1428 0.3297 0.3297 0.3341 0.3341 0.3445 0.3445 1.2347 1.2347 1.2492 1.2492 1.3343 1.3343 2.2756 2.2756 2.4132 2.4132 2.4351 2.4351 5.9896 5.9896 6.2065 6.2065 6.2138 6.2138 10.5019 10.5019 15.1790 15.1790 15.1791 15.1791 16.0220 16.0220 16.0225 16.0225 16.0562 16.0562 k = 0.0923 0.0923 0.0923 ( 3863 PWs) bands (ev): -67.0849 -67.0849 -67.0772 -67.0772 -67.0772 -67.0772 -34.0500 -34.0500 -34.0492 -34.0492 -34.0282 -34.0282 -33.7934 -33.7934 -33.7912 -33.7912 -33.7849 -33.7849 -33.7001 -33.7001 -33.6722 -33.6722 -33.6693 -33.6693 -17.2644 -17.2644 -16.8483 -16.8483 -16.8483 -16.8483 -5.1431 -5.1431 0.3396 0.3396 0.3443 0.3443 0.3562 0.3562 1.2238 1.2238 1.2381 1.2381 1.3383 1.3383 2.2489 2.2489 2.4128 2.4128 2.4349 2.4349 5.9431 5.9431 6.1938 6.1938 6.2011 6.2011 10.5736 10.5736 15.2042 15.2042 15.2042 15.2042 16.0467 16.0467 16.0473 16.0473 16.0807 16.0807 k = 0.1000 0.1000 0.1000 ( 3869 PWs) bands (ev): -67.0848 -67.0848 -67.0773 -67.0773 -67.0773 -67.0773 -34.0500 -34.0500 -34.0490 -34.0490 -34.0284 -34.0284 -33.7937 -33.7937 -33.7910 -33.7910 -33.7849 -33.7849 -33.6999 -33.6999 -33.6726 -33.6726 -33.6693 -33.6693 -17.2592 -17.2592 -16.8494 -16.8494 -16.8493 -16.8493 -5.1432 -5.1432 0.3498 0.3498 0.3549 0.3549 0.3684 0.3684 1.2124 1.2124 1.2263 1.2263 1.3427 1.3427 2.2201 2.2201 2.4125 2.4125 2.4347 2.4347 5.8954 5.8954 6.1806 6.1806 6.1878 6.1878 10.6491 10.6491 15.2285 15.2285 15.2286 15.2286 16.0741 16.0741 16.0748 16.0748 16.1052 16.1052 k = 0.1077 0.1077 0.1077 ( 3857 PWs) bands (ev): -67.0848 -67.0848 -67.0773 -67.0773 -67.0773 -67.0773 -34.0500 -34.0500 -34.0488 -34.0488 -34.0286 -34.0286 -33.7939 -33.7939 -33.7908 -33.7908 -33.7848 -33.7848 -33.6997 -33.6997 -33.6730 -33.6730 -33.6693 -33.6693 -17.2537 -17.2537 -16.8505 -16.8505 -16.8505 -16.8505 -5.1432 -5.1432 0.3602 0.3602 0.3657 0.3657 0.3810 0.3810 1.2007 1.2007 1.2143 1.2143 1.3477 1.3477 2.1894 2.1894 2.4125 2.4125 2.4346 2.4346 5.8470 5.8470 6.1669 6.1669 6.1740 6.1740 10.7279 10.7279 15.2513 15.2513 15.2514 15.2514 16.1045 16.1045 16.1053 16.1053 16.1289 16.1289 k = 0.1154 0.1154 0.1154 ( 3866 PWs) bands (ev): -67.0847 -67.0847 -67.0774 -67.0774 -67.0774 -67.0774 -34.0500 -34.0500 -34.0487 -34.0487 -34.0289 -34.0289 -33.7943 -33.7943 -33.7906 -33.7906 -33.7848 -33.7848 -33.6996 -33.6996 -33.6735 -33.6735 -33.6692 -33.6692 -17.2479 -17.2479 -16.8518 -16.8518 -16.8517 -16.8517 -5.1430 -5.1430 0.3707 0.3707 0.3765 0.3765 0.3938 0.3938 1.1887 1.1887 1.2017 1.2017 1.3528 1.3528 2.1566 2.1566 2.4127 2.4127 2.4346 2.4346 5.7983 5.7983 6.1529 6.1529 6.1599 6.1599 10.8097 10.8097 15.2719 15.2719 15.2719 15.2719 16.1379 16.1379 16.1388 16.1388 16.1510 16.1510 k = 0.1231 0.1231 0.1231 ( 3869 PWs) bands (ev): -67.0846 -67.0846 -67.0774 -67.0774 -67.0774 -67.0774 -34.0500 -34.0500 -34.0486 -34.0486 -34.0292 -34.0292 -33.7946 -33.7946 -33.7903 -33.7903 -33.7848 -33.7848 -33.6994 -33.6994 -33.6739 -33.6739 -33.6692 -33.6692 -17.2417 -17.2417 -16.8530 -16.8530 -16.8529 -16.8529 -5.1426 -5.1426 0.3809 0.3809 0.3872 0.3872 0.4066 0.4066 1.1769 1.1769 1.1892 1.1892 1.3584 1.3584 2.1220 2.1220 2.4130 2.4130 2.4348 2.4348 5.7497 5.7497 6.1386 6.1386 6.1454 6.1454 10.8941 10.8941 15.2894 15.2894 15.2895 15.2895 16.1696 16.1696 16.1746 16.1746 16.1765 16.1765 k = 0.1308 0.1308 0.1308 ( 3869 PWs) bands (ev): -67.0845 -67.0845 -67.0774 -67.0774 -67.0774 -67.0774 -34.0500 -34.0500 -34.0484 -34.0484 -34.0294 -34.0294 -33.7950 -33.7950 -33.7901 -33.7901 -33.7847 -33.7847 -33.6993 -33.6993 -33.6744 -33.6744 -33.6692 -33.6692 -17.2352 -17.2352 -16.8544 -16.8544 -16.8543 -16.8543 -5.1420 -5.1420 0.3908 0.3908 0.3975 0.3975 0.4193 0.4193 1.1653 1.1653 1.1769 1.1769 1.3642 1.3642 2.0857 2.0857 2.4136 2.4136 2.4351 2.4351 5.7018 5.7018 6.1241 6.1241 6.1309 6.1309 10.9808 10.9808 15.3035 15.3035 15.3035 15.3035 16.1861 16.1861 16.2146 16.2146 16.2162 16.2162 k = 0.1385 0.1385 0.1385 ( 3875 PWs) bands (ev): -67.0844 -67.0844 -67.0775 -67.0775 -67.0775 -67.0775 -34.0500 -34.0500 -34.0482 -34.0482 -34.0297 -34.0297 -33.7954 -33.7954 -33.7898 -33.7898 -33.7846 -33.7846 -33.6991 -33.6991 -33.6748 -33.6748 -33.6692 -33.6692 -17.2284 -17.2284 -16.8558 -16.8558 -16.8557 -16.8557 -5.1412 -5.1412 0.4000 0.4000 0.4072 0.4072 0.4318 0.4318 1.1542 1.1542 1.1649 1.1649 1.3703 1.3703 2.0477 2.0477 2.4144 2.4144 2.4356 2.4356 5.6548 5.6548 6.1095 6.1095 6.1162 6.1162 11.0694 11.0694 15.3134 15.3134 15.3134 15.3134 16.1979 16.1979 16.2577 16.2577 16.2595 16.2595 k = 0.1462 0.1462 0.1462 ( 3875 PWs) bands (ev): -67.0843 -67.0843 -67.0775 -67.0775 -67.0775 -67.0775 -34.0501 -34.0501 -34.0481 -34.0481 -34.0300 -34.0300 -33.7959 -33.7959 -33.7896 -33.7896 -33.7845 -33.7845 -33.6990 -33.6990 -33.6752 -33.6752 -33.6691 -33.6691 -17.2213 -17.2213 -16.8573 -16.8573 -16.8571 -16.8571 -5.1401 -5.1401 0.4083 0.4083 0.4160 0.4160 0.4438 0.4438 1.1440 1.1440 1.1538 1.1538 1.3768 1.3768 2.0082 2.0082 2.4154 2.4154 2.4364 2.4364 5.6092 5.6092 6.0951 6.0951 6.1016 6.1016 11.1597 11.1597 15.3188 15.3188 15.3188 15.3188 16.2048 16.2048 16.3041 16.3041 16.3059 16.3059 k = 0.1538 0.1538 0.1538 ( 3869 PWs) bands (ev): -67.0842 -67.0842 -67.0776 -67.0776 -67.0776 -67.0776 -34.0501 -34.0501 -34.0479 -34.0479 -34.0303 -34.0303 -33.7963 -33.7963 -33.7893 -33.7893 -33.7844 -33.7844 -33.6989 -33.6989 -33.6756 -33.6756 -33.6690 -33.6690 -17.2139 -17.2139 -16.8588 -16.8588 -16.8586 -16.8586 -5.1387 -5.1387 0.4153 0.4153 0.4236 0.4236 0.4552 0.4552 1.1350 1.1350 1.1437 1.1437 1.3836 1.3836 1.9672 1.9672 2.4166 2.4166 2.4373 2.4373 5.5654 5.5654 6.0807 6.0807 6.0871 6.0871 11.2513 11.2513 15.3193 15.3193 15.3194 15.3194 16.2066 16.2066 16.3533 16.3533 16.3554 16.3554 k = 0.1615 0.1615 0.1615 ( 3878 PWs) bands (ev): -67.0840 -67.0840 -67.0777 -67.0777 -67.0777 -67.0777 -34.0501 -34.0501 -34.0478 -34.0478 -34.0306 -34.0306 -33.7969 -33.7969 -33.7890 -33.7890 -33.7843 -33.7843 -33.6989 -33.6989 -33.6760 -33.6760 -33.6690 -33.6690 -17.2063 -17.2063 -16.8603 -16.8603 -16.8602 -16.8602 -5.1369 -5.1369 0.4207 0.4207 0.4297 0.4297 0.4658 0.4658 1.1273 1.1273 1.1349 1.1349 1.3905 1.3905 1.9249 1.9249 2.4181 2.4181 2.4385 2.4385 5.5237 5.5237 6.0666 6.0666 6.0729 6.0729 11.3440 11.3440 15.3147 15.3147 15.3149 15.3149 16.2032 16.2032 16.4052 16.4052 16.4075 16.4075 k = 0.1692 0.1692 0.1692 ( 3881 PWs) bands (ev): -67.0839 -67.0839 -67.0777 -67.0777 -67.0777 -67.0777 -34.0501 -34.0501 -34.0476 -34.0476 -34.0310 -34.0310 -33.7974 -33.7974 -33.7887 -33.7887 -33.7841 -33.7841 -33.6989 -33.6989 -33.6763 -33.6763 -33.6689 -33.6689 -17.1984 -17.1984 -16.8619 -16.8619 -16.8617 -16.8617 -5.1349 -5.1349 0.4244 0.4244 0.4340 0.4340 0.4755 0.4755 1.1214 1.1214 1.1278 1.1278 1.3977 1.3977 1.8813 1.8813 2.4199 2.4199 2.4399 2.4399 5.4843 5.4843 6.0528 6.0528 6.0589 6.0589 11.4374 11.4374 15.3049 15.3049 15.3051 15.3051 16.1950 16.1950 16.4594 16.4594 16.4619 16.4619 k = 0.1769 0.1769 0.1769 ( 3863 PWs) bands (ev): -67.0838 -67.0838 -67.0778 -67.0778 -67.0778 -67.0778 -34.0501 -34.0501 -34.0475 -34.0475 -34.0312 -34.0312 -33.7979 -33.7979 -33.7884 -33.7884 -33.7839 -33.7839 -33.6989 -33.6989 -33.6766 -33.6766 -33.6689 -33.6689 -17.1903 -17.1903 -16.8635 -16.8635 -16.8633 -16.8633 -5.1324 -5.1324 0.4259 0.4259 0.4363 0.4363 0.4842 0.4842 1.1176 1.1176 1.1227 1.1227 1.4052 1.4052 1.8366 1.8366 2.4219 2.4219 2.4416 2.4416 5.4476 5.4476 6.0394 6.0394 6.0454 6.0454 11.5315 11.5315 15.2899 15.2899 15.2902 15.2902 16.1826 16.1826 16.5156 16.5156 16.5182 16.5182 k = 0.1846 0.1846 0.1846 ( 3869 PWs) bands (ev): -67.0837 -67.0837 -67.0778 -67.0778 -67.0778 -67.0778 -34.0502 -34.0502 -34.0473 -34.0473 -34.0315 -34.0315 -33.7985 -33.7985 -33.7881 -33.7881 -33.7838 -33.7838 -33.6990 -33.6990 -33.6768 -33.6768 -33.6688 -33.6688 -17.1820 -17.1820 -16.8652 -16.8652 -16.8650 -16.8650 -5.1295 -5.1295 0.4250 0.4250 0.4360 0.4360 0.4915 0.4915 1.1159 1.1159 1.1198 1.1198 1.4129 1.4129 1.7908 1.7908 2.4242 2.4242 2.4435 2.4435 5.4137 5.4137 6.0264 6.0264 6.0323 6.0323 11.6258 11.6258 15.2697 15.2697 15.2701 15.2701 16.1665 16.1665 16.5734 16.5734 16.5762 16.5762 k = 0.1923 0.1923 0.1923 ( 3857 PWs) bands (ev): -67.0836 -67.0836 -67.0779 -67.0779 -67.0779 -67.0779 -34.0502 -34.0502 -34.0472 -34.0472 -34.0318 -34.0318 -33.7991 -33.7991 -33.7877 -33.7877 -33.7836 -33.7836 -33.6991 -33.6991 -33.6770 -33.6770 -33.6687 -33.6687 -17.1736 -17.1736 -16.8669 -16.8669 -16.8666 -16.8666 -5.1263 -5.1263 0.4216 0.4216 0.4333 0.4333 0.4975 0.4975 1.1169 1.1169 1.1195 1.1195 1.4208 1.4208 1.7441 1.7441 2.4268 2.4268 2.4457 2.4457 5.3831 5.3831 6.0140 6.0140 6.0197 6.0197 11.7201 11.7201 15.2445 15.2445 15.2450 15.2450 16.1474 16.1474 16.6323 16.6323 16.6352 16.6352 k = 0.2000 0.2000 0.2000 ( 3845 PWs) bands (ev): -67.0834 -67.0834 -67.0779 -67.0779 -67.0779 -67.0779 -34.0502 -34.0502 -34.0471 -34.0471 -34.0321 -34.0321 -33.7996 -33.7996 -33.7874 -33.7874 -33.7833 -33.7833 -33.6993 -33.6993 -33.6771 -33.6771 -33.6686 -33.6686 -17.1649 -17.1649 -16.8686 -16.8686 -16.8683 -16.8683 -5.1226 -5.1226 0.4156 0.4156 0.4279 0.4279 0.5019 0.5019 1.1204 1.1204 1.1217 1.1217 1.4288 1.4288 1.6966 1.6966 2.4297 2.4297 2.4482 2.4482 5.3558 5.3558 6.0022 6.0022 6.0078 6.0078 11.8142 11.8142 15.2144 15.2144 15.2150 15.2150 16.1259 16.1259 16.6919 16.6919 16.6950 16.6950 k = 0.2077 0.2077 0.2077 ( 3845 PWs) bands (ev): -67.0833 -67.0833 -67.0780 -67.0780 -67.0780 -67.0780 -34.0503 -34.0503 -34.0470 -34.0470 -34.0324 -34.0324 -33.8003 -33.8003 -33.7870 -33.7870 -33.7831 -33.7831 -33.6995 -33.6995 -33.6771 -33.6771 -33.6685 -33.6685 -17.1562 -17.1562 -16.8703 -16.8703 -16.8701 -16.8701 -5.1184 -5.1184 0.4069 0.4069 0.4198 0.4198 0.5046 0.5046 1.1265 1.1265 1.1265 1.1265 1.4369 1.4369 1.6485 1.6485 2.4329 2.4329 2.4510 2.4510 5.3320 5.3320 5.9910 5.9910 5.9964 5.9964 11.9078 11.9078 15.1795 15.1795 15.1802 15.1802 16.1025 16.1025 16.7518 16.7518 16.7551 16.7551 k = 0.2154 0.2154 0.2154 ( 3854 PWs) bands (ev): -67.0832 -67.0832 -67.0781 -67.0781 -67.0781 -67.0781 -34.0503 -34.0503 -34.0469 -34.0469 -34.0327 -34.0327 -33.8009 -33.8009 -33.7867 -33.7867 -33.7830 -33.7830 -33.6999 -33.6999 -33.6771 -33.6771 -33.6685 -33.6685 -17.1473 -17.1473 -16.8721 -16.8721 -16.8718 -16.8718 -5.1138 -5.1138 0.3955 0.3955 0.4089 0.4089 0.5054 0.5054 1.1338 1.1338 1.1350 1.1350 1.4451 1.4451 1.6000 1.6000 2.4364 2.4364 2.4540 2.4540 5.3118 5.3118 5.9804 5.9804 5.9857 5.9857 12.0007 12.0007 15.1401 15.1401 15.1410 15.1410 16.0776 16.0776 16.8117 16.8117 16.8151 16.8151 k = 0.2231 0.2231 0.2231 ( 3845 PWs) bands (ev): -67.0830 -67.0830 -67.0781 -67.0781 -67.0781 -67.0781 -34.0504 -34.0504 -34.0469 -34.0469 -34.0329 -34.0329 -33.8016 -33.8016 -33.7863 -33.7863 -33.7827 -33.7827 -33.7002 -33.7002 -33.6770 -33.6770 -33.6684 -33.6684 -17.1383 -17.1383 -16.8738 -16.8738 -16.8736 -16.8736 -5.1087 -5.1087 0.3817 0.3817 0.3955 0.3955 0.5045 0.5045 1.1437 1.1437 1.1461 1.1461 1.4534 1.4534 1.5512 1.5512 2.4403 2.4403 2.4574 2.4574 5.2954 5.2954 5.9706 5.9706 5.9758 5.9758 12.0927 12.0927 15.0965 15.0965 15.0976 15.0976 16.0515 16.0515 16.8712 16.8712 16.8747 16.8747 k = 0.2308 0.2308 0.2308 ( 3860 PWs) bands (ev): -67.0829 -67.0829 -67.0782 -67.0782 -67.0782 -67.0782 -34.0505 -34.0505 -34.0469 -34.0469 -34.0332 -34.0332 -33.8023 -33.8023 -33.7860 -33.7860 -33.7825 -33.7825 -33.7007 -33.7007 -33.6769 -33.6769 -33.6683 -33.6683 -17.1292 -17.1292 -16.8756 -16.8756 -16.8753 -16.8753 -5.1032 -5.1032 0.3655 0.3655 0.3796 0.3796 0.5013 0.5013 1.1558 1.1558 1.1593 1.1593 1.4610 1.4610 1.5028 1.5028 2.4444 2.4444 2.4611 2.4611 5.2827 5.2827 5.9616 5.9616 5.9666 5.9666 12.1835 12.1835 15.0490 15.0490 15.0503 15.0503 16.0246 16.0246 16.9299 16.9299 16.9336 16.9336 k = 0.2385 0.2385 0.2385 ( 3860 PWs) bands (ev): -67.0828 -67.0828 -67.0783 -67.0783 -67.0783 -67.0783 -34.0505 -34.0505 -34.0469 -34.0469 -34.0334 -34.0334 -33.8029 -33.8029 -33.7856 -33.7856 -33.7823 -33.7823 -33.7012 -33.7012 -33.6767 -33.6767 -33.6682 -33.6682 -17.1201 -17.1201 -16.8774 -16.8774 -16.8771 -16.8771 -5.0972 -5.0972 0.3473 0.3473 0.3618 0.3618 0.4962 0.4962 1.1699 1.1699 1.1746 1.1746 1.4494 1.4494 1.4737 1.4737 2.4489 2.4489 2.4651 2.4651 5.2740 5.2740 5.9533 5.9533 5.9582 5.9582 12.2729 12.2729 14.9980 14.9980 14.9994 14.9994 15.9971 15.9971 16.9877 16.9877 16.9915 16.9915 k = 0.2462 0.2462 0.2462 ( 3872 PWs) bands (ev): -67.0826 -67.0826 -67.0783 -67.0783 -67.0783 -67.0783 -34.0506 -34.0506 -34.0469 -34.0469 -34.0336 -34.0336 -33.8036 -33.8036 -33.7853 -33.7853 -33.7821 -33.7821 -33.7017 -33.7017 -33.6765 -33.6765 -33.6681 -33.6681 -17.1109 -17.1109 -16.8792 -16.8792 -16.8789 -16.8789 -5.0908 -5.0908 0.3273 0.3273 0.3419 0.3419 0.4888 0.4888 1.1857 1.1857 1.1916 1.1916 1.4023 1.4023 1.4804 1.4804 2.4537 2.4537 2.4694 2.4694 5.2690 5.2690 5.9458 5.9458 5.9506 5.9506 12.3605 12.3605 14.9436 14.9436 14.9452 14.9452 15.9691 15.9691 17.0442 17.0442 17.0481 17.0481 k = 0.2538 0.2538 0.2538 ( 3872 PWs) bands (ev): -67.0825 -67.0825 -67.0784 -67.0784 -67.0784 -67.0784 -34.0507 -34.0507 -34.0470 -34.0470 -34.0338 -34.0338 -33.8043 -33.8043 -33.7849 -33.7849 -33.7819 -33.7819 -33.7023 -33.7023 -33.6762 -33.6762 -33.6680 -33.6680 -17.1017 -17.1017 -16.8810 -16.8810 -16.8806 -16.8806 -5.0838 -5.0838 0.3058 0.3058 0.3206 0.3206 0.4793 0.4793 1.2027 1.2027 1.2101 1.2101 1.3543 1.3543 1.4888 1.4888 2.4589 2.4589 2.4741 2.4741 5.2680 5.2680 5.9392 5.9392 5.9438 5.9438 12.4462 12.4462 14.8862 14.8862 14.8881 14.8881 15.9409 15.9409 17.0993 17.0993 17.1033 17.1033 k = 0.2615 0.2615 0.2615 ( 3860 PWs) bands (ev): -67.0823 -67.0823 -67.0785 -67.0785 -67.0785 -67.0785 -34.0508 -34.0508 -34.0470 -34.0470 -34.0339 -34.0339 -33.8050 -33.8050 -33.7846 -33.7846 -33.7817 -33.7817 -33.7029 -33.7029 -33.6759 -33.6759 -33.6678 -33.6678 -17.0925 -17.0925 -16.8827 -16.8827 -16.8824 -16.8824 -5.0764 -5.0764 0.2830 0.2830 0.2978 0.2978 0.4675 0.4675 1.2201 1.2201 1.2299 1.2299 1.3075 1.3075 1.4974 1.4974 2.4645 2.4645 2.4791 2.4791 5.2707 5.2707 5.9334 5.9334 5.9379 5.9379 12.5297 12.5297 14.8263 14.8263 14.8284 14.8284 15.9127 15.9127 17.1528 17.1528 17.1568 17.1568 k = 0.2692 0.2692 0.2692 ( 3863 PWs) bands (ev): -67.0822 -67.0822 -67.0785 -67.0785 -67.0785 -67.0785 -34.0509 -34.0509 -34.0472 -34.0472 -34.0340 -34.0340 -33.8057 -33.8057 -33.7842 -33.7842 -33.7814 -33.7814 -33.7035 -33.7035 -33.6755 -33.6755 -33.6677 -33.6677 -17.0834 -17.0834 -16.8845 -16.8845 -16.8841 -16.8841 -5.0685 -5.0685 0.2591 0.2591 0.2740 0.2740 0.4534 0.4534 1.2311 1.2311 1.2507 1.2507 1.2688 1.2688 1.5060 1.5060 2.4704 2.4704 2.4845 2.4845 5.2770 5.2770 5.9284 5.9284 5.9328 5.9328 12.6106 12.6106 14.7641 14.7641 14.7664 14.7664 15.8846 15.8846 17.2044 17.2044 17.2085 17.2085 k = 0.2769 0.2769 0.2769 ( 3860 PWs) bands (ev): -67.0821 -67.0821 -67.0786 -67.0786 -67.0786 -67.0786 -34.0510 -34.0510 -34.0473 -34.0473 -34.0341 -34.0341 -33.8064 -33.8064 -33.7838 -33.7838 -33.7812 -33.7812 -33.7041 -33.7041 -33.6751 -33.6751 -33.6676 -33.6676 -17.0743 -17.0743 -16.8862 -16.8862 -16.8858 -16.8858 -5.0603 -5.0603 0.2344 0.2344 0.2492 0.2492 0.4370 0.4370 1.2038 1.2038 1.2700 1.2700 1.2722 1.2722 1.5146 1.5146 2.4766 2.4766 2.4902 2.4902 5.2869 5.2869 5.9243 5.9243 5.9286 5.9286 12.6887 12.6887 14.7000 14.7000 14.7025 14.7025 15.8567 15.8567 17.2542 17.2542 17.2583 17.2584 k = 0.2846 0.2846 0.2846 ( 3872 PWs) bands (ev): -67.0819 -67.0819 -67.0787 -67.0787 -67.0787 -67.0787 -34.0511 -34.0511 -34.0475 -34.0475 -34.0342 -34.0342 -33.8071 -33.8071 -33.7835 -33.7835 -33.7810 -33.7810 -33.7048 -33.7048 -33.6747 -33.6747 -33.6675 -33.6675 -17.0652 -17.0652 -16.8880 -16.8880 -16.8876 -16.8876 -5.0516 -5.0516 0.2090 0.2090 0.2238 0.2238 0.4183 0.4183 1.1606 1.1606 1.2886 1.2886 1.2943 1.2943 1.5231 1.5231 2.4832 2.4832 2.4962 2.4962 5.3001 5.3001 5.9209 5.9209 5.9251 5.9251 12.7638 12.7638 14.6342 14.6342 14.6369 14.6369 15.8291 15.8291 17.3019 17.3019 17.3061 17.3061 k = 0.2923 0.2923 0.2923 ( 3878 PWs) bands (ev): -67.0818 -67.0818 -67.0787 -67.0787 -67.0787 -67.0787 -34.0512 -34.0512 -34.0477 -34.0477 -34.0343 -34.0343 -33.8077 -33.8077 -33.7832 -33.7832 -33.7808 -33.7808 -33.7055 -33.7055 -33.6742 -33.6742 -33.6674 -33.6674 -17.0563 -17.0563 -16.8897 -16.8897 -16.8892 -16.8892 -5.0425 -5.0425 0.1832 0.1832 0.1979 0.1979 0.3974 0.3974 1.1169 1.1169 1.3094 1.3094 1.3167 1.3167 1.5317 1.5317 2.4901 2.4901 2.5025 2.5025 5.3165 5.3165 5.9184 5.9184 5.9225 5.9225 12.8354 12.8354 14.5673 14.5673 14.5702 14.5702 15.8022 15.8022 17.3476 17.3476 17.3519 17.3519 k = 0.3000 0.3000 0.3000 ( 3884 PWs) bands (ev): -67.0817 -67.0817 -67.0788 -67.0788 -67.0788 -67.0788 -34.0513 -34.0513 -34.0479 -34.0479 -34.0344 -34.0344 -33.8084 -33.8084 -33.7828 -33.7828 -33.7806 -33.7806 -33.7062 -33.7062 -33.6738 -33.6738 -33.6672 -33.6672 -17.0475 -17.0475 -16.8913 -16.8913 -16.8909 -16.8909 -5.0330 -5.0330 0.1572 0.1572 0.1718 0.1718 0.3743 0.3743 1.0740 1.0740 1.3309 1.3309 1.3393 1.3393 1.5401 1.5401 2.4974 2.4974 2.5092 2.5092 5.3359 5.3359 5.9166 5.9166 5.9206 5.9206 12.9034 12.9034 14.4993 14.4993 14.5024 14.5024 15.7761 15.7761 17.3913 17.3913 17.3955 17.3955 k = 0.3077 0.3077 0.3077 ( 3884 PWs) bands (ev): -67.0816 -67.0816 -67.0789 -67.0789 -67.0789 -67.0789 -34.0514 -34.0514 -34.0482 -34.0482 -34.0344 -34.0344 -33.8091 -33.8091 -33.7825 -33.7825 -33.7804 -33.7804 -33.7069 -33.7069 -33.6733 -33.6733 -33.6671 -33.6671 -17.0388 -17.0388 -16.8930 -16.8930 -16.8925 -16.8925 -5.0232 -5.0232 0.1311 0.1311 0.1456 0.1456 0.3492 0.3492 1.0327 1.0327 1.3525 1.3525 1.3619 1.3619 1.5485 1.5485 2.5050 2.5050 2.5162 2.5162 5.3581 5.3581 5.9156 5.9156 5.9195 5.9195 12.9674 12.9674 14.4308 14.4308 14.4341 14.4341 15.7510 15.7510 17.4329 17.4329 17.4359 17.4359 k = 0.3154 0.3154 0.3154 ( 3878 PWs) bands (ev): -67.0814 -67.0814 -67.0789 -67.0789 -67.0789 -67.0789 -34.0515 -34.0515 -34.0484 -34.0484 -34.0344 -34.0344 -33.8097 -33.8097 -33.7821 -33.7821 -33.7802 -33.7802 -33.7075 -33.7075 -33.6728 -33.6728 -33.6670 -33.6670 -17.0302 -17.0302 -16.8945 -16.8945 -16.8941 -16.8941 -5.0131 -5.0131 0.1051 0.1051 0.1195 0.1195 0.3221 0.3221 0.9930 0.9930 1.3741 1.3741 1.3843 1.3843 1.5568 1.5568 2.5130 2.5130 2.5235 2.5235 5.3828 5.3828 5.9154 5.9154 5.9192 5.9192 13.0271 13.0271 14.3620 14.3620 14.3655 14.3655 15.7270 15.7270 17.3763 17.3763 17.4725 17.4725 k = 0.3231 0.3231 0.3231 ( 3884 PWs) bands (ev): -67.0813 -67.0813 -67.0790 -67.0790 -67.0790 -67.0790 -34.0517 -34.0517 -34.0487 -34.0487 -34.0344 -34.0344 -33.8104 -33.8104 -33.7818 -33.7818 -33.7800 -33.7800 -33.7082 -33.7082 -33.6723 -33.6723 -33.6669 -33.6669 -17.0219 -17.0219 -16.8961 -16.8961 -16.8956 -16.8956 -5.0028 -5.0028 0.0792 0.0792 0.0935 0.0935 0.2933 0.2933 0.9550 0.9550 1.3953 1.3953 1.4064 1.4064 1.5649 1.5649 2.5212 2.5212 2.5311 2.5311 5.4097 5.4097 5.9157 5.9157 5.9195 5.9195 13.0823 13.0823 14.2931 14.2931 14.2969 14.2969 15.7045 15.7045 17.3144 17.3144 17.5099 17.5099 k = 0.3308 0.3308 0.3308 ( 3884 PWs) bands (ev): -67.0812 -67.0812 -67.0790 -67.0790 -67.0790 -67.0790 -34.0518 -34.0518 -34.0490 -34.0490 -34.0343 -34.0343 -33.8110 -33.8110 -33.7815 -33.7815 -33.7798 -33.7798 -33.7089 -33.7089 -33.6718 -33.6718 -33.6667 -33.6667 -17.0137 -17.0137 -16.8976 -16.8976 -16.8971 -16.8971 -4.9922 -4.9922 0.0537 0.0537 0.0678 0.0678 0.2630 0.2630 0.9188 0.9188 1.4162 1.4162 1.4281 1.4281 1.5728 1.5728 2.5297 2.5297 2.5390 2.5390 5.4386 5.4386 5.9168 5.9168 5.9205 5.9205 13.1328 13.1328 14.2246 14.2246 14.2286 14.2286 15.6836 15.6836 17.2526 17.2526 17.5454 17.5454 k = 0.3385 0.3385 0.3385 ( 3884 PWs) bands (ev): -67.0811 -67.0811 -67.0791 -67.0791 -67.0791 -67.0791 -34.0519 -34.0519 -34.0493 -34.0493 -34.0343 -34.0343 -33.8116 -33.8116 -33.7811 -33.7811 -33.7796 -33.7796 -33.7095 -33.7095 -33.6712 -33.6712 -33.6666 -33.6666 -17.0057 -17.0057 -16.8991 -16.8991 -16.8986 -16.8986 -4.9815 -4.9815 0.0286 0.0286 0.0426 0.0426 0.2314 0.2314 0.8845 0.8845 1.4365 1.4365 1.4492 1.4492 1.5806 1.5806 2.5385 2.5385 2.5471 2.5471 5.4692 5.4692 5.9185 5.9185 5.9221 5.9221 13.1782 13.1782 14.1568 14.1568 14.1610 14.1610 15.6647 15.6647 17.1921 17.1921 17.5789 17.5789 k = 0.3462 0.3462 0.3462 ( 3884 PWs) bands (ev): -67.0810 -67.0810 -67.0791 -67.0791 -67.0791 -67.0791 -34.0520 -34.0520 -34.0496 -34.0496 -34.0343 -34.0343 -33.8122 -33.8122 -33.7808 -33.7808 -33.7794 -33.7794 -33.7101 -33.7101 -33.6707 -33.6707 -33.6664 -33.6664 -16.9980 -16.9980 -16.9005 -16.9005 -16.9000 -16.9000 -4.9707 -4.9707 0.0040 0.0040 0.0179 0.0179 0.1987 0.1987 0.8521 0.8521 1.4562 1.4562 1.4697 1.4697 1.5881 1.5881 2.5474 2.5474 2.5554 2.5554 5.5012 5.5012 5.9207 5.9207 5.9243 5.9243 13.2186 13.2186 14.0899 14.0899 14.0943 14.0943 15.6479 15.6479 17.1336 17.1336 17.6105 17.6105 k = 0.3538 0.3538 0.3538 ( 3866 PWs) bands (ev): -67.0808 -67.0808 -67.0792 -67.0792 -67.0792 -67.0792 -34.0521 -34.0521 -34.0499 -34.0499 -34.0342 -34.0342 -33.8128 -33.8128 -33.7805 -33.7805 -33.7792 -33.7792 -33.7108 -33.7108 -33.6702 -33.6702 -33.6663 -33.6663 -16.9905 -16.9905 -16.9018 -16.9018 -16.9013 -16.9013 -4.9598 -4.9598 -0.0199 -0.0199 -0.0061 -0.0061 0.1654 0.1654 0.8216 0.8216 1.4753 1.4753 1.4895 1.4895 1.5955 1.5955 2.5566 2.5566 2.5639 2.5639 5.5344 5.5344 5.9234 5.9234 5.9270 5.9270 13.2538 13.2538 14.0242 14.0242 14.0288 14.0288 15.6334 15.6334 17.0778 17.0778 17.6402 17.6402 k = 0.3615 0.3615 0.3615 ( 3872 PWs) bands (ev): -67.0807 -67.0807 -67.0793 -67.0793 -67.0793 -67.0793 -34.0522 -34.0522 -34.0502 -34.0502 -34.0341 -34.0341 -33.8134 -33.8134 -33.7802 -33.7802 -33.7791 -33.7791 -33.7114 -33.7114 -33.6697 -33.6697 -33.6662 -33.6662 -16.9832 -16.9832 -16.9032 -16.9032 -16.9026 -16.9026 -4.9489 -4.9489 -0.0430 -0.0430 -0.0295 -0.0295 0.1315 0.1315 0.7929 0.7929 1.4934 1.4934 1.5084 1.5084 1.6026 1.6026 2.5658 2.5658 2.5725 2.5725 5.5682 5.5682 5.9265 5.9265 5.9301 5.9301 13.2838 13.2838 13.9600 13.9600 13.9648 13.9648 15.6214 15.6214 17.0250 17.0250 17.6681 17.6682 k = 0.3692 0.3692 0.3692 ( 3881 PWs) bands (ev): -67.0806 -67.0806 -67.0793 -67.0793 -67.0793 -67.0793 -34.0523 -34.0523 -34.0505 -34.0505 -34.0341 -34.0341 -33.8139 -33.8139 -33.7800 -33.7800 -33.7790 -33.7790 -33.7120 -33.7120 -33.6693 -33.6693 -33.6660 -33.6660 -16.9763 -16.9763 -16.9044 -16.9044 -16.9039 -16.9039 -4.9381 -4.9381 -0.0654 -0.0654 -0.0520 -0.0520 0.0975 0.0975 0.7660 0.7660 1.5107 1.5107 1.5265 1.5265 1.6095 1.6095 2.5750 2.5750 2.5811 2.5811 5.6026 5.6026 5.9301 5.9301 5.9336 5.9336 13.3085 13.3085 13.8975 13.8975 13.9025 13.9025 15.6119 15.6119 16.9753 16.9753 17.6942 17.6942 k = 0.3769 0.3769 0.3769 ( 3864 PWs) bands (ev): -67.0805 -67.0805 -67.0793 -67.0793 -67.0793 -67.0793 -34.0524 -34.0524 -34.0507 -34.0507 -34.0340 -34.0340 -33.8144 -33.8144 -33.7797 -33.7797 -33.7788 -33.7788 -33.7125 -33.7125 -33.6688 -33.6688 -33.6659 -33.6659 -16.9696 -16.9696 -16.9056 -16.9056 -16.9050 -16.9050 -4.9273 -4.9273 -0.0869 -0.0869 -0.0736 -0.0736 0.0638 0.0638 0.7409 0.7409 1.5270 1.5270 1.5437 1.5437 1.6162 1.6162 2.5844 2.5844 2.5898 2.5898 5.6372 5.6372 5.9339 5.9339 5.9374 5.9374 13.3284 13.3284 13.8371 13.8371 13.8423 13.8423 15.6050 15.6050 16.9289 16.9289 17.7187 17.7187 k = 0.3846 0.3846 0.3846 ( 3864 PWs) bands (ev): -67.0804 -67.0804 -67.0794 -67.0794 -67.0794 -67.0794 -34.0525 -34.0525 -34.0510 -34.0510 -34.0339 -34.0339 -33.8149 -33.8149 -33.7794 -33.7794 -33.7786 -33.7786 -33.7130 -33.7130 -33.6683 -33.6683 -33.6658 -33.6658 -16.9633 -16.9633 -16.9068 -16.9068 -16.9062 -16.9062 -4.9168 -4.9168 -0.1073 -0.1073 -0.0942 -0.0942 0.0306 0.0306 0.7175 0.7175 1.5423 1.5423 1.5598 1.5598 1.6226 1.6226 2.5936 2.5936 2.5984 2.5984 5.6717 5.6717 5.9380 5.9380 5.9415 5.9415 13.3438 13.3438 13.7789 13.7789 13.7843 13.7843 15.6005 15.6005 16.8857 16.8857 17.7414 17.7414 k = 0.3923 0.3923 0.3923 ( 3858 PWs) bands (ev): -67.0803 -67.0803 -67.0794 -67.0794 -67.0794 -67.0794 -34.0526 -34.0526 -34.0513 -34.0513 -34.0338 -34.0338 -33.8153 -33.8153 -33.7792 -33.7792 -33.7784 -33.7784 -33.7135 -33.7135 -33.6679 -33.6679 -33.6656 -33.6656 -16.9573 -16.9573 -16.9078 -16.9078 -16.9072 -16.9072 -4.9065 -4.9065 -0.1268 -0.1268 -0.1139 -0.1139 -0.0019 -0.0019 0.6958 0.6958 1.5567 1.5567 1.5750 1.5750 1.6287 1.6287 2.6027 2.6027 2.6069 2.6069 5.7057 5.7057 5.9423 5.9423 5.9458 5.9458 13.3544 13.3544 13.7233 13.7233 13.7288 13.7288 15.5985 15.5985 16.8458 16.8458 17.7625 17.7626 k = 0.4000 0.4000 0.4000 ( 3855 PWs) bands (ev): -67.0803 -67.0803 -67.0795 -67.0795 -67.0795 -67.0795 -34.0527 -34.0527 -34.0515 -34.0515 -34.0337 -34.0337 -33.8158 -33.8158 -33.7790 -33.7790 -33.7783 -33.7783 -33.7140 -33.7140 -33.6675 -33.6675 -33.6655 -33.6655 -16.9517 -16.9517 -16.9088 -16.9088 -16.9082 -16.9082 -4.8965 -4.8965 -0.1451 -0.1451 -0.1324 -0.1324 -0.0334 -0.0334 0.6756 0.6756 1.5700 1.5700 1.5891 1.5891 1.6346 1.6346 2.6115 2.6115 2.6153 2.6153 5.7390 5.7390 5.9467 5.9467 5.9501 5.9501 13.3611 13.3611 13.6704 13.6704 13.6761 13.6761 15.5987 15.5987 16.8091 16.8091 17.7820 17.7820 k = 0.4077 0.4077 0.4077 ( 3867 PWs) bands (ev): -67.0802 -67.0802 -67.0795 -67.0795 -67.0795 -67.0795 -34.0528 -34.0528 -34.0518 -34.0518 -34.0337 -34.0337 -33.8162 -33.8162 -33.7788 -33.7788 -33.7782 -33.7782 -33.7144 -33.7144 -33.6671 -33.6671 -33.6654 -33.6654 -16.9464 -16.9464 -16.9098 -16.9098 -16.9091 -16.9091 -4.8870 -4.8870 -0.1623 -0.1623 -0.1498 -0.1498 -0.0636 -0.0636 0.6570 0.6570 1.5821 1.5821 1.6022 1.6022 1.6401 1.6401 2.6201 2.6201 2.6233 2.6233 5.7712 5.7712 5.9511 5.9511 5.9545 5.9545 13.3642 13.3642 13.6204 13.6204 13.6262 13.6262 15.6008 15.6008 16.7755 16.7755 17.8000 17.8000 k = 0.4154 0.4154 0.4154 ( 3873 PWs) bands (ev): -67.0801 -67.0801 -67.0795 -67.0795 -67.0795 -67.0795 -34.0529 -34.0529 -34.0521 -34.0521 -34.0336 -34.0336 -33.8166 -33.8166 -33.7786 -33.7786 -33.7781 -33.7781 -33.7148 -33.7148 -33.6668 -33.6668 -33.6653 -33.6653 -16.9415 -16.9415 -16.9106 -16.9106 -16.9100 -16.9100 -4.8779 -4.8779 -0.1784 -0.1784 -0.1661 -0.1661 -0.0921 -0.0921 0.6400 0.6400 1.5933 1.5933 1.6142 1.6142 1.6453 1.6453 2.6283 2.6283 2.6310 2.6310 5.8020 5.8020 5.9554 5.9554 5.9589 5.9589 13.3644 13.3644 13.5736 13.5736 13.5796 13.5796 15.6045 15.6045 16.7450 16.7450 17.8164 17.8164 k = 0.4231 0.4231 0.4231 ( 3879 PWs) bands (ev): -67.0801 -67.0801 -67.0796 -67.0796 -67.0796 -67.0796 -34.0530 -34.0530 -34.0523 -34.0523 -34.0336 -34.0336 -33.8170 -33.8170 -33.7784 -33.7784 -33.7780 -33.7780 -33.7152 -33.7152 -33.6664 -33.6664 -33.6652 -33.6652 -16.9370 -16.9370 -16.9114 -16.9114 -16.9108 -16.9108 -4.8693 -4.8693 -0.1932 -0.1932 -0.1812 -0.1812 -0.1190 -0.1190 0.6245 0.6245 1.6032 1.6032 1.6251 1.6251 1.6502 1.6502 2.6361 2.6361 2.6384 2.6384 5.8313 5.8313 5.9597 5.9597 5.9632 5.9632 13.3621 13.3621 13.5302 13.5302 13.5363 13.5363 15.6095 15.6095 16.7174 16.7174 17.8314 17.8315 k = 0.4308 0.4308 0.4308 ( 3873 PWs) bands (ev): -67.0800 -67.0800 -67.0796 -67.0796 -67.0796 -67.0796 -34.0531 -34.0531 -34.0525 -34.0525 -34.0335 -34.0335 -33.8173 -33.8173 -33.7782 -33.7782 -33.7779 -33.7779 -33.7156 -33.7156 -33.6661 -33.6661 -33.6652 -33.6652 -16.9329 -16.9329 -16.9122 -16.9122 -16.9115 -16.9115 -4.8613 -4.8613 -0.2066 -0.2066 -0.1951 -0.1951 -0.1437 -0.1437 0.6105 0.6105 1.6122 1.6122 1.6350 1.6350 1.6547 1.6547 2.6435 2.6435 2.6453 2.6453 5.8587 5.8587 5.9638 5.9638 5.9673 5.9673 13.3580 13.3580 13.4903 13.4903 13.4966 13.4966 15.6155 15.6155 16.6928 16.6928 17.8449 17.8449 k = 0.4385 0.4385 0.4385 ( 3885 PWs) bands (ev): -67.0799 -67.0799 -67.0796 -67.0796 -67.0796 -67.0796 -34.0532 -34.0532 -34.0527 -34.0527 -34.0335 -34.0335 -33.8176 -33.8176 -33.7781 -33.7781 -33.7778 -33.7778 -33.7159 -33.7159 -33.6659 -33.6659 -33.6651 -33.6651 -16.9292 -16.9292 -16.9128 -16.9128 -16.9122 -16.9122 -4.8539 -4.8539 -0.2188 -0.2188 -0.2078 -0.2078 -0.1662 -0.1662 0.5980 0.5980 1.6200 1.6200 1.6437 1.6437 1.6589 1.6589 2.6502 2.6502 2.6516 2.6516 5.8839 5.8839 5.9677 5.9677 5.9711 5.9711 13.3526 13.3526 13.4541 13.4541 13.4605 13.4605 15.6220 15.6220 16.6709 16.6709 17.8569 17.8569 k = 0.4462 0.4462 0.4462 ( 3876 PWs) bands (ev): -67.0799 -67.0799 -67.0797 -67.0797 -67.0797 -67.0797 -34.0532 -34.0532 -34.0529 -34.0529 -34.0334 -34.0334 -33.8178 -33.8178 -33.7780 -33.7780 -33.7778 -33.7778 -33.7162 -33.7162 -33.6656 -33.6656 -33.6650 -33.6650 -16.9259 -16.9259 -16.9134 -16.9134 -16.9127 -16.9127 -4.8473 -4.8473 -0.2296 -0.2296 -0.2192 -0.2192 -0.1861 -0.1861 0.5870 0.5870 1.6268 1.6268 1.6515 1.6515 1.6628 1.6628 2.6563 2.6563 2.6575 2.6575 5.9068 5.9068 5.9713 5.9713 5.9747 5.9747 13.3465 13.3465 13.4219 13.4219 13.4284 13.4284 15.6288 15.6288 16.6518 16.6518 17.8675 17.8675 k = 0.4538 0.4538 0.4538 ( 3876 PWs) bands (ev): -67.0799 -67.0799 -67.0797 -67.0797 -67.0797 -67.0797 -34.0533 -34.0533 -34.0530 -34.0530 -34.0334 -34.0334 -33.8181 -33.8181 -33.7778 -33.7778 -33.7777 -33.7777 -33.7164 -33.7164 -33.6654 -33.6654 -33.6649 -33.6649 -16.9230 -16.9230 -16.9139 -16.9139 -16.9132 -16.9132 -4.8414 -4.8414 -0.2390 -0.2390 -0.2297 -0.2297 -0.2033 -0.2033 0.5775 0.5775 1.6326 1.6326 1.6582 1.6582 1.6663 1.6663 2.6618 2.6618 2.6626 2.6626 5.9270 5.9270 5.9745 5.9745 5.9780 5.9780 13.3400 13.3400 13.3936 13.3936 13.4004 13.4004 15.6354 15.6354 16.6353 16.6353 17.8766 17.8766 k = 0.4615 0.4615 0.4615 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0533 -34.0533 -34.0531 -34.0531 -34.0333 -34.0333 -33.8183 -33.8183 -33.7777 -33.7777 -33.7776 -33.7776 -33.7166 -33.7166 -33.6652 -33.6652 -33.6649 -33.6649 -16.9206 -16.9206 -16.9143 -16.9143 -16.9136 -16.9136 -4.8364 -4.8364 -0.2471 -0.2471 -0.2391 -0.2391 -0.2175 -0.2175 0.5694 0.5694 1.6374 1.6374 1.6639 1.6639 1.6693 1.6693 2.6665 2.6665 2.6670 2.6670 5.9445 5.9445 5.9774 5.9774 5.9808 5.9808 13.3336 13.3336 13.3695 13.3695 13.3765 13.3765 15.6416 15.6416 16.6215 16.6215 17.8843 17.8843 k = 0.4692 0.4692 0.4692 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0532 -34.0532 -34.0333 -34.0333 -33.8184 -33.8184 -33.7777 -33.7777 -33.7776 -33.7776 -33.7168 -33.7168 -33.6650 -33.6650 -33.6648 -33.6648 -16.9186 -16.9186 -16.9147 -16.9147 -16.9140 -16.9140 -4.8322 -4.8322 -0.2536 -0.2536 -0.2477 -0.2477 -0.2285 -0.2285 0.5629 0.5629 1.6412 1.6412 1.6685 1.6685 1.6719 1.6719 2.6704 2.6704 2.6707 2.6707 5.9589 5.9589 5.9799 5.9799 5.9832 5.9832 13.3277 13.3277 13.3496 13.3496 13.3569 13.3569 15.6471 15.6471 16.6102 16.6102 17.8907 17.8907 k = 0.4769 0.4769 0.4769 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0533 -34.0533 -34.0333 -34.0333 -33.8185 -33.8185 -33.7776 -33.7776 -33.7776 -33.7776 -33.7169 -33.7169 -33.6649 -33.6649 -33.6648 -33.6648 -16.9171 -16.9171 -16.9150 -16.9150 -16.9142 -16.9142 -4.8289 -4.8289 -0.2588 -0.2588 -0.2550 -0.2550 -0.2364 -0.2364 0.5577 0.5577 1.6441 1.6441 1.6720 1.6720 1.6739 1.6739 2.6734 2.6734 2.6737 2.6737 5.9702 5.9702 5.9820 5.9820 5.9850 5.9850 13.3226 13.3226 13.3340 13.3340 13.3418 13.3418 15.6516 15.6516 16.6014 16.6014 17.8956 17.8956 k = 0.4846 0.4846 0.4846 ( 3882 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0534 -34.0534 -34.0333 -34.0333 -33.8186 -33.8186 -33.7776 -33.7776 -33.7775 -33.7775 -33.7170 -33.7170 -33.6648 -33.6648 -33.6648 -33.6648 -16.9160 -16.9160 -16.9152 -16.9152 -16.9144 -16.9144 -4.8265 -4.8265 -0.2625 -0.2625 -0.2606 -0.2606 -0.2418 -0.2418 0.5541 0.5541 1.6461 1.6461 1.6746 1.6746 1.6754 1.6754 2.6757 2.6757 2.6758 2.6758 5.9777 5.9777 5.9841 5.9841 5.9864 5.9864 13.3182 13.3182 13.3228 13.3228 13.3314 13.3314 15.6549 15.6549 16.5952 16.5952 17.8991 17.8991 k = 0.4923 0.4923 0.4923 ( 3891 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0535 -34.0535 -34.0534 -34.0534 -34.0333 -34.0333 -33.8187 -33.8187 -33.7775 -33.7775 -33.7775 -33.7775 -33.7171 -33.7171 -33.6648 -33.6648 -33.6648 -33.6648 -16.9155 -16.9155 -16.9153 -16.9153 -16.9144 -16.9144 -4.8251 -4.8251 -0.2647 -0.2647 -0.2642 -0.2642 -0.2448 -0.2448 0.5518 0.5518 1.6473 1.6473 1.6761 1.6761 1.6762 1.6762 2.6770 2.6770 2.6770 2.6770 5.9812 5.9812 5.9864 5.9864 5.9872 5.9872 13.3150 13.3150 13.3161 13.3161 13.3256 13.3256 15.6569 15.6569 16.5914 16.5914 17.9012 17.9012 k = 0.5000 0.5000 0.5000 ( 3912 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0535 -34.0535 -34.0535 -34.0535 -34.0333 -34.0333 -33.8188 -33.8188 -33.7776 -33.7776 -33.7776 -33.7776 -33.7171 -33.7171 -33.6648 -33.6648 -33.6648 -33.6648 -16.9153 -16.9153 -16.9153 -16.9153 -16.9143 -16.9143 -4.8246 -4.8246 -0.2655 -0.2655 -0.2655 -0.2655 -0.2459 -0.2459 0.5510 0.5510 1.6477 1.6477 1.6765 1.6765 1.6765 1.6765 2.6774 2.6774 2.6774 2.6774 5.9820 5.9820 5.9875 5.9875 5.9875 5.9875 13.3137 13.3137 13.3137 13.3137 13.3237 13.3237 15.6575 15.6575 16.5902 16.5902 17.9018 17.9018 k = 0.5000 0.5000 0.5000 ( 3912 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0535 -34.0535 -34.0535 -34.0535 -34.0333 -34.0333 -33.8188 -33.8188 -33.7776 -33.7776 -33.7776 -33.7776 -33.7171 -33.7171 -33.6648 -33.6648 -33.6648 -33.6648 -16.9153 -16.9153 -16.9153 -16.9153 -16.9143 -16.9143 -4.8246 -4.8246 -0.2655 -0.2655 -0.2655 -0.2655 -0.2459 -0.2459 0.5510 0.5510 1.6477 1.6477 1.6765 1.6765 1.6765 1.6765 2.6774 2.6774 2.6774 2.6774 5.9820 5.9820 5.9875 5.9875 5.9875 5.9875 13.3137 13.3137 13.3137 13.3137 13.3237 13.3237 15.6575 15.6575 16.5902 16.5902 17.9018 17.9018 k = 0.4906 0.5000 0.4906 ( 3888 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0535 -34.0535 -34.0534 -34.0534 -34.0333 -34.0333 -33.8187 -33.8187 -33.7775 -33.7775 -33.7775 -33.7775 -33.7171 -33.7171 -33.6648 -33.6648 -33.6648 -33.6648 -16.9155 -16.9155 -16.9153 -16.9153 -16.9144 -16.9144 -4.8251 -4.8251 -0.2647 -0.2647 -0.2643 -0.2643 -0.2448 -0.2448 0.5518 0.5518 1.6473 1.6473 1.6760 1.6760 1.6763 1.6763 2.6768 2.6768 2.6772 2.6772 5.9813 5.9813 5.9864 5.9864 5.9872 5.9872 13.3150 13.3150 13.3162 13.3162 13.3256 13.3256 15.6569 15.6569 16.5915 16.5915 17.9011 17.9011 k = 0.4811 0.5000 0.4811 ( 3878 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0534 -34.0534 -34.0333 -34.0333 -33.8186 -33.8186 -33.7776 -33.7776 -33.7775 -33.7775 -33.7170 -33.7170 -33.6648 -33.6648 -33.6648 -33.6648 -16.9159 -16.9159 -16.9153 -16.9153 -16.9143 -16.9143 -4.8265 -4.8265 -0.2624 -0.2624 -0.2607 -0.2607 -0.2418 -0.2418 0.5541 0.5541 1.6461 1.6461 1.6744 1.6744 1.6755 1.6755 2.6748 2.6748 2.6766 2.6766 5.9783 5.9783 5.9833 5.9833 5.9866 5.9866 13.3180 13.3180 13.3230 13.3230 13.3316 13.3316 15.6549 15.6549 16.5952 16.5952 17.8986 17.8986 k = 0.4717 0.5000 0.4717 ( 3878 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0533 -34.0533 -34.0333 -34.0333 -33.8185 -33.8185 -33.7776 -33.7776 -33.7775 -33.7775 -33.7169 -33.7169 -33.6649 -33.6649 -33.6648 -33.6648 -16.9166 -16.9166 -16.9156 -16.9156 -16.9140 -16.9140 -4.8289 -4.8289 -0.2586 -0.2586 -0.2550 -0.2550 -0.2365 -0.2365 0.5577 0.5577 1.6440 1.6440 1.6717 1.6717 1.6742 1.6742 2.6716 2.6716 2.6755 2.6755 5.9722 5.9722 5.9787 5.9787 5.9862 5.9862 13.3220 13.3220 13.3342 13.3342 13.3423 13.3423 15.6515 15.6515 16.6015 16.6015 17.8942 17.8942 k = 0.4623 0.5000 0.4623 ( 3878 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0532 -34.0532 -34.0333 -34.0333 -33.8184 -33.8184 -33.7777 -33.7777 -33.7776 -33.7776 -33.7168 -33.7168 -33.6651 -33.6651 -33.6648 -33.6648 -16.9178 -16.9178 -16.9161 -16.9161 -16.9134 -16.9134 -4.8322 -4.8322 -0.2534 -0.2534 -0.2473 -0.2473 -0.2289 -0.2289 0.5629 0.5629 1.6410 1.6410 1.6680 1.6680 1.6725 1.6725 2.6670 2.6670 2.6740 2.6740 5.9631 5.9631 5.9728 5.9728 5.9860 5.9860 13.3269 13.3269 13.3497 13.3497 13.3580 13.3580 15.6469 15.6469 16.6102 16.6102 17.8879 17.8879 k = 0.4528 0.5000 0.4528 ( 3878 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0533 -34.0533 -34.0531 -34.0531 -34.0333 -34.0333 -33.8183 -33.8183 -33.7778 -33.7778 -33.7776 -33.7776 -33.7166 -33.7166 -33.6652 -33.6652 -33.6649 -33.6649 -16.9193 -16.9193 -16.9167 -16.9167 -16.9126 -16.9126 -4.8364 -4.8364 -0.2470 -0.2470 -0.2379 -0.2379 -0.2185 -0.2185 0.5695 0.5695 1.6370 1.6370 1.6632 1.6632 1.6703 1.6703 2.6613 2.6613 2.6720 2.6720 5.9512 5.9512 5.9654 5.9654 5.9858 5.9858 13.3328 13.3328 13.3692 13.3692 13.3783 13.3783 15.6413 15.6413 16.6215 16.6215 17.8796 17.8796 k = 0.4434 0.5000 0.4434 ( 3878 PWs) bands (ev): -67.0798 -67.0798 -67.0797 -67.0797 -67.0797 -67.0797 -34.0533 -34.0533 -34.0530 -34.0530 -34.0334 -34.0334 -33.8181 -33.8181 -33.7779 -33.7779 -33.7776 -33.7776 -33.7164 -33.7164 -33.6654 -33.6654 -33.6649 -33.6649 -16.9211 -16.9211 -16.9174 -16.9174 -16.9116 -16.9116 -4.8415 -4.8415 -0.2393 -0.2393 -0.2271 -0.2271 -0.2054 -0.2054 0.5775 0.5775 1.6319 1.6319 1.6574 1.6574 1.6677 1.6677 2.6544 2.6544 2.6697 2.6697 5.9370 5.9370 5.9565 5.9565 5.9856 5.9856 13.3397 13.3397 13.3928 13.3928 13.4028 13.4028 15.6348 15.6348 16.6354 16.6354 17.8696 17.8696 k = 0.4340 0.5000 0.4340 ( 3878 PWs) bands (ev): -67.0799 -67.0799 -67.0797 -67.0797 -67.0796 -67.0796 -34.0532 -34.0532 -34.0529 -34.0529 -34.0334 -34.0334 -33.8178 -33.8178 -33.7781 -33.7781 -33.7776 -33.7776 -33.7162 -33.7162 -33.6657 -33.6657 -33.6650 -33.6650 -16.9233 -16.9233 -16.9183 -16.9183 -16.9104 -16.9104 -4.8474 -4.8474 -0.2303 -0.2303 -0.2148 -0.2148 -0.1894 -0.1894 0.5870 0.5870 1.6255 1.6255 1.6507 1.6507 1.6648 1.6648 2.6465 2.6465 2.6669 2.6669 5.9206 5.9206 5.9460 5.9460 5.9855 5.9855 13.3476 13.3476 13.4203 13.4203 13.4312 13.4312 15.6278 15.6278 16.6518 16.6518 17.8577 17.8577 k = 0.4245 0.5000 0.4245 ( 3880 PWs) bands (ev): -67.0799 -67.0799 -67.0797 -67.0797 -67.0796 -67.0796 -34.0532 -34.0532 -34.0527 -34.0527 -34.0335 -34.0335 -33.8176 -33.8176 -33.7783 -33.7783 -33.7777 -33.7777 -33.7159 -33.7159 -33.6659 -33.6659 -33.6650 -33.6650 -16.9258 -16.9258 -16.9193 -16.9193 -16.9091 -16.9091 -4.8540 -4.8540 -0.2202 -0.2202 -0.2011 -0.2011 -0.1707 -0.1707 0.5980 0.5980 1.6179 1.6179 1.6432 1.6432 1.6616 1.6616 2.6375 2.6375 2.6636 2.6636 5.9022 5.9022 5.9341 5.9341 5.9853 5.9853 13.3564 13.3564 13.4518 13.4518 13.4629 13.4629 15.6205 15.6205 16.6708 16.6708 17.8442 17.8442 k = 0.4151 0.5000 0.4151 ( 3884 PWs) bands (ev): -67.0799 -67.0799 -67.0797 -67.0797 -67.0796 -67.0796 -34.0531 -34.0531 -34.0525 -34.0525 -34.0335 -34.0335 -33.8173 -33.8173 -33.7785 -33.7785 -33.7777 -33.7777 -33.7156 -33.7156 -33.6663 -33.6663 -33.6651 -33.6651 -16.9285 -16.9285 -16.9204 -16.9204 -16.9076 -16.9076 -4.8614 -4.8614 -0.2090 -0.2090 -0.1859 -0.1859 -0.1496 -0.1496 0.6104 0.6104 1.6088 1.6088 1.6348 1.6348 1.6581 1.6581 2.6276 2.6276 2.6600 2.6600 5.8822 5.8822 5.9207 5.9207 5.9852 5.9852 13.3659 13.3659 13.4870 13.4870 13.4974 13.4974 15.6133 15.6133 16.6924 16.6924 17.8291 17.8291 k = 0.4057 0.5000 0.4057 ( 3880 PWs) bands (ev): -67.0800 -67.0800 -67.0797 -67.0797 -67.0795 -67.0795 -34.0530 -34.0530 -34.0523 -34.0523 -34.0336 -34.0336 -33.8170 -33.8170 -33.7787 -33.7787 -33.7778 -33.7778 -33.7152 -33.7152 -33.6666 -33.6666 -33.6651 -33.6651 -16.9316 -16.9316 -16.9217 -16.9217 -16.9059 -16.9059 -4.8694 -4.8694 -0.1966 -0.1966 -0.1692 -0.1692 -0.1263 -0.1263 0.6242 0.6242 1.5984 1.5984 1.6256 1.6256 1.6543 1.6543 2.6170 2.6170 2.6559 2.6559 5.8609 5.8609 5.9060 5.9060 5.9850 5.9850 13.3761 13.3761 13.5259 13.5259 13.5343 13.5343 15.6065 15.6065 16.7166 16.7166 17.8124 17.8124 k = 0.3962 0.5000 0.3962 ( 3880 PWs) bands (ev): -67.0800 -67.0800 -67.0797 -67.0797 -67.0795 -67.0795 -34.0530 -34.0530 -34.0521 -34.0521 -34.0337 -34.0337 -33.8166 -33.8166 -33.7789 -33.7789 -33.7778 -33.7778 -33.7148 -33.7148 -33.6670 -33.6670 -33.6652 -33.6652 -16.9349 -16.9349 -16.9230 -16.9230 -16.9041 -16.9041 -4.8780 -4.8780 -0.1831 -0.1831 -0.1509 -0.1509 -0.1010 -0.1010 0.6394 0.6394 1.5865 1.5865 1.6158 1.6158 1.6502 1.6502 2.6057 2.6057 2.6515 2.6515 5.8385 5.8385 5.8898 5.8898 5.9848 5.9848 13.3868 13.3868 13.5675 13.5675 13.5736 13.5736 15.6007 15.6007 16.7434 16.7434 17.7943 17.7943 k = 0.3868 0.5000 0.3868 ( 3874 PWs) bands (ev): -67.0801 -67.0801 -67.0797 -67.0797 -67.0794 -67.0794 -34.0529 -34.0529 -34.0518 -34.0518 -34.0337 -34.0337 -33.8162 -33.8162 -33.7791 -33.7791 -33.7779 -33.7779 -33.7144 -33.7144 -33.6673 -33.6673 -33.6653 -33.6653 -16.9386 -16.9386 -16.9245 -16.9245 -16.9021 -16.9021 -4.8871 -4.8871 -0.1684 -0.1684 -0.1313 -0.1313 -0.0738 -0.0738 0.6561 0.6561 1.5733 1.5733 1.6051 1.6051 1.6458 1.6458 2.5938 2.5938 2.6466 2.6466 5.8154 5.8154 5.8724 5.8724 5.9846 5.9846 13.3979 13.3979 13.6089 13.6089 13.6177 13.6177 15.5965 15.5965 16.7728 16.7728 17.7748 17.7748 k = 0.3774 0.5000 0.3774 ( 3866 PWs) bands (ev): -67.0801 -67.0801 -67.0797 -67.0797 -67.0794 -67.0794 -34.0528 -34.0528 -34.0515 -34.0515 -34.0338 -34.0338 -33.8158 -33.8158 -33.7794 -33.7794 -33.7779 -33.7779 -33.7140 -33.7140 -33.6677 -33.6677 -33.6654 -33.6654 -16.9424 -16.9424 -16.9261 -16.9261 -16.8999 -16.8999 -4.8967 -4.8967 -0.1526 -0.1526 -0.1103 -0.1103 -0.0449 -0.0449 0.6742 0.6742 1.5586 1.5586 1.5938 1.5938 1.6411 1.6411 2.5814 2.5814 2.6413 2.6413 5.7918 5.7918 5.8537 5.8537 5.9844 5.9844 13.4093 13.4093 13.6485 13.6485 13.6670 13.6670 15.5942 15.5942 16.8047 16.8047 17.7542 17.7543 k = 0.3679 0.5000 0.3679 ( 3854 PWs) bands (ev): -67.0802 -67.0802 -67.0797 -67.0797 -67.0793 -67.0793 -34.0526 -34.0526 -34.0512 -34.0512 -34.0338 -34.0338 -33.8153 -33.8153 -33.7797 -33.7797 -33.7780 -33.7780 -33.7135 -33.7135 -33.6681 -33.6681 -33.6654 -33.6654 -16.9466 -16.9466 -16.9277 -16.9277 -16.8976 -16.8976 -4.9067 -4.9067 -0.1356 -0.1356 -0.0879 -0.0879 -0.0147 -0.0147 0.6937 0.6937 1.5426 1.5426 1.5817 1.5817 1.6360 1.6360 2.5687 2.5687 2.6357 2.6357 5.7681 5.7681 5.8339 5.8339 5.9842 5.9842 13.4209 13.4209 13.6868 13.6868 13.7202 13.7202 15.5946 15.5946 16.8390 16.8390 17.7327 17.7327 k = 0.3585 0.5000 0.3585 ( 3864 PWs) bands (ev): -67.0803 -67.0803 -67.0797 -67.0797 -67.0792 -67.0792 -34.0525 -34.0525 -34.0510 -34.0510 -34.0339 -34.0339 -33.8149 -33.8149 -33.7800 -33.7800 -33.7781 -33.7781 -33.7130 -33.7130 -33.6686 -33.6686 -33.6656 -33.6656 -16.9509 -16.9509 -16.9295 -16.9295 -16.8952 -16.8952 -4.9170 -4.9170 -0.1176 -0.1176 -0.0644 -0.0644 0.0168 0.0168 0.7145 0.7145 1.5251 1.5251 1.5687 1.5687 1.6305 1.6305 2.5556 2.5556 2.6296 2.6296 5.7445 5.7445 5.8129 5.8129 5.9839 5.9839 13.4323 13.4323 13.7232 13.7232 13.7766 13.7766 15.5983 15.5983 16.8755 16.8755 17.7105 17.7105 k = 0.3491 0.5000 0.3491 ( 3864 PWs) bands (ev): -67.0803 -67.0803 -67.0797 -67.0797 -67.0792 -67.0792 -34.0524 -34.0524 -34.0507 -34.0507 -34.0340 -34.0340 -33.8144 -33.8144 -33.7803 -33.7803 -33.7781 -33.7781 -33.7124 -33.7124 -33.6691 -33.6691 -33.6657 -33.6657 -16.9555 -16.9555 -16.9314 -16.9314 -16.8927 -16.8927 -4.9276 -4.9276 -0.0986 -0.0986 -0.0397 -0.0397 0.0494 0.0494 0.7367 0.7367 1.5065 1.5065 1.5551 1.5551 1.6246 1.6246 2.5424 2.5424 2.6232 2.6232 5.7214 5.7214 5.7908 5.7908 5.9836 5.9836 13.4436 13.4436 13.7571 13.7571 13.8363 13.8363 15.6058 15.6058 16.9139 16.9139 17.6879 17.6879 k = 0.3396 0.5000 0.3396 ( 3870 PWs) bands (ev): -67.0804 -67.0804 -67.0797 -67.0797 -67.0791 -67.0791 -34.0523 -34.0523 -34.0504 -34.0504 -34.0341 -34.0341 -33.8139 -33.8139 -33.7806 -33.7806 -33.7782 -33.7782 -33.7119 -33.7119 -33.6696 -33.6696 -33.6658 -33.6658 -16.9602 -16.9602 -16.9333 -16.9333 -16.8901 -16.8901 -4.9383 -4.9383 -0.0785 -0.0785 -0.0140 -0.0140 0.0829 0.0829 0.7602 0.7602 1.4867 1.4867 1.5407 1.5407 1.6184 1.6184 2.5290 2.5290 2.6163 2.6163 5.6991 5.6991 5.7678 5.7678 5.9832 5.9832 13.4546 13.4546 13.7874 13.7874 13.8989 13.8989 15.6179 15.6179 16.9538 16.9538 17.6654 17.6654 k = 0.3302 0.5000 0.3302 ( 3870 PWs) bands (ev): -67.0805 -67.0805 -67.0797 -67.0797 -67.0790 -67.0790 -34.0522 -34.0522 -34.0501 -34.0501 -34.0342 -34.0342 -33.8133 -33.8133 -33.7810 -33.7810 -33.7783 -33.7783 -33.7113 -33.7113 -33.6701 -33.6701 -33.6659 -33.6659 -16.9651 -16.9651 -16.9353 -16.9353 -16.8874 -16.8874 -4.9492 -4.9492 -0.0574 -0.0574 0.0128 0.0128 0.1170 0.1170 0.7850 0.7850 1.4658 1.4658 1.5256 1.5256 1.6117 1.6117 2.5158 2.5158 2.6092 2.6092 5.6779 5.6779 5.7438 5.7438 5.9829 5.9829 13.4653 13.4653 13.8135 13.8135 13.9644 13.9644 15.6351 15.6351 16.9945 16.9945 17.6438 17.6438 k = 0.3208 0.5000 0.3208 ( 3870 PWs) bands (ev): -67.0805 -67.0805 -67.0797 -67.0797 -67.0789 -67.0789 -34.0521 -34.0521 -34.0497 -34.0497 -34.0343 -34.0343 -33.8128 -33.8128 -33.7813 -33.7813 -33.7785 -33.7785 -33.7107 -33.7107 -33.6706 -33.6706 -33.6660 -33.6660 -16.9702 -16.9702 -16.9374 -16.9374 -16.8845 -16.8845 -4.9602 -4.9602 -0.0354 -0.0354 0.0404 0.0404 0.1517 0.1517 0.8111 0.8111 1.4439 1.4439 1.5097 1.5097 1.6045 1.6045 2.5025 2.5025 2.6016 2.6016 5.6580 5.6580 5.7190 5.7190 5.9825 5.9825 13.4755 13.4755 13.8347 13.8347 14.0326 14.0326 15.6580 15.6580 17.0352 17.0352 17.6241 17.6241 k = 0.3113 0.5000 0.3113 ( 3876 PWs) bands (ev): -67.0806 -67.0806 -67.0798 -67.0798 -67.0789 -67.0789 -34.0520 -34.0520 -34.0494 -34.0494 -34.0344 -34.0344 -33.8122 -33.8122 -33.7817 -33.7817 -33.7786 -33.7786 -33.7101 -33.7101 -33.6711 -33.6711 -33.6662 -33.6662 -16.9754 -16.9754 -16.9396 -16.9396 -16.8816 -16.8816 -4.9712 -4.9712 -0.0124 -0.0124 0.0687 0.0687 0.1866 0.1866 0.8384 0.8384 1.4209 1.4209 1.4932 1.4932 1.5970 1.5970 2.4895 2.4895 2.5938 2.5938 5.6398 5.6398 5.6934 5.6934 5.9821 5.9821 13.4850 13.4850 13.8503 13.8503 14.1033 14.1033 15.6866 15.6866 17.0744 17.0744 17.6076 17.6076 k = 0.3019 0.5000 0.3019 ( 3880 PWs) bands (ev): -67.0807 -67.0807 -67.0798 -67.0798 -67.0788 -67.0788 -34.0519 -34.0519 -34.0491 -34.0491 -34.0345 -34.0345 -33.8116 -33.8116 -33.7821 -33.7821 -33.7787 -33.7787 -33.7094 -33.7094 -33.6717 -33.6717 -33.6663 -33.6663 -16.9808 -16.9808 -16.9418 -16.9418 -16.8786 -16.8786 -4.9821 -4.9821 0.0115 0.0115 0.0977 0.0977 0.2217 0.2217 0.8669 0.8669 1.3971 1.3971 1.4759 1.4759 1.5889 1.5889 2.4766 2.4766 2.5855 2.5855 5.6233 5.6233 5.6671 5.6671 5.9816 5.9816 13.4939 13.4939 13.8601 13.8601 14.1764 14.1764 15.7214 15.7214 17.1099 17.1099 17.5966 17.5966 k = 0.2925 0.5000 0.2925 ( 3868 PWs) bands (ev): -67.0808 -67.0808 -67.0798 -67.0798 -67.0787 -67.0787 -34.0518 -34.0518 -34.0487 -34.0487 -34.0346 -34.0346 -33.8109 -33.8109 -33.7825 -33.7825 -33.7788 -33.7788 -33.7087 -33.7087 -33.6722 -33.6722 -33.6664 -33.6664 -16.9862 -16.9862 -16.9440 -16.9440 -16.8756 -16.8756 -4.9930 -4.9930 0.0363 0.0363 0.1273 0.1273 0.2568 0.2568 0.8967 0.8967 1.3726 1.3726 1.4579 1.4579 1.5803 1.5803 2.4641 2.4641 2.5770 2.5770 5.6090 5.6090 5.6402 5.6402 5.9811 5.9811 13.5022 13.5022 13.8637 13.8637 14.2518 14.2518 15.7622 15.7622 17.1390 17.1390 17.5938 17.5938 k = 0.2830 0.5000 0.2830 ( 3872 PWs) bands (ev): -67.0809 -67.0809 -67.0798 -67.0798 -67.0786 -67.0786 -34.0517 -34.0517 -34.0484 -34.0484 -34.0347 -34.0347 -33.8103 -33.8103 -33.7829 -33.7829 -33.7790 -33.7790 -33.7081 -33.7081 -33.6728 -33.6728 -33.6666 -33.6666 -16.9917 -16.9917 -16.9463 -16.9463 -16.8725 -16.8725 -5.0037 -5.0037 0.0619 0.0619 0.1574 0.1574 0.2916 0.2916 0.9275 0.9275 1.3473 1.3473 1.4393 1.4393 1.5713 1.5713 2.4519 2.4519 2.5682 2.5682 5.5968 5.5968 5.6128 5.6128 5.9806 5.9806 13.5096 13.5096 13.8612 13.8612 14.3293 14.3293 15.8087 15.8087 17.1588 17.1588 17.5917 17.5917 k = 0.2736 0.5000 0.2736 ( 3868 PWs) bands (ev): -67.0809 -67.0809 -67.0798 -67.0798 -67.0786 -67.0786 -34.0516 -34.0516 -34.0480 -34.0480 -34.0348 -34.0348 -33.8096 -33.8096 -33.7833 -33.7833 -33.7791 -33.7791 -33.7073 -33.7073 -33.6734 -33.6734 -33.6667 -33.6667 -16.9972 -16.9972 -16.9486 -16.9486 -16.8693 -16.8693 -5.0142 -5.0142 0.0883 0.0883 0.1878 0.1878 0.3260 0.3260 0.9594 0.9594 1.3214 1.3214 1.4201 1.4201 1.5617 1.5617 2.4400 2.4400 2.5591 2.5591 5.5837 5.5837 5.5882 5.5882 5.9800 5.9800 13.5161 13.5161 13.8526 13.8526 14.4088 14.4088 15.8607 15.8607 17.1671 17.1671 17.5635 17.5635 k = 0.2642 0.5000 0.2642 ( 3864 PWs) bands (ev): -67.0810 -67.0810 -67.0798 -67.0798 -67.0785 -67.0785 -34.0515 -34.0515 -34.0476 -34.0476 -34.0349 -34.0349 -33.8090 -33.8090 -33.7837 -33.7837 -33.7793 -33.7793 -33.7066 -33.7066 -33.6739 -33.6739 -33.6669 -33.6669 -17.0028 -17.0028 -16.9510 -16.9510 -16.8661 -16.8661 -5.0245 -5.0245 0.1154 0.1154 0.2184 0.2184 0.3599 0.3599 0.9923 0.9923 1.2952 1.2952 1.4004 1.4004 1.5516 1.5516 2.4286 2.4286 2.5496 2.5496 5.5560 5.5560 5.5803 5.5803 5.9794 5.9794 13.5219 13.5219 13.8383 13.8383 14.4900 14.4900 15.9175 15.9175 17.1638 17.1638 17.5338 17.5338 k = 0.2547 0.5000 0.2547 ( 3860 PWs) bands (ev): -67.0811 -67.0811 -67.0798 -67.0798 -67.0784 -67.0784 -34.0514 -34.0514 -34.0473 -34.0473 -34.0349 -34.0349 -33.8083 -33.8083 -33.7841 -33.7841 -33.7794 -33.7794 -33.7059 -33.7059 -33.6745 -33.6745 -33.6671 -33.6671 -17.0085 -17.0085 -16.9533 -16.9533 -16.8629 -16.8629 -5.0345 -5.0345 0.1432 0.1432 0.2491 0.2491 0.3931 0.3931 1.0261 1.0261 1.2686 1.2686 1.3802 1.3802 1.5409 1.5409 2.4175 2.4175 2.5400 2.5400 5.5272 5.5272 5.5757 5.5757 5.9788 5.9788 13.5267 13.5267 13.8186 13.8186 14.5729 14.5729 15.9785 15.9785 17.1505 17.1505 17.5028 17.5028 k = 0.2453 0.5000 0.2453 ( 3856 PWs) bands (ev): -67.0812 -67.0812 -67.0798 -67.0798 -67.0783 -67.0783 -34.0513 -34.0513 -34.0469 -34.0469 -34.0350 -34.0350 -33.8076 -33.8076 -33.7845 -33.7845 -33.7796 -33.7796 -33.7051 -33.7051 -33.6751 -33.6751 -33.6672 -33.6672 -17.0141 -17.0141 -16.9557 -16.9557 -16.8597 -16.8597 -5.0442 -5.0442 0.1718 0.1718 0.2799 0.2799 0.4254 0.4254 1.0606 1.0606 1.2418 1.2418 1.3596 1.3596 1.5297 1.5297 2.4069 2.4069 2.5300 2.5300 5.4982 5.4982 5.5739 5.5739 5.9782 5.9782 13.5307 13.5307 13.7939 13.7939 14.6572 14.6572 16.0431 16.0431 17.1296 17.1296 17.4705 17.4705 k = 0.2358 0.5000 0.2358 ( 3856 PWs) bands (ev): -67.0813 -67.0813 -67.0798 -67.0798 -67.0782 -67.0782 -34.0512 -34.0512 -34.0466 -34.0466 -34.0351 -34.0351 -33.8069 -33.8069 -33.7849 -33.7849 -33.7798 -33.7798 -33.7043 -33.7043 -33.6756 -33.6756 -33.6674 -33.6674 -17.0197 -17.0197 -16.9580 -16.9580 -16.8565 -16.8565 -5.0537 -5.0537 0.2009 0.2009 0.3106 0.3106 0.4569 0.4569 1.0956 1.0956 1.2151 1.2151 1.3387 1.3387 1.5179 1.5179 2.3967 2.3967 2.5198 2.5198 5.4689 5.4689 5.5749 5.5749 5.9775 5.9775 13.5338 13.5338 13.7648 13.7648 14.7428 14.7428 16.1104 16.1104 17.1029 17.1029 17.4369 17.4369 k = 0.2264 0.5000 0.2264 ( 3852 PWs) bands (ev): -67.0813 -67.0813 -67.0798 -67.0798 -67.0781 -67.0781 -34.0511 -34.0511 -34.0463 -34.0463 -34.0352 -34.0352 -33.8062 -33.8062 -33.7853 -33.7853 -33.7800 -33.7800 -33.7036 -33.7036 -33.6762 -33.6762 -33.6676 -33.6676 -17.0253 -17.0253 -16.9604 -16.9604 -16.8533 -16.8533 -5.0628 -5.0628 0.2305 0.2305 0.3411 0.3411 0.4873 0.4873 1.1304 1.1304 1.1892 1.1892 1.3177 1.3177 1.5055 1.5055 2.3869 2.3869 2.5094 2.5094 5.4396 5.4396 5.5785 5.5785 5.9768 5.9768 13.5361 13.5361 13.7317 13.7317 14.8295 14.8295 16.1797 16.1797 17.0724 17.0724 17.4023 17.4023 k = 0.2170 0.5000 0.2170 ( 3852 PWs) bands (ev): -67.0814 -67.0814 -67.0798 -67.0798 -67.0781 -67.0781 -34.0511 -34.0511 -34.0459 -34.0459 -34.0352 -34.0352 -33.8054 -33.8054 -33.7857 -33.7857 -33.7802 -33.7802 -33.7028 -33.7028 -33.6767 -33.6767 -33.6678 -33.6678 -17.0308 -17.0308 -16.9627 -16.9627 -16.8501 -16.8501 -5.0715 -5.0715 0.2607 0.2607 0.3713 0.3713 0.5166 0.5166 1.1522 1.1522 1.1766 1.1766 1.2967 1.2967 1.4925 1.4925 2.3776 2.3776 2.4988 2.4988 5.4102 5.4102 5.5849 5.5849 5.9760 5.9760 13.5376 13.5376 13.6951 13.6951 14.9171 14.9171 16.2502 16.2502 17.0390 17.0390 17.3667 17.3667 k = 0.2075 0.5000 0.2075 ( 3872 PWs) bands (ev): -67.0815 -67.0815 -67.0798 -67.0798 -67.0780 -67.0780 -34.0510 -34.0510 -34.0456 -34.0456 -34.0353 -34.0353 -33.8048 -33.8048 -33.7861 -33.7861 -33.7805 -33.7805 -33.7021 -33.7021 -33.6773 -33.6773 -33.6680 -33.6680 -17.0363 -17.0363 -16.9650 -16.9650 -16.8470 -16.8470 -5.0799 -5.0799 0.2912 0.2912 0.4012 0.4012 0.5447 0.5447 1.1313 1.1313 1.2062 1.2062 1.2765 1.2765 1.4789 1.4789 2.3687 2.3687 2.4879 2.4879 5.3808 5.3808 5.5939 5.5939 5.9752 5.9752 13.5382 13.5382 13.6554 13.6554 15.0053 15.0053 16.3209 16.3209 17.0037 17.0037 17.3302 17.3302 k = 0.1981 0.5000 0.1981 ( 3872 PWs) bands (ev): -67.0816 -67.0816 -67.0798 -67.0798 -67.0779 -67.0779 -34.0510 -34.0510 -34.0453 -34.0453 -34.0354 -34.0354 -33.8040 -33.8040 -33.7865 -33.7865 -33.7807 -33.7807 -33.7013 -33.7013 -33.6778 -33.6778 -33.6682 -33.6682 -17.0416 -17.0416 -16.9673 -16.9673 -16.8439 -16.8439 -5.0878 -5.0878 0.3223 0.3223 0.4305 0.4305 0.5716 0.5716 1.1057 1.1057 1.2327 1.2327 1.2649 1.2649 1.4647 1.4647 2.3603 2.3603 2.4769 2.4769 5.3516 5.3516 5.6053 5.6053 5.9745 5.9745 13.5382 13.5382 13.6134 13.6134 15.0942 15.0942 16.3913 16.3913 16.9671 16.9671 17.2930 17.2930 k = 0.1887 0.5000 0.1887 ( 3870 PWs) bands (ev): -67.0817 -67.0817 -67.0798 -67.0798 -67.0778 -67.0778 -34.0509 -34.0509 -34.0450 -34.0450 -34.0355 -34.0355 -33.8033 -33.8033 -33.7869 -33.7869 -33.7810 -33.7810 -33.7006 -33.7006 -33.6783 -33.6783 -33.6684 -33.6684 -17.0468 -17.0468 -16.9695 -16.9695 -16.8409 -16.8409 -5.0954 -5.0954 0.3536 0.3536 0.4593 0.4593 0.5972 0.5972 1.0800 1.0800 1.2247 1.2247 1.2887 1.2887 1.4500 1.4500 2.3523 2.3523 2.4658 2.4658 5.3227 5.3227 5.6192 5.6192 5.9737 5.9737 13.5375 13.5375 13.5692 13.5692 15.1833 15.1833 16.4605 16.4605 16.9298 16.9298 17.2553 17.2553 k = 0.1792 0.5000 0.1792 ( 3866 PWs) bands (ev): -67.0818 -67.0818 -67.0798 -67.0798 -67.0778 -67.0778 -34.0509 -34.0509 -34.0447 -34.0447 -34.0355 -34.0355 -33.8026 -33.8026 -33.7872 -33.7872 -33.7812 -33.7812 -33.6998 -33.6998 -33.6788 -33.6788 -33.6686 -33.6686 -17.0519 -17.0519 -16.9717 -16.9717 -16.8379 -16.8379 -5.1025 -5.1025 0.3853 0.3853 0.4874 0.4874 0.6216 0.6216 1.0548 1.0548 1.2050 1.2050 1.3242 1.3242 1.4348 1.4348 2.3448 2.3448 2.4545 2.4545 5.2941 5.2941 5.6351 5.6351 5.9729 5.9729 13.5233 13.5233 13.5365 13.5365 15.2725 15.2725 16.5277 16.5277 16.8921 16.8921 17.2173 17.2173 k = 0.1698 0.5000 0.1698 ( 3850 PWs) bands (ev): -67.0818 -67.0818 -67.0798 -67.0798 -67.0777 -67.0777 -34.0508 -34.0508 -34.0444 -34.0444 -34.0355 -34.0355 -33.8018 -33.8018 -33.7876 -33.7876 -33.7815 -33.7815 -33.6991 -33.6991 -33.6792 -33.6792 -33.6688 -33.6688 -17.0569 -17.0569 -16.9738 -16.9738 -16.8350 -16.8350 -5.1093 -5.1093 0.4172 0.4172 0.5148 0.5148 0.6447 0.6447 1.0302 1.0302 1.1842 1.1842 1.3606 1.3606 1.4196 1.4196 2.3377 2.3377 2.4431 2.4431 5.2660 5.2660 5.6531 5.6531 5.9721 5.9721 13.4765 13.4765 13.5346 13.5346 15.3615 15.3615 16.5922 16.5922 16.8544 16.8544 17.1792 17.1792 k = 0.1604 0.5000 0.1604 ( 3858 PWs) bands (ev): -67.0819 -67.0819 -67.0798 -67.0798 -67.0776 -67.0776 -34.0508 -34.0508 -34.0441 -34.0441 -34.0356 -34.0356 -33.8011 -33.8011 -33.7880 -33.7880 -33.7818 -33.7818 -33.6984 -33.6984 -33.6797 -33.6797 -33.6690 -33.6690 -17.0617 -17.0617 -16.9759 -16.9759 -16.8322 -16.8322 -5.1156 -5.1156 0.4493 0.4493 0.5412 0.5412 0.6664 0.6664 1.0062 1.0062 1.1632 1.1632 1.3897 1.3897 1.4111 1.4111 2.3310 2.3310 2.4317 2.4317 5.2383 5.2383 5.6727 5.6727 5.9713 5.9713 13.4290 13.4290 13.5324 13.5324 15.4500 15.4500 16.6532 16.6532 16.8170 16.8170 17.1413 17.1413 k = 0.1509 0.5000 0.1509 ( 3870 PWs) bands (ev): -67.0820 -67.0820 -67.0798 -67.0798 -67.0775 -67.0775 -34.0508 -34.0508 -34.0439 -34.0439 -34.0356 -34.0356 -33.8004 -33.8004 -33.7883 -33.7883 -33.7821 -33.7821 -33.6977 -33.6977 -33.6801 -33.6801 -33.6692 -33.6692 -17.0663 -17.0663 -16.9779 -16.9779 -16.8295 -16.8295 -5.1215 -5.1215 0.4815 0.4815 0.5667 0.5667 0.6868 0.6868 0.9831 0.9831 1.1424 1.1424 1.3811 1.3811 1.4393 1.4393 2.3246 2.3246 2.4201 2.4201 5.2114 5.2114 5.6937 5.6937 5.9705 5.9705 13.3811 13.3811 13.5297 13.5297 15.5376 15.5376 16.7102 16.7102 16.7801 16.7801 17.1038 17.1038 k = 0.1415 0.5000 0.1415 ( 3882 PWs) bands (ev): -67.0821 -67.0821 -67.0798 -67.0798 -67.0775 -67.0775 -34.0508 -34.0508 -34.0436 -34.0436 -34.0357 -34.0357 -33.7997 -33.7997 -33.7887 -33.7887 -33.7825 -33.7825 -33.6970 -33.6970 -33.6806 -33.6806 -33.6694 -33.6694 -17.0707 -17.0707 -16.9798 -16.9798 -16.8269 -16.8269 -5.1270 -5.1270 0.5137 0.5137 0.5913 0.5913 0.7059 0.7059 0.9609 0.9609 1.1221 1.1221 1.3639 1.3639 1.4750 1.4750 2.3187 2.3187 2.4085 2.4085 5.1852 5.1852 5.7159 5.7159 5.9697 5.9697 13.3334 13.3334 13.5268 13.5268 15.6242 15.6242 16.7440 16.7440 16.7626 16.7626 17.0670 17.0670 k = 0.1321 0.5000 0.1321 ( 3886 PWs) bands (ev): -67.0821 -67.0821 -67.0798 -67.0798 -67.0774 -67.0774 -34.0508 -34.0508 -34.0434 -34.0434 -34.0357 -34.0357 -33.7990 -33.7990 -33.7890 -33.7890 -33.7828 -33.7828 -33.6964 -33.6964 -33.6809 -33.6809 -33.6696 -33.6696 -17.0749 -17.0749 -16.9816 -16.9816 -16.8245 -16.8245 -5.1321 -5.1321 0.5459 0.5459 0.6148 0.6148 0.7238 0.7238 0.9398 0.9398 1.1022 1.1022 1.3455 1.3455 1.5108 1.5108 2.3131 2.3131 2.3971 2.3971 5.1599 5.1599 5.7389 5.7389 5.9689 5.9689 13.2863 13.2863 13.5237 13.5237 15.7093 15.7093 16.7091 16.7091 16.8101 16.8101 17.0312 17.0312 k = 0.1226 0.5000 0.1226 ( 3888 PWs) bands (ev): -67.0822 -67.0822 -67.0798 -67.0798 -67.0774 -67.0774 -34.0508 -34.0508 -34.0432 -34.0432 -34.0358 -34.0358 -33.7984 -33.7984 -33.7892 -33.7892 -33.7832 -33.7832 -33.6957 -33.6957 -33.6813 -33.6813 -33.6699 -33.6699 -17.0789 -17.0789 -16.9833 -16.9833 -16.8221 -16.8221 -5.1368 -5.1368 0.5780 0.5780 0.6371 0.6371 0.7405 0.7405 0.9198 0.9198 1.0830 1.0830 1.3262 1.3262 1.5459 1.5459 2.3079 2.3079 2.3856 2.3856 5.1357 5.1357 5.7623 5.7623 5.9681 5.9681 13.2401 13.2401 13.5203 13.5203 15.7925 15.7925 16.6754 16.6754 16.8522 16.8522 16.9966 16.9966 k = 0.1132 0.5000 0.1132 ( 3886 PWs) bands (ev): -67.0822 -67.0822 -67.0798 -67.0798 -67.0773 -67.0773 -34.0509 -34.0509 -34.0430 -34.0430 -34.0358 -34.0358 -33.7977 -33.7977 -33.7895 -33.7895 -33.7835 -33.7835 -33.6951 -33.6951 -33.6816 -33.6816 -33.6700 -33.6700 -17.0826 -17.0826 -16.9849 -16.9849 -16.8200 -16.8200 -5.1411 -5.1411 0.6099 0.6099 0.6583 0.6583 0.7561 0.7561 0.9010 0.9010 1.0644 1.0644 1.3062 1.3062 1.5801 1.5801 2.3031 2.3031 2.3743 2.3743 5.1125 5.1125 5.7860 5.7860 5.9675 5.9675 13.1954 13.1954 13.5170 13.5170 15.8734 15.8734 16.6434 16.6434 16.8891 16.8891 16.9636 16.9636 k = 0.1038 0.5000 0.1038 ( 3892 PWs) bands (ev): -67.0823 -67.0823 -67.0798 -67.0798 -67.0773 -67.0773 -34.0509 -34.0509 -34.0428 -34.0428 -34.0358 -34.0358 -33.7970 -33.7970 -33.7897 -33.7897 -33.7839 -33.7839 -33.6946 -33.6946 -33.6819 -33.6819 -33.6703 -33.6703 -17.0861 -17.0861 -16.9864 -16.9864 -16.8179 -16.8179 -5.1451 -5.1451 0.6413 0.6413 0.6783 0.6783 0.7706 0.7706 0.8836 0.8836 1.0467 1.0467 1.2855 1.2855 1.6129 1.6129 2.2985 2.2985 2.3632 2.3632 5.0906 5.0906 5.8093 5.8093 5.9668 5.9668 13.1523 13.1523 13.5135 13.5135 15.9514 15.9514 16.6130 16.6130 16.9204 16.9204 16.9324 16.9324 k = 0.0943 0.5000 0.0943 ( 3892 PWs) bands (ev): -67.0823 -67.0823 -67.0798 -67.0798 -67.0772 -67.0772 -34.0509 -34.0509 -34.0426 -34.0426 -34.0358 -34.0358 -33.7964 -33.7964 -33.7899 -33.7899 -33.7843 -33.7843 -33.6940 -33.6940 -33.6822 -33.6822 -33.6704 -33.6704 -17.0893 -17.0893 -16.9878 -16.9878 -16.8160 -16.8160 -5.1486 -5.1486 0.6717 0.6717 0.6976 0.6976 0.7840 0.7840 0.8676 0.8676 1.0297 1.0297 1.2643 1.2643 1.6443 1.6443 2.2942 2.2942 2.3525 2.3525 5.0701 5.0701 5.8321 5.8321 5.9662 5.9662 13.1115 13.1115 13.5102 13.5102 16.0260 16.0260 16.5846 16.5846 16.9027 16.9027 16.9473 16.9473 k = 0.0849 0.5000 0.0849 ( 3884 PWs) bands (ev): -67.0824 -67.0824 -67.0798 -67.0798 -67.0772 -67.0772 -34.0509 -34.0509 -34.0424 -34.0424 -34.0358 -34.0358 -33.7958 -33.7958 -33.7901 -33.7901 -33.7847 -33.7847 -33.6935 -33.6935 -33.6824 -33.6824 -33.6706 -33.6706 -17.0922 -17.0922 -16.9891 -16.9891 -16.8142 -16.8142 -5.1518 -5.1518 0.6994 0.6994 0.7176 0.7176 0.7966 0.7966 0.8531 0.8531 1.0137 1.0137 1.2425 1.2425 1.6741 1.6741 2.2902 2.2902 2.3422 2.3422 5.0511 5.0511 5.8540 5.8540 5.9656 5.9656 13.0733 13.0733 13.5069 13.5069 16.0965 16.0965 16.5583 16.5583 16.8755 16.8755 16.9693 16.9693 k = 0.0755 0.5000 0.0755 ( 3884 PWs) bands (ev): -67.0824 -67.0824 -67.0798 -67.0798 -67.0771 -67.0771 -34.0509 -34.0509 -34.0423 -34.0423 -34.0358 -34.0358 -33.7952 -33.7952 -33.7902 -33.7902 -33.7851 -33.7851 -33.6931 -33.6931 -33.6827 -33.6827 -33.6708 -33.6708 -17.0949 -17.0949 -16.9903 -16.9903 -16.8127 -16.8127 -5.1546 -5.1546 0.7207 0.7207 0.7419 0.7419 0.8080 0.8080 0.8403 0.8403 0.9986 0.9986 1.2203 1.2203 1.7018 1.7018 2.2863 2.2863 2.3325 2.3325 5.0337 5.0337 5.8747 5.8747 5.9651 5.9651 13.0380 13.0380 13.5038 13.5038 16.1624 16.1624 16.5343 16.5343 16.8506 16.8506 16.9871 16.9871 k = 0.0660 0.5000 0.0660 ( 3876 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0771 -67.0771 -34.0509 -34.0509 -34.0421 -34.0421 -34.0358 -34.0358 -33.7946 -33.7946 -33.7903 -33.7903 -33.7855 -33.7855 -33.6927 -33.6927 -33.6828 -33.6828 -33.6709 -33.6709 -17.0972 -17.0972 -16.9913 -16.9913 -16.8112 -16.8112 -5.1571 -5.1571 0.7361 0.7361 0.7694 0.7694 0.8177 0.8177 0.8304 0.8304 0.9845 0.9845 1.1977 1.1977 1.7274 1.7274 2.2826 2.2826 2.3236 2.3236 5.0181 5.0181 5.8938 5.8938 5.9646 5.9646 13.0059 13.0059 13.5010 13.5010 16.2230 16.2230 16.5128 16.5128 16.8282 16.8282 17.0013 17.0013 k = 0.0566 0.5000 0.0566 ( 3872 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0420 -34.0420 -34.0358 -34.0358 -33.7941 -33.7941 -33.7903 -33.7903 -33.7859 -33.7859 -33.6923 -33.6923 -33.6830 -33.6830 -33.6711 -33.6711 -17.0993 -17.0993 -16.9922 -16.9922 -16.8100 -16.8100 -5.1592 -5.1592 0.7483 0.7483 0.7957 0.7957 0.8186 0.8186 0.8319 0.8319 0.9715 0.9715 1.1748 1.1748 1.7504 1.7504 2.2789 2.2789 2.3157 2.3157 5.0043 5.0043 5.9110 5.9110 5.9643 5.9643 12.9774 12.9774 13.4984 13.4984 16.2775 16.2775 16.4939 16.4939 16.8085 16.8085 17.0124 17.0124 k = 0.0472 0.5000 0.0472 ( 3872 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0419 -34.0419 -34.0358 -34.0358 -33.7937 -33.7937 -33.7903 -33.7903 -33.7864 -33.7864 -33.6920 -33.6920 -33.6831 -33.6831 -33.6712 -33.6712 -17.1011 -17.1011 -16.9930 -16.9930 -16.8090 -16.8090 -5.1609 -5.1609 0.7580 0.7580 0.8053 0.8053 0.8284 0.8284 0.8416 0.8416 0.9597 0.9597 1.1520 1.1520 1.7707 1.7707 2.2752 2.2752 2.3090 2.3090 4.9924 4.9924 5.9259 5.9259 5.9641 5.9641 12.9527 12.9527 13.4962 13.4962 16.3251 16.3251 16.4777 16.4777 16.7917 16.7917 17.0209 17.0209 k = 0.0377 0.5000 0.0377 ( 3876 PWs) bands (ev): -67.0825 -67.0825 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0418 -34.0418 -34.0359 -34.0359 -33.7934 -33.7934 -33.7901 -33.7901 -33.7868 -33.7868 -33.6918 -33.6918 -33.6832 -33.6832 -33.6713 -33.6713 -17.1025 -17.1025 -16.9936 -16.9936 -16.8081 -16.8081 -5.1624 -5.1624 0.7654 0.7654 0.8012 0.8012 0.8451 0.8451 0.8578 0.8578 0.9494 0.9494 1.1296 1.1296 1.7878 1.7878 2.2716 2.2716 2.3036 2.3036 4.9826 4.9826 5.9383 5.9383 5.9641 5.9641 12.9322 12.9322 13.4943 13.4943 16.3653 16.3653 16.4643 16.4643 16.7777 16.7777 17.0271 17.0271 k = 0.0283 0.5000 0.0283 ( 3884 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0418 -34.0418 -34.0359 -34.0359 -33.7932 -33.7932 -33.7899 -33.7899 -33.7873 -33.7873 -33.6916 -33.6916 -33.6833 -33.6833 -33.6714 -33.6714 -17.1037 -17.1037 -16.9941 -16.9941 -16.8074 -16.8074 -5.1635 -5.1635 0.7701 0.7701 0.7979 0.7979 0.8542 0.8542 0.8793 0.8793 0.9411 0.9411 1.1083 1.1083 1.8015 1.8015 2.2683 2.2683 2.2995 2.2995 4.9748 4.9748 5.9477 5.9477 5.9644 5.9644 12.9160 12.9160 13.4927 13.4927 16.3972 16.3972 16.4539 16.4539 16.7668 16.7668 17.0316 17.0316 k = 0.0189 0.5000 0.0189 ( 3876 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0770 -67.0770 -34.0509 -34.0509 -34.0417 -34.0417 -34.0359 -34.0359 -33.7930 -33.7930 -33.7896 -33.7896 -33.7877 -33.7877 -33.6915 -33.6915 -33.6834 -33.6834 -33.6715 -33.6715 -17.1045 -17.1045 -16.9944 -16.9944 -16.8069 -16.8069 -5.1643 -5.1643 0.7724 0.7724 0.7965 0.7965 0.8610 0.8610 0.8969 0.8969 0.9365 0.9365 1.0896 1.0896 1.8116 1.8116 2.2657 2.2657 2.2968 2.2968 4.9693 4.9693 5.9539 5.9539 5.9653 5.9653 12.9043 12.9043 13.4916 13.4916 16.4202 16.4202 16.4467 16.4467 16.7589 16.7589 17.0345 17.0345 k = 0.0094 0.5000 0.0094 ( 3868 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0769 -67.0769 -34.0508 -34.0508 -34.0417 -34.0417 -34.0359 -34.0359 -33.7929 -33.7929 -33.7893 -33.7893 -33.7880 -33.7880 -33.6913 -33.6913 -33.6834 -33.6834 -33.6715 -33.6715 -17.1050 -17.1050 -16.9946 -16.9946 -16.8066 -16.8066 -5.1648 -5.1648 0.7732 0.7732 0.7963 0.7963 0.8657 0.8657 0.9058 0.9058 0.9373 0.9373 1.0759 1.0759 1.8177 1.8177 2.2640 2.2640 2.2952 2.2952 4.9659 4.9659 5.9569 5.9569 5.9667 5.9667 12.8972 12.8972 13.4910 13.4910 16.4329 16.4329 16.4437 16.4437 16.7542 16.7542 17.0362 17.0362 k = 0.0000 0.5000-0.0000 ( 3868 PWs) bands (ev): -67.0826 -67.0826 -67.0798 -67.0798 -67.0769 -67.0769 -34.0508 -34.0508 -34.0416 -34.0416 -34.0359 -34.0359 -33.7929 -33.7929 -33.7891 -33.7891 -33.7882 -33.7882 -33.6913 -33.6913 -33.6834 -33.6834 -33.6715 -33.6715 -17.1051 -17.1051 -16.9947 -16.9947 -16.8065 -16.8065 -5.1649 -5.1649 0.7733 0.7733 0.7963 0.7963 0.8674 0.8674 0.9076 0.9076 0.9392 0.9392 1.0707 1.0707 1.8198 1.8198 2.2634 2.2634 2.2947 2.2947 4.9648 4.9648 5.9577 5.9577 5.9674 5.9674 12.8949 12.8949 13.4907 13.4907 16.4355 16.4355 16.4443 16.4443 16.7526 16.7526 17.0368 17.0368 k = 0.5000 0.5000-0.0000 ( 3900 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0512 -34.0512 -34.0445 -34.0445 -34.0373 -34.0373 -33.8030 -33.8030 -33.7921 -33.7921 -33.7766 -33.7766 -33.7006 -33.7006 -33.6830 -33.6830 -33.6650 -33.6650 -16.9544 -16.9544 -16.9537 -16.9537 -16.9203 -16.9203 -5.0750 -5.0750 0.3818 0.3818 0.5390 0.5390 0.5692 0.5692 1.0263 1.0263 1.0290 1.0290 1.1715 1.1715 1.6703 1.6703 1.9764 1.9764 2.6800 2.6800 5.5516 5.5516 5.5527 5.5527 5.6160 5.6160 13.5000 13.5000 15.2613 15.2613 15.2667 15.2667 15.2715 15.2715 16.8673 16.8673 16.8674 16.8674 k = 0.5000 0.5000 0.0132 ( 3900 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0512 -34.0512 -34.0445 -34.0445 -34.0373 -34.0373 -33.8031 -33.8031 -33.7920 -33.7920 -33.7766 -33.7766 -33.7006 -33.7006 -33.6829 -33.6829 -33.6650 -33.6650 -16.9543 -16.9543 -16.9536 -16.9536 -16.9203 -16.9203 -5.0746 -5.0746 0.3807 0.3807 0.5358 0.5358 0.5657 0.5657 1.0292 1.0292 1.0322 1.0322 1.1697 1.1697 1.6703 1.6703 1.9785 1.9785 2.6800 2.6800 5.5523 5.5523 5.5534 5.5534 5.6167 5.6167 13.4997 13.4997 15.2603 15.2603 15.2620 15.2620 15.2652 15.2652 16.8720 16.8720 16.8720 16.8720 k = 0.5000 0.5000 0.0263 ( 3892 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0512 -34.0512 -34.0445 -34.0445 -34.0372 -34.0372 -33.8032 -33.8032 -33.7918 -33.7918 -33.7766 -33.7766 -33.7008 -33.7008 -33.6827 -33.6827 -33.6650 -33.6650 -16.9541 -16.9541 -16.9534 -16.9534 -16.9203 -16.9203 -5.0734 -5.0734 0.3773 0.3773 0.5263 0.5263 0.5556 0.5556 1.0375 1.0375 1.0416 1.0416 1.1642 1.1642 1.6703 1.6703 1.9847 1.9847 2.6800 2.6800 5.5543 5.5543 5.5555 5.5555 5.6188 5.6188 13.4989 13.4989 15.2417 15.2417 15.2466 15.2466 15.2640 15.2640 16.8859 16.8859 16.8859 16.8859 k = 0.5000 0.5000 0.0395 ( 3892 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0512 -34.0512 -34.0447 -34.0447 -34.0371 -34.0371 -33.8035 -33.8035 -33.7915 -33.7915 -33.7766 -33.7766 -33.7011 -33.7011 -33.6825 -33.6825 -33.6650 -33.6650 -16.9537 -16.9537 -16.9531 -16.9531 -16.9202 -16.9202 -5.0715 -5.0715 0.3717 0.3717 0.5112 0.5112 0.5395 0.5395 1.0505 1.0505 1.0561 1.0561 1.1553 1.1553 1.6703 1.6703 1.9948 1.9948 2.6800 2.6800 5.5577 5.5577 5.5589 5.5589 5.6222 5.6222 13.4976 13.4976 15.2115 15.2115 15.2164 15.2164 15.2673 15.2673 16.9080 16.9080 16.9081 16.9081 k = 0.5000 0.5000 0.0526 ( 3884 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0512 -34.0512 -34.0448 -34.0448 -34.0370 -34.0370 -33.8039 -33.8039 -33.7911 -33.7911 -33.7766 -33.7766 -33.7014 -33.7014 -33.6821 -33.6821 -33.6650 -33.6650 -16.9533 -16.9533 -16.9526 -16.9526 -16.9201 -16.9201 -5.0687 -5.0687 0.3640 0.3640 0.4914 0.4914 0.5186 0.5186 1.0670 1.0670 1.0750 1.0750 1.1439 1.1439 1.6702 1.6702 2.0085 2.0085 2.6800 2.6800 5.5625 5.5625 5.5637 5.5637 5.6270 5.6270 13.4958 13.4958 15.1709 15.1709 15.1758 15.1758 15.2720 15.2720 16.9373 16.9373 16.9375 16.9375 k = 0.5000 0.5000 0.0658 ( 3884 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0513 -34.0513 -34.0450 -34.0450 -34.0369 -34.0369 -33.8044 -33.8044 -33.7907 -33.7907 -33.7766 -33.7766 -33.7019 -33.7019 -33.6816 -33.6816 -33.6650 -33.6650 -16.9527 -16.9527 -16.9520 -16.9520 -16.9201 -16.9201 -5.0652 -5.0652 0.3540 0.3540 0.4678 0.4678 0.4939 0.4939 1.0844 1.0844 1.0972 1.0972 1.1319 1.1319 1.6701 1.6701 2.0253 2.0253 2.6799 2.6799 5.5685 5.5685 5.5698 5.5698 5.6331 5.6331 13.4935 13.4935 15.1214 15.1214 15.1263 15.1263 15.2779 15.2779 16.9725 16.9725 16.9728 16.9728 k = 0.5000 0.5000 0.0789 ( 3872 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0513 -34.0513 -34.0452 -34.0452 -34.0367 -34.0367 -33.8049 -33.8049 -33.7902 -33.7902 -33.7766 -33.7766 -33.7024 -33.7024 -33.6810 -33.6810 -33.6650 -33.6650 -16.9520 -16.9520 -16.9513 -16.9513 -16.9200 -16.9200 -5.0610 -5.0610 0.3420 0.3420 0.4413 0.4413 0.4664 0.4664 1.0925 1.0925 1.1219 1.1219 1.1292 1.1292 1.6701 1.6701 2.0451 2.0451 2.6799 2.6799 5.5759 5.5759 5.5772 5.5772 5.6405 5.6405 13.4907 13.4907 15.0643 15.0643 15.0693 15.0693 15.2851 15.2851 17.0124 17.0124 17.0127 17.0127 k = 0.5000 0.5000 0.0921 ( 3864 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0513 -34.0513 -34.0455 -34.0455 -34.0365 -34.0365 -33.8054 -33.8054 -33.7896 -33.7896 -33.7766 -33.7766 -33.7029 -33.7029 -33.6804 -33.6804 -33.6650 -33.6650 -16.9512 -16.9512 -16.9505 -16.9505 -16.9198 -16.9198 -5.0561 -5.0561 0.3281 0.3281 0.4126 0.4126 0.4367 0.4367 1.0805 1.0805 1.1460 1.1460 1.1481 1.1481 1.6700 1.6700 2.0670 2.0670 2.6799 2.6799 5.5844 5.5844 5.5858 5.5858 5.6491 5.6491 13.4874 13.4874 15.0009 15.0009 15.0060 15.0060 15.2934 15.2934 17.0555 17.0555 17.0559 17.0559 k = 0.5000 0.5000 0.1053 ( 3872 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0514 -34.0514 -34.0458 -34.0458 -34.0364 -34.0364 -33.8060 -33.8060 -33.7891 -33.7891 -33.7767 -33.7767 -33.7036 -33.7036 -33.6798 -33.6798 -33.6650 -33.6650 -16.9502 -16.9502 -16.9496 -16.9496 -16.9197 -16.9197 -5.0505 -5.0505 0.3122 0.3122 0.3823 0.3823 0.4055 0.4055 1.0608 1.0608 1.1699 1.1699 1.1753 1.1753 1.6699 1.6699 2.0909 2.0909 2.6798 2.6798 5.5942 5.5942 5.5957 5.5957 5.6587 5.6587 13.4836 13.4836 14.9326 14.9326 14.9377 14.9377 15.3029 15.3029 17.1006 17.1006 17.1012 17.1012 k = 0.5000 0.5000 0.1184 ( 3880 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0515 -34.0515 -34.0461 -34.0461 -34.0362 -34.0362 -33.8067 -33.8067 -33.7885 -33.7885 -33.7767 -33.7767 -33.7042 -33.7042 -33.6791 -33.6791 -33.6650 -33.6650 -16.9492 -16.9492 -16.9485 -16.9485 -16.9196 -16.9196 -5.0443 -5.0443 0.2946 0.2946 0.3508 0.3508 0.3732 0.3732 1.0384 1.0384 1.1957 1.1957 1.2030 1.2030 1.6698 1.6698 2.1163 2.1163 2.6797 2.6797 5.6051 5.6051 5.6066 5.6066 5.6694 5.6694 13.4792 13.4792 14.8603 14.8603 14.8655 14.8655 15.3134 15.3134 17.1472 17.1472 17.1479 17.1479 k = 0.5000 0.5000 0.1316 ( 3880 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0515 -34.0515 -34.0465 -34.0465 -34.0360 -34.0360 -33.8073 -33.8073 -33.7879 -33.7879 -33.7767 -33.7767 -33.7049 -33.7049 -33.6784 -33.6784 -33.6650 -33.6650 -16.9481 -16.9481 -16.9474 -16.9474 -16.9194 -16.9194 -5.0374 -5.0374 0.2753 0.2753 0.3186 0.3186 0.3404 0.3404 1.0146 1.0146 1.2223 1.2223 1.2310 1.2310 1.6697 1.6697 2.1430 2.1430 2.6797 2.6797 5.6170 5.6170 5.6187 5.6187 5.6809 5.6809 13.4744 13.4744 14.7852 14.7852 14.7905 14.7905 15.3249 15.3249 17.1943 17.1943 17.1951 17.1951 k = 0.5000 0.5000 0.1447 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0516 -34.0516 -34.0468 -34.0468 -34.0358 -34.0358 -33.8079 -33.8079 -33.7873 -33.7873 -33.7768 -33.7768 -33.7056 -33.7056 -33.6776 -33.6776 -33.6650 -33.6650 -16.9468 -16.9468 -16.9462 -16.9462 -16.9193 -16.9193 -5.0300 -5.0300 0.2545 0.2545 0.2860 0.2860 0.3074 0.3074 0.9900 0.9900 1.2491 1.2491 1.2590 1.2590 1.6697 1.6697 2.1705 2.1705 2.6796 2.6796 5.6300 5.6300 5.6317 5.6317 5.6934 5.6934 13.4693 13.4693 14.7081 14.7081 14.7135 14.7135 15.3375 15.3375 17.2413 17.2413 17.2422 17.2422 k = 0.5000 0.5000 0.1579 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0517 -34.0517 -34.0471 -34.0471 -34.0357 -34.0357 -33.8086 -33.8086 -33.7867 -33.7867 -33.7768 -33.7768 -33.7063 -33.7063 -33.6769 -33.6769 -33.6650 -33.6650 -16.9455 -16.9455 -16.9449 -16.9449 -16.9191 -16.9191 -5.0220 -5.0220 0.2322 0.2322 0.2532 0.2532 0.2743 0.2743 0.9648 0.9648 1.2758 1.2758 1.2867 1.2867 1.6696 1.6696 2.1987 2.1987 2.6795 2.6795 5.6439 5.6439 5.6457 5.6457 5.7065 5.7065 13.4638 13.4638 14.6296 14.6296 14.6351 14.6351 15.3508 15.3508 17.2877 17.2877 17.2887 17.2887 k = 0.5000 0.5000 0.1711 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0517 -34.0517 -34.0475 -34.0475 -34.0355 -34.0355 -33.8092 -33.8092 -33.7861 -33.7861 -33.7768 -33.7768 -33.7069 -33.7069 -33.6761 -33.6761 -33.6649 -33.6649 -16.9441 -16.9441 -16.9435 -16.9435 -16.9189 -16.9189 -5.0135 -5.0135 0.2086 0.2086 0.2204 0.2204 0.2415 0.2415 0.9393 0.9393 1.3022 1.3022 1.3140 1.3140 1.6695 1.6695 2.2272 2.2272 2.6794 2.6794 5.6586 5.6586 5.6605 5.6605 5.7203 5.7203 13.4578 13.4578 14.5504 14.5504 14.5559 14.5559 15.3648 15.3648 17.3331 17.3331 17.3342 17.3342 k = 0.5000 0.5000 0.1842 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0518 -34.0518 -34.0479 -34.0479 -34.0353 -34.0353 -33.8099 -33.8099 -33.7855 -33.7855 -33.7769 -33.7769 -33.7076 -33.7076 -33.6754 -33.6754 -33.6649 -33.6649 -16.9427 -16.9427 -16.9420 -16.9420 -16.9187 -16.9187 -5.0046 -5.0046 0.1836 0.1836 0.1878 0.1878 0.2094 0.2094 0.9138 0.9138 1.3281 1.3281 1.3407 1.3407 1.6694 1.6694 2.2559 2.2559 2.6793 2.6793 5.6741 5.6741 5.6761 5.6761 5.7346 5.7346 13.4515 13.4515 14.4710 14.4710 14.4766 14.4766 15.3795 15.3795 17.3188 17.3188 17.3773 17.3773 k = 0.5000 0.5000 0.1974 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0519 -34.0519 -34.0482 -34.0482 -34.0351 -34.0351 -33.8105 -33.8105 -33.7849 -33.7849 -33.7769 -33.7769 -33.7083 -33.7083 -33.6746 -33.6746 -33.6649 -33.6649 -16.9412 -16.9412 -16.9405 -16.9405 -16.9185 -16.9185 -4.9953 -4.9953 0.1555 0.1555 0.1572 0.1572 0.1781 0.1781 0.8883 0.8883 1.3534 1.3534 1.3668 1.3668 1.6694 1.6694 2.2846 2.2846 2.6792 2.6792 5.6903 5.6903 5.6924 5.6924 5.7493 5.7493 13.4448 13.4448 14.3919 14.3919 14.3976 14.3976 15.3946 15.3946 17.2591 17.2591 17.4199 17.4199 k = 0.5000 0.5000 0.2105 ( 3876 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0797 -67.0797 -34.0520 -34.0520 -34.0486 -34.0486 -34.0350 -34.0350 -33.8111 -33.8111 -33.7843 -33.7843 -33.7769 -33.7769 -33.7090 -33.7090 -33.6739 -33.6739 -33.6649 -33.6649 -16.9397 -16.9397 -16.9390 -16.9390 -16.9183 -16.9183 -4.9856 -4.9856 0.1239 0.1239 0.1297 0.1297 0.1481 0.1481 0.8632 0.8632 1.3780 1.3780 1.3920 1.3920 1.6693 1.6693 2.3131 2.3131 2.6791 2.6791 5.7070 5.7070 5.7092 5.7092 5.7644 5.7644 13.4379 13.4379 14.3136 14.3136 14.3193 14.3193 15.4103 15.4103 17.2017 17.2017 17.4609 17.4610 k = 0.5000 0.5000 0.2237 ( 3864 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0521 -34.0521 -34.0489 -34.0489 -34.0348 -34.0348 -33.8117 -33.8117 -33.7838 -33.7838 -33.7769 -33.7769 -33.7096 -33.7096 -33.6732 -33.6732 -33.6649 -33.6649 -16.9381 -16.9381 -16.9374 -16.9374 -16.9181 -16.9181 -4.9757 -4.9757 0.0929 0.0929 0.1011 0.1011 0.1193 0.1193 0.8385 0.8385 1.4018 1.4018 1.4165 1.4165 1.6693 1.6693 2.3412 2.3412 2.6791 2.6791 5.7242 5.7242 5.7265 5.7265 5.7796 5.7796 13.4308 13.4308 14.2364 14.2364 14.2423 14.2423 15.4263 15.4263 17.1466 17.1466 17.5002 17.5002 k = 0.5000 0.5000 0.2368 ( 3848 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0522 -34.0522 -34.0493 -34.0493 -34.0346 -34.0346 -33.8123 -33.8123 -33.7832 -33.7832 -33.7770 -33.7770 -33.7102 -33.7102 -33.6724 -33.6724 -33.6649 -33.6649 -16.9365 -16.9365 -16.9358 -16.9358 -16.9178 -16.9178 -4.9656 -4.9656 0.0627 0.0627 0.0723 0.0723 0.0914 0.0914 0.8144 0.8144 1.4248 1.4248 1.4401 1.4401 1.6693 1.6693 2.3689 2.3689 2.6790 2.6790 5.7417 5.7417 5.7441 5.7441 5.7949 5.7949 13.4236 13.4236 14.1608 14.1608 14.1667 14.1667 15.4427 15.4427 17.0941 17.0941 17.5377 17.5380 k = 0.5000 0.5000 0.2500 ( 3848 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0522 -34.0522 -34.0496 -34.0496 -34.0345 -34.0345 -33.8129 -33.8129 -33.7827 -33.7827 -33.7770 -33.7770 -33.7109 -33.7109 -33.6718 -33.6718 -33.6648 -33.6648 -16.9349 -16.9349 -16.9342 -16.9342 -16.9176 -16.9176 -4.9553 -4.9553 0.0334 0.0334 0.0436 0.0436 0.0640 0.0640 0.7908 0.7908 1.4468 1.4468 1.4626 1.4626 1.6693 1.6693 2.3959 2.3959 2.6789 2.6789 5.7594 5.7594 5.7620 5.7620 5.8102 5.8102 13.4161 13.4161 14.0869 14.0869 14.0929 14.0929 15.4590 15.4590 17.0441 17.0441 17.5734 17.5734 k = 0.5000 0.5000 0.2632 ( 3856 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0524 -34.0524 -34.0500 -34.0500 -34.0344 -34.0344 -33.8134 -33.8134 -33.7822 -33.7822 -33.7771 -33.7771 -33.7115 -33.7115 -33.6711 -33.6711 -33.6648 -33.6648 -16.9332 -16.9332 -16.9326 -16.9326 -16.9174 -16.9174 -4.9450 -4.9450 0.0049 0.0049 0.0154 0.0154 0.0370 0.0370 0.7680 0.7680 1.4677 1.4677 1.4841 1.4841 1.6692 1.6692 2.4221 2.4221 2.6787 2.6787 5.7773 5.7773 5.7800 5.7800 5.8253 5.8253 13.4085 13.4085 14.0151 14.0151 14.0211 14.0211 15.4753 15.4753 16.9966 16.9966 17.6072 17.6072 k = 0.5000 0.5000 0.2763 ( 3864 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0525 -34.0525 -34.0503 -34.0503 -34.0343 -34.0343 -33.8140 -33.8140 -33.7817 -33.7817 -33.7771 -33.7771 -33.7120 -33.7120 -33.6705 -33.6705 -33.6649 -33.6649 -16.9317 -16.9317 -16.9310 -16.9310 -16.9172 -16.9172 -4.9346 -4.9346 -0.0225 -0.0225 -0.0119 -0.0119 0.0105 0.0105 0.7461 0.7461 1.4876 1.4876 1.5046 1.5046 1.6691 1.6691 2.4474 2.4474 2.6786 2.6786 5.7951 5.7951 5.7979 5.7979 5.8402 5.8402 13.4008 13.4008 13.9456 13.9456 13.9517 13.9517 15.4916 15.4916 16.9519 16.9519 17.6392 17.6396 k = 0.5000 0.5000 0.2895 ( 3860 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0525 -34.0525 -34.0506 -34.0506 -34.0341 -34.0341 -33.8145 -33.8145 -33.7812 -33.7812 -33.7771 -33.7771 -33.7126 -33.7126 -33.6699 -33.6699 -33.6648 -33.6648 -16.9301 -16.9301 -16.9294 -16.9294 -16.9170 -16.9170 -4.9243 -4.9243 -0.0486 -0.0486 -0.0383 -0.0383 -0.0153 -0.0153 0.7251 0.7251 1.5065 1.5065 1.5240 1.5240 1.6692 1.6692 2.4718 2.4718 2.6785 2.6785 5.8128 5.8128 5.8157 5.8157 5.8548 5.8548 13.3931 13.3931 13.8787 13.8787 13.8849 13.8849 15.5076 15.5076 16.9097 16.9097 17.6692 17.6692 k = 0.5000 0.5000 0.3026 ( 3852 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0526 -34.0526 -34.0509 -34.0509 -34.0340 -34.0340 -33.8149 -33.8149 -33.7808 -33.7808 -33.7772 -33.7772 -33.7131 -33.7131 -33.6693 -33.6693 -33.6648 -33.6648 -16.9285 -16.9285 -16.9279 -16.9279 -16.9167 -16.9167 -4.9142 -4.9142 -0.0736 -0.0736 -0.0635 -0.0635 -0.0405 -0.0405 0.7050 0.7050 1.5243 1.5243 1.5423 1.5423 1.6693 1.6693 2.4953 2.4953 2.6784 2.6784 5.8303 5.8303 5.8333 5.8333 5.8690 5.8690 13.3855 13.3855 13.8148 13.8148 13.8210 13.8210 15.5233 15.5233 16.8703 16.8703 17.6974 17.6974 k = 0.5000 0.5000 0.3158 ( 3868 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0527 -34.0527 -34.0512 -34.0512 -34.0339 -34.0339 -33.8154 -33.8154 -33.7804 -33.7804 -33.7772 -33.7772 -33.7136 -33.7136 -33.6687 -33.6687 -33.6648 -33.6648 -16.9270 -16.9270 -16.9264 -16.9264 -16.9165 -16.9165 -4.9043 -4.9043 -0.0973 -0.0973 -0.0875 -0.0875 -0.0648 -0.0648 0.6859 0.6859 1.5410 1.5410 1.5595 1.5595 1.6693 1.6693 2.5175 2.5175 2.6783 2.6783 5.8473 5.8473 5.8504 5.8504 5.8828 5.8828 13.3780 13.3780 13.7538 13.7538 13.7601 13.7601 15.5386 15.5386 16.8335 16.8335 17.7237 17.7238 k = 0.5000 0.5000 0.3289 ( 3868 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0528 -34.0528 -34.0515 -34.0515 -34.0338 -34.0338 -33.8159 -33.8159 -33.7800 -33.7800 -33.7773 -33.7773 -33.7141 -33.7141 -33.6682 -33.6682 -33.6648 -33.6648 -16.9256 -16.9256 -16.9249 -16.9249 -16.9163 -16.9163 -4.8946 -4.8946 -0.1196 -0.1196 -0.1103 -0.1103 -0.0882 -0.0882 0.6680 0.6680 1.5565 1.5565 1.5755 1.5755 1.6694 1.6694 2.5385 2.5385 2.6782 2.6782 5.8638 5.8638 5.8671 5.8671 5.8959 5.8959 13.3707 13.3707 13.6961 13.6961 13.7024 13.7024 15.5533 15.5533 16.7995 16.7995 17.7483 17.7483 k = 0.5000 0.5000 0.3421 ( 3876 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0529 -34.0529 -34.0518 -34.0518 -34.0338 -34.0338 -33.8163 -33.8163 -33.7797 -33.7797 -33.7773 -33.7773 -33.7145 -33.7145 -33.6677 -33.6677 -33.6648 -33.6648 -16.9242 -16.9242 -16.9235 -16.9235 -16.9162 -16.9162 -4.8854 -4.8854 -0.1405 -0.1405 -0.1317 -0.1317 -0.1103 -0.1103 0.6512 0.6512 1.5708 1.5708 1.5904 1.5904 1.6695 1.6695 2.5583 2.5583 2.6781 2.6781 5.8797 5.8797 5.8831 5.8831 5.9083 5.9083 13.3637 13.3637 13.6418 13.6418 13.6483 13.6483 15.5674 15.5674 16.7680 16.7680 17.7710 17.7712 k = 0.5000 0.5000 0.3553 ( 3868 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0530 -34.0530 -34.0520 -34.0520 -34.0337 -34.0337 -33.8166 -33.8166 -33.7793 -33.7793 -33.7773 -33.7773 -33.7149 -33.7149 -33.6673 -33.6673 -33.6648 -33.6648 -16.9229 -16.9229 -16.9222 -16.9222 -16.9160 -16.9160 -4.8765 -4.8765 -0.1599 -0.1599 -0.1518 -0.1518 -0.1311 -0.1311 0.6356 0.6356 1.5840 1.5840 1.6041 1.6041 1.6698 1.6698 2.5767 2.5767 2.6780 2.6780 5.8949 5.8949 5.8984 5.8984 5.9201 5.9201 13.3569 13.3569 13.5913 13.5913 13.5978 13.5978 15.5808 15.5808 16.7392 16.7392 17.7919 17.7919 k = 0.5000 0.5000 0.3684 ( 3876 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0531 -34.0531 -34.0523 -34.0523 -34.0336 -34.0336 -33.8170 -33.8170 -33.7790 -33.7790 -33.7774 -33.7774 -33.7153 -33.7153 -33.6669 -33.6669 -33.6648 -33.6648 -16.9216 -16.9216 -16.9210 -16.9210 -16.9158 -16.9158 -4.8681 -4.8681 -0.1778 -0.1778 -0.1704 -0.1704 -0.1505 -0.1505 0.6212 0.6212 1.5959 1.5959 1.6166 1.6166 1.6700 1.6700 2.5937 2.5937 2.6779 2.6779 5.9091 5.9091 5.9127 5.9127 5.9311 5.9311 13.3506 13.3506 13.5445 13.5445 13.5511 13.5511 15.5933 15.5933 16.7131 16.7131 17.8109 17.8109 k = 0.5000 0.5000 0.3816 ( 3880 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0531 -34.0531 -34.0525 -34.0525 -34.0335 -34.0335 -33.8173 -33.8173 -33.7787 -33.7787 -33.7774 -33.7774 -33.7156 -33.7156 -33.6665 -33.6665 -33.6648 -33.6648 -16.9205 -16.9205 -16.9199 -16.9199 -16.9156 -16.9156 -4.8604 -4.8604 -0.1942 -0.1942 -0.1876 -0.1876 -0.1683 -0.1683 0.6081 0.6081 1.6066 1.6066 1.6280 1.6280 1.6704 1.6704 2.6093 2.6093 2.6778 2.6778 5.9224 5.9224 5.9261 5.9261 5.9412 5.9412 13.3446 13.3446 13.5017 13.5017 13.5083 13.5083 15.6049 15.6049 16.6895 16.6895 17.8282 17.8285 k = 0.5000 0.5000 0.3947 ( 3884 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0532 -34.0532 -34.0527 -34.0527 -34.0335 -34.0335 -33.8176 -33.8176 -33.7785 -33.7785 -33.7774 -33.7774 -33.7159 -33.7159 -33.6661 -33.6661 -33.6648 -33.6648 -16.9195 -16.9195 -16.9188 -16.9188 -16.9155 -16.9155 -4.8532 -4.8532 -0.2090 -0.2090 -0.2033 -0.2033 -0.1844 -0.1844 0.5963 0.5963 1.6160 1.6160 1.6382 1.6382 1.6709 1.6709 2.6233 2.6233 2.6777 2.6777 5.9346 5.9346 5.9384 5.9384 5.9504 5.9504 13.3391 13.3391 13.4630 13.4630 13.4696 13.4696 15.6155 15.6155 16.6685 16.6685 17.8436 17.8437 k = 0.5000 0.5000 0.4079 ( 3876 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0533 -34.0533 -34.0529 -34.0529 -34.0334 -34.0334 -33.8179 -33.8179 -33.7783 -33.7783 -33.7774 -33.7774 -33.7162 -33.7162 -33.6658 -33.6658 -33.6648 -33.6648 -16.9185 -16.9185 -16.9179 -16.9179 -16.9153 -16.9153 -4.8467 -4.8467 -0.2221 -0.2221 -0.2173 -0.2173 -0.1987 -0.1987 0.5858 0.5858 1.6242 1.6242 1.6472 1.6472 1.6715 1.6715 2.6359 2.6359 2.6777 2.6777 5.9455 5.9455 5.9495 5.9495 5.9587 5.9587 13.3341 13.3341 13.4285 13.4285 13.4353 13.4353 15.6251 15.6251 16.6500 16.6500 17.8572 17.8572 k = 0.5000 0.5000 0.4211 ( 3876 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0533 -34.0533 -34.0530 -34.0530 -34.0334 -34.0334 -33.8181 -33.8181 -33.7781 -33.7781 -33.7775 -33.7775 -33.7164 -33.7164 -33.6655 -33.6655 -33.6648 -33.6648 -16.9177 -16.9177 -16.9171 -16.9171 -16.9152 -16.9152 -4.8410 -4.8410 -0.2335 -0.2335 -0.2297 -0.2297 -0.2112 -0.2112 0.5767 0.5767 1.6310 1.6310 1.6550 1.6550 1.6723 1.6723 2.6468 2.6468 2.6776 2.6776 5.9552 5.9552 5.9594 5.9594 5.9660 5.9660 13.3296 13.3296 13.3984 13.3984 13.4053 13.4053 15.6336 15.6336 16.6341 16.6341 17.8691 17.8693 k = 0.5000 0.5000 0.4342 ( 3876 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0533 -34.0533 -34.0531 -34.0531 -34.0333 -34.0333 -33.8183 -33.8183 -33.7779 -33.7779 -33.7775 -33.7775 -33.7166 -33.7166 -33.6653 -33.6653 -33.6648 -33.6648 -16.9170 -16.9170 -16.9165 -16.9165 -16.9150 -16.9150 -4.8361 -4.8361 -0.2432 -0.2432 -0.2404 -0.2404 -0.2218 -0.2218 0.5689 0.5689 1.6366 1.6366 1.6616 1.6616 1.6732 1.6732 2.6561 2.6561 2.6776 2.6776 5.9634 5.9634 5.9678 5.9678 5.9723 5.9723 13.3257 13.3257 13.3728 13.3728 13.3798 13.3798 15.6408 15.6408 16.6206 16.6206 17.8791 17.8791 k = 0.5000 0.5000 0.4474 ( 3876 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0532 -34.0532 -34.0333 -34.0333 -33.8184 -33.8184 -33.7778 -33.7778 -33.7775 -33.7775 -33.7168 -33.7168 -33.6651 -33.6651 -33.6648 -33.6648 -16.9164 -16.9164 -16.9160 -16.9160 -16.9149 -16.9149 -4.8320 -4.8320 -0.2512 -0.2512 -0.2493 -0.2493 -0.2304 -0.2304 0.5625 0.5625 1.6409 1.6409 1.6670 1.6670 1.6741 1.6741 2.6638 2.6638 2.6775 2.6775 5.9702 5.9702 5.9748 5.9748 5.9776 5.9776 13.3224 13.3224 13.3517 13.3517 13.3589 13.3589 15.6468 15.6468 16.6097 16.6097 17.8873 17.8873 k = 0.5000 0.5000 0.4605 ( 3876 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0534 -34.0534 -34.0533 -34.0533 -34.0333 -34.0333 -33.8185 -33.8185 -33.7777 -33.7777 -33.7775 -33.7775 -33.7169 -33.7169 -33.6650 -33.6650 -33.6648 -33.6648 -16.9159 -16.9159 -16.9156 -16.9156 -16.9147 -16.9147 -4.8288 -4.8288 -0.2574 -0.2574 -0.2563 -0.2563 -0.2371 -0.2371 0.5576 0.5576 1.6440 1.6440 1.6712 1.6712 1.6751 1.6751 2.6698 2.6698 2.6775 2.6775 5.9755 5.9755 5.9803 5.9803 5.9819 5.9819 13.3195 13.3195 13.3352 13.3352 13.3428 13.3428 15.6515 15.6515 16.6011 16.6011 17.8937 17.8937 k = 0.5000 0.5000 0.4737 ( 3892 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0535 -34.0535 -34.0534 -34.0534 -34.0333 -34.0333 -33.8187 -33.8187 -33.7776 -33.7776 -33.7775 -33.7775 -33.7170 -33.7170 -33.6649 -33.6649 -33.6648 -33.6648 -16.9156 -16.9156 -16.9155 -16.9155 -16.9145 -16.9145 -4.8265 -4.8265 -0.2619 -0.2619 -0.2614 -0.2614 -0.2420 -0.2420 0.5539 0.5539 1.6461 1.6461 1.6742 1.6742 1.6758 1.6758 2.6740 2.6740 2.6774 2.6774 5.9791 5.9791 5.9843 5.9843 5.9849 5.9849 13.3169 13.3169 13.3233 13.3233 13.3317 13.3317 15.6548 15.6548 16.5951 16.5951 17.8982 17.8982 k = 0.5000 0.5000 0.4868 ( 3892 PWs) bands (ev): -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -67.0797 -34.0535 -34.0535 -34.0535 -34.0535 -34.0333 -34.0333 -33.8187 -33.8187 -33.7776 -33.7776 -33.7775 -33.7775 -33.7171 -33.7171 -33.6648 -33.6648 -33.6648 -33.6648 -16.9154 -16.9154 -16.9154 -16.9154 -16.9144 -16.9144 -4.8251 -4.8251 -0.2645 -0.2645 -0.2645 -0.2645 -0.2449 -0.2449 0.5518 0.5518 1.6473 1.6473 1.6760 1.6760 1.6764 1.6764 2.6766 2.6766 2.6774 2.6774 5.9813 5.9813 5.9867 5.9867 5.9869 5.9869 13.3147 13.3147 13.3162 13.3162 13.3256 13.3256 15.6569 15.6569 16.5914 16.5914 17.9009 17.9010 k = 0.5000 0.5000 0.5000 ( 3912 PWs) bands (ev): -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -67.0798 -34.0535 -34.0535 -34.0535 -34.0535 -34.0333 -34.0333 -33.8188 -33.8188 -33.7776 -33.7776 -33.7776 -33.7776 -33.7171 -33.7171 -33.6648 -33.6648 -33.6648 -33.6648 -16.9153 -16.9153 -16.9153 -16.9153 -16.9143 -16.9143 -4.8246 -4.8246 -0.2655 -0.2655 -0.2655 -0.2655 -0.2459 -0.2459 0.5510 0.5510 1.6477 1.6477 1.6765 1.6765 1.6765 1.6765 2.6774 2.6774 2.6774 2.6774 5.9820 5.9820 5.9875 5.9875 5.9875 5.9875 13.3137 13.3137 13.3137 13.3137 13.3237 13.3237 15.6575 15.6575 16.5902 16.5902 17.9018 17.9018 Writing output data file Mg3NF3.save init_run : 0.13s CPU 0.22s WALL ( 1 calls) electrons : 142.50s CPU 145.21s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 142.49s CPU 145.19s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.01s CPU 0.02s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.04s WALL ( 291 calls) cegterg : 133.14s CPU 134.94s WALL ( 361 calls) Called by sum_band: Called by *egterg: h_psi : 63.57s CPU 65.05s WALL ( 6152 calls) s_psi : 1.93s CPU 1.90s WALL ( 6152 calls) g_psi : 0.24s CPU 0.18s WALL ( 5500 calls) cdiaghg : 59.71s CPU 60.12s WALL ( 5791 calls) cegterg:over : 5.84s CPU 5.82s WALL ( 5500 calls) cegterg:upda : 4.73s CPU 5.02s WALL ( 5500 calls) cegterg:last : 2.78s CPU 2.76s WALL ( 899 calls) cdiaghg:chol : 3.44s CPU 3.40s WALL ( 5791 calls) cdiaghg:inve : 2.40s CPU 2.44s WALL ( 5791 calls) cdiaghg:para : 4.32s CPU 4.32s WALL ( 11582 calls) Called by h_psi: h_psi:vloc : 57.91s CPU 59.26s WALL ( 6152 calls) h_psi:vnl : 5.45s CPU 5.58s WALL ( 6152 calls) add_vuspsi : 2.11s CPU 2.17s WALL ( 6152 calls) General routines calbec : 3.32s CPU 3.39s WALL ( 6152 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 54.14s CPU 55.60s WALL ( 699860 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.13s CPU 0.33s WALL ( 582 calls) Parallel routines fft_scatter : 19.90s CPU 20.41s WALL ( 699883 calls) PWSCF : 2m39.39s CPU 2m55.61s WALL This run was terminated on: 17:51:14 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=