Program PWSCF v.5.1.1 starts on 28Oct2015 at 6:19:41 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./Sr4S3O.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 66 38 11 2844 1247 187 Max 67 39 12 2851 1265 193 Sum 3205 1869 529 136675 60269 9171 bravais-lattice index = 14 lattice parameter (alat) = 11.1551 a.u. unit-cell volume = 1388.0812 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.155053 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 S read from file: /home/autes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 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 Sr read from file: /home/autes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 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 1221 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) O 6.00 15.99940 O( 1.00) Sr 10.00 87.62000 Sr( 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: E 1 3C2 -3C2 2 -2 4 -4 3 -3 6C2'-6C2' 5 -5 6 -6 14 -13 -14 13 -10 -9 10 9 6C4 7 8 15 16 12 11 8C3 17 19 20 18 24 21 22 23 i 25 3s_h-3s_h 26 -26 28 -28 27 -27 6s_d-6s_d 29 -29 30 -30 38 -37 -38 37 -34 -33 34 33 6S4 31 32 39 40 36 35 8S6 41 43 44 42 48 45 46 47 -E -1 -6C4 -7 -8 -15 -16 -12 -11 -8C3 -17 -19 -20 -18 -24 -21 -22 -23 -i -25 -6S4 -31 -32 -39 -40 -36 -35 -8S6 -41 -43 -44 -42 -48 -45 -46 -47 Cartesian axes number of k points= 210 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0185185 -0.0000000), wk = 0.0047619 k( 3) = ( 0.0000000 0.0370370 -0.0000000), wk = 0.0047619 k( 4) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0047619 k( 5) = ( 0.0000000 0.0740741 -0.0000000), wk = 0.0047619 k( 6) = ( 0.0000000 0.0925926 -0.0000000), wk = 0.0047619 k( 7) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0047619 k( 8) = ( 0.0000000 0.1296296 -0.0000000), wk = 0.0047619 k( 9) = ( 0.0000000 0.1481482 -0.0000000), wk = 0.0047619 k( 10) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0047619 k( 11) = ( 0.0000000 0.1851852 -0.0000000), wk = 0.0047619 k( 12) = ( 0.0000000 0.2037037 -0.0000000), wk = 0.0047619 k( 13) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0047619 k( 14) = ( 0.0000000 0.2407407 -0.0000000), wk = 0.0047619 k( 15) = ( 0.0000000 0.2592593 -0.0000000), wk = 0.0047619 k( 16) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0047619 k( 17) = ( 0.0000000 0.2962963 -0.0000000), wk = 0.0047619 k( 18) = ( 0.0000000 0.3148148 -0.0000000), wk = 0.0047619 k( 19) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0047619 k( 20) = ( 0.0000000 0.3518519 -0.0000000), wk = 0.0047619 k( 21) = ( 0.0000000 0.3703704 -0.0000000), wk = 0.0047619 k( 22) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0047619 k( 23) = ( 0.0000000 0.4074074 -0.0000000), wk = 0.0047619 k( 24) = ( 0.0000000 0.4259259 -0.0000000), wk = 0.0047619 k( 25) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0047619 k( 26) = ( 0.0000000 0.4629630 -0.0000000), wk = 0.0047619 k( 27) = ( 0.0000000 0.4814815 -0.0000000), wk = 0.0047619 k( 28) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 30) = ( 0.0185185 0.5000000 -0.0000000), wk = 0.0047619 k( 31) = ( 0.0370370 0.5000000 -0.0000000), wk = 0.0047619 k( 32) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0047619 k( 33) = ( 0.0740741 0.5000000 -0.0000000), wk = 0.0047619 k( 34) = ( 0.0925926 0.5000000 -0.0000000), wk = 0.0047619 k( 35) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0047619 k( 36) = ( 0.1296296 0.5000000 -0.0000000), wk = 0.0047619 k( 37) = ( 0.1481482 0.5000000 -0.0000000), wk = 0.0047619 k( 38) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0047619 k( 39) = ( 0.1851852 0.5000000 -0.0000000), wk = 0.0047619 k( 40) = ( 0.2037037 0.5000000 -0.0000000), wk = 0.0047619 k( 41) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0047619 k( 42) = ( 0.2407407 0.5000000 -0.0000000), wk = 0.0047619 k( 43) = ( 0.2592593 0.5000000 -0.0000000), wk = 0.0047619 k( 44) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0047619 k( 45) = ( 0.2962963 0.5000000 -0.0000000), wk = 0.0047619 k( 46) = ( 0.3148148 0.5000000 -0.0000000), wk = 0.0047619 k( 47) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0047619 k( 48) = ( 0.3518519 0.5000000 -0.0000000), wk = 0.0047619 k( 49) = ( 0.3703704 0.5000000 -0.0000000), wk = 0.0047619 k( 50) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0047619 k( 51) = ( 0.4074074 0.5000000 -0.0000000), wk = 0.0047619 k( 52) = ( 0.4259259 0.5000000 -0.0000000), wk = 0.0047619 k( 53) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0047619 k( 54) = ( 0.4629630 0.5000000 -0.0000000), wk = 0.0047619 k( 55) = ( 0.4814815 0.5000000 -0.0000000), wk = 0.0047619 k( 56) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 57) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 58) = ( 0.4868421 0.4868421 -0.0000000), wk = 0.0047619 k( 59) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0047619 k( 60) = ( 0.4605263 0.4605263 -0.0000000), wk = 0.0047619 k( 61) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0047619 k( 62) = ( 0.4342105 0.4342105 -0.0000000), wk = 0.0047619 k( 63) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0047619 k( 64) = ( 0.4078947 0.4078947 -0.0000000), wk = 0.0047619 k( 65) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0047619 k( 66) = ( 0.3815789 0.3815789 -0.0000000), wk = 0.0047619 k( 67) = ( 0.3684211 0.3684210 -0.0000000), wk = 0.0047619 k( 68) = ( 0.3552632 0.3552632 -0.0000000), wk = 0.0047619 k( 69) = ( 0.3421053 0.3421053 -0.0000000), wk = 0.0047619 k( 70) = ( 0.3289474 0.3289474 -0.0000000), wk = 0.0047619 k( 71) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0047619 k( 72) = ( 0.3026316 0.3026316 -0.0000000), wk = 0.0047619 k( 73) = ( 0.2894737 0.2894737 -0.0000000), wk = 0.0047619 k( 74) = ( 0.2763158 0.2763158 -0.0000000), wk = 0.0047619 k( 75) = ( 0.2631579 0.2631579 -0.0000000), wk = 0.0047619 k( 76) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0047619 k( 77) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0047619 k( 78) = ( 0.2236842 0.2236842 -0.0000000), wk = 0.0047619 k( 79) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0047619 k( 80) = ( 0.1973684 0.1973684 -0.0000000), wk = 0.0047619 k( 81) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0047619 k( 82) = ( 0.1710526 0.1710526 -0.0000000), wk = 0.0047619 k( 83) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0047619 k( 84) = ( 0.1447368 0.1447368 -0.0000000), wk = 0.0047619 k( 85) = ( 0.1315790 0.1315790 -0.0000000), wk = 0.0047619 k( 86) = ( 0.1184210 0.1184210 -0.0000000), wk = 0.0047619 k( 87) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0047619 k( 88) = ( 0.0921053 0.0921053 -0.0000000), wk = 0.0047619 k( 89) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0047619 k( 90) = ( 0.0657895 0.0657895 -0.0000000), wk = 0.0047619 k( 91) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0047619 k( 92) = ( 0.0394737 0.0394737 -0.0000000), wk = 0.0047619 k( 93) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0047619 k( 94) = ( 0.0131579 0.0131579 -0.0000000), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0047619 k( 98) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0047619 k( 99) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0047619 k( 100) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0047619 k( 101) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0047619 k( 102) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0047619 k( 103) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0047619 k( 104) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0047619 k( 105) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0047619 k( 106) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0047619 k( 107) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0047619 k( 108) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0047619 k( 109) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0047619 k( 110) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0047619 k( 111) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0047619 k( 112) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0047619 k( 113) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0047619 k( 114) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0047619 k( 115) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0047619 k( 116) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0047619 k( 117) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0047619 k( 118) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0047619 k( 119) = ( 0.2446809 0.2446808 0.2446808), wk = 0.0047619 k( 120) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0047619 k( 121) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0047619 k( 122) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0047619 k( 123) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0047619 k( 124) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0047619 k( 125) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0047619 k( 126) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0047619 k( 127) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0047619 k( 128) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0047619 k( 129) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0047619 k( 130) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0047619 k( 131) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0047619 k( 132) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0047619 k( 133) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0047619 k( 134) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0047619 k( 135) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0047619 k( 136) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0047619 k( 137) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0047619 k( 138) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0047619 k( 139) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0047619 k( 140) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0047619 k( 141) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0047619 k( 142) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0047619 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 144) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 145) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047619 k( 146) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047619 k( 147) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047619 k( 148) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047619 k( 149) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047619 k( 150) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047619 k( 151) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047619 k( 152) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047619 k( 153) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047619 k( 154) = ( 0.3684211 0.5000000 0.3684210), wk = 0.0047619 k( 155) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047619 k( 156) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047619 k( 157) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047619 k( 158) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047619 k( 159) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047619 k( 160) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047619 k( 161) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047619 k( 162) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047619 k( 163) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047619 k( 164) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047619 k( 165) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047619 k( 166) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047619 k( 167) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047619 k( 168) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047619 k( 169) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047619 k( 170) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047619 k( 171) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047619 k( 172) = ( 0.1315790 0.5000000 0.1315789), wk = 0.0047619 k( 173) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047619 k( 174) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047619 k( 175) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047619 k( 176) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047619 k( 177) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047619 k( 178) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047619 k( 179) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047619 k( 180) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047619 k( 181) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047619 k( 182) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 183) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 184) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047619 k( 185) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047619 k( 186) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047619 k( 187) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047619 k( 188) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047619 k( 189) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047619 k( 190) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047619 k( 191) = ( 0.5000000 0.5000000 0.1481481), wk = 0.0047619 k( 192) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047619 k( 193) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047619 k( 194) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047619 k( 195) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047619 k( 196) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047619 k( 197) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047619 k( 198) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047619 k( 199) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047619 k( 200) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047619 k( 201) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047619 k( 202) = ( 0.5000000 0.5000000 0.3518518), wk = 0.0047619 k( 203) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047619 k( 204) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047619 k( 205) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047619 k( 206) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047619 k( 207) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047619 k( 208) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047619 k( 209) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047619 k( 210) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0185185 0.0000000), wk = 0.0047619 k( 3) = ( 0.0000000 0.0370370 0.0000000), wk = 0.0047619 k( 4) = ( 0.0000000 0.0555556 0.0000000), wk = 0.0047619 k( 5) = ( 0.0000000 0.0740741 0.0000000), wk = 0.0047619 k( 6) = ( 0.0000000 0.0925926 0.0000000), wk = 0.0047619 k( 7) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0047619 k( 8) = ( 0.0000000 0.1296296 0.0000000), wk = 0.0047619 k( 9) = ( 0.0000000 0.1481482 0.0000000), wk = 0.0047619 k( 10) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0047619 k( 11) = ( 0.0000000 0.1851852 0.0000000), wk = 0.0047619 k( 12) = ( 0.0000000 0.2037037 0.0000000), wk = 0.0047619 k( 13) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0047619 k( 14) = ( 0.0000000 0.2407407 0.0000000), wk = 0.0047619 k( 15) = ( 0.0000000 0.2592593 0.0000000), wk = 0.0047619 k( 16) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0047619 k( 17) = ( 0.0000000 0.2962963 0.0000000), wk = 0.0047619 k( 18) = ( 0.0000000 0.3148148 0.0000000), wk = 0.0047619 k( 19) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0047619 k( 20) = ( 0.0000000 0.3518519 0.0000000), wk = 0.0047619 k( 21) = ( 0.0000000 0.3703704 0.0000000), wk = 0.0047619 k( 22) = ( 0.0000000 0.3888889 0.0000000), wk = 0.0047619 k( 23) = ( 0.0000000 0.4074074 0.0000000), wk = 0.0047619 k( 24) = ( 0.0000000 0.4259259 0.0000000), wk = 0.0047619 k( 25) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0047619 k( 26) = ( 0.0000000 0.4629630 0.0000000), wk = 0.0047619 k( 27) = ( 0.0000000 0.4814815 0.0000000), wk = 0.0047619 k( 28) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 29) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 30) = ( 0.0185185 0.5000000 0.0000000), wk = 0.0047619 k( 31) = ( 0.0370370 0.5000000 0.0000000), wk = 0.0047619 k( 32) = ( 0.0555556 0.5000000 0.0000000), wk = 0.0047619 k( 33) = ( 0.0740741 0.5000000 0.0000000), wk = 0.0047619 k( 34) = ( 0.0925926 0.5000000 0.0000000), wk = 0.0047619 k( 35) = ( 0.1111111 0.5000000 0.0000000), wk = 0.0047619 k( 36) = ( 0.1296296 0.5000000 0.0000000), wk = 0.0047619 k( 37) = ( 0.1481482 0.5000000 0.0000000), wk = 0.0047619 k( 38) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0047619 k( 39) = ( 0.1851852 0.5000000 0.0000000), wk = 0.0047619 k( 40) = ( 0.2037037 0.5000000 0.0000000), wk = 0.0047619 k( 41) = ( 0.2222222 0.5000000 0.0000000), wk = 0.0047619 k( 42) = ( 0.2407407 0.5000000 0.0000000), wk = 0.0047619 k( 43) = ( 0.2592593 0.5000000 0.0000000), wk = 0.0047619 k( 44) = ( 0.2777778 0.5000000 0.0000000), wk = 0.0047619 k( 45) = ( 0.2962963 0.5000000 0.0000000), wk = 0.0047619 k( 46) = ( 0.3148148 0.5000000 -0.0000000), wk = 0.0047619 k( 47) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0047619 k( 48) = ( 0.3518519 0.5000000 0.0000000), wk = 0.0047619 k( 49) = ( 0.3703704 0.5000000 0.0000000), wk = 0.0047619 k( 50) = ( 0.3888889 0.5000000 0.0000000), wk = 0.0047619 k( 51) = ( 0.4074074 0.5000000 0.0000000), wk = 0.0047619 k( 52) = ( 0.4259259 0.5000000 0.0000000), wk = 0.0047619 k( 53) = ( 0.4444444 0.5000000 0.0000000), wk = 0.0047619 k( 54) = ( 0.4629630 0.5000000 0.0000000), wk = 0.0047619 k( 55) = ( 0.4814815 0.5000000 0.0000000), wk = 0.0047619 k( 56) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 57) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 58) = ( 0.4868421 0.4868421 0.0000000), wk = 0.0047619 k( 59) = ( 0.4736842 0.4736842 0.0000000), wk = 0.0047619 k( 60) = ( 0.4605263 0.4605263 0.0000000), wk = 0.0047619 k( 61) = ( 0.4473684 0.4473684 0.0000000), wk = 0.0047619 k( 62) = ( 0.4342105 0.4342105 0.0000000), wk = 0.0047619 k( 63) = ( 0.4210526 0.4210526 0.0000000), wk = 0.0047619 k( 64) = ( 0.4078947 0.4078947 0.0000000), wk = 0.0047619 k( 65) = ( 0.3947368 0.3947368 0.0000000), wk = 0.0047619 k( 66) = ( 0.3815789 0.3815789 0.0000000), wk = 0.0047619 k( 67) = ( 0.3684211 0.3684211 0.0000000), wk = 0.0047619 k( 68) = ( 0.3552632 0.3552632 0.0000000), wk = 0.0047619 k( 69) = ( 0.3421053 0.3421053 0.0000000), wk = 0.0047619 k( 70) = ( 0.3289474 0.3289474 0.0000000), wk = 0.0047619 k( 71) = ( 0.3157895 0.3157895 0.0000000), wk = 0.0047619 k( 72) = ( 0.3026316 0.3026316 0.0000000), wk = 0.0047619 k( 73) = ( 0.2894737 0.2894737 0.0000000), wk = 0.0047619 k( 74) = ( 0.2763158 0.2763158 0.0000000), wk = 0.0047619 k( 75) = ( 0.2631579 0.2631579 0.0000000), wk = 0.0047619 k( 76) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0047619 k( 77) = ( 0.2368421 0.2368421 0.0000000), wk = 0.0047619 k( 78) = ( 0.2236842 0.2236842 0.0000000), wk = 0.0047619 k( 79) = ( 0.2105263 0.2105263 0.0000000), wk = 0.0047619 k( 80) = ( 0.1973684 0.1973684 0.0000000), wk = 0.0047619 k( 81) = ( 0.1842105 0.1842105 0.0000000), wk = 0.0047619 k( 82) = ( 0.1710526 0.1710526 0.0000000), wk = 0.0047619 k( 83) = ( 0.1578947 0.1578947 0.0000000), wk = 0.0047619 k( 84) = ( 0.1447368 0.1447368 0.0000000), wk = 0.0047619 k( 85) = ( 0.1315790 0.1315790 0.0000000), wk = 0.0047619 k( 86) = ( 0.1184210 0.1184210 0.0000000), wk = 0.0047619 k( 87) = ( 0.1052632 0.1052632 0.0000000), wk = 0.0047619 k( 88) = ( 0.0921053 0.0921053 0.0000000), wk = 0.0047619 k( 89) = ( 0.0789474 0.0789474 0.0000000), wk = 0.0047619 k( 90) = ( 0.0657895 0.0657895 0.0000000), wk = 0.0047619 k( 91) = ( 0.0526316 0.0526316 0.0000000), wk = 0.0047619 k( 92) = ( 0.0394737 0.0394737 0.0000000), wk = 0.0047619 k( 93) = ( 0.0263158 0.0263158 0.0000000), wk = 0.0047619 k( 94) = ( 0.0131579 0.0131579 0.0000000), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0047619 k( 98) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0047619 k( 99) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0047619 k( 100) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0047619 k( 101) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0047619 k( 102) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0047619 k( 103) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0047619 k( 104) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0047619 k( 105) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0047619 k( 106) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0047619 k( 107) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0047619 k( 108) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0047619 k( 109) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0047619 k( 110) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0047619 k( 111) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0047619 k( 112) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0047619 k( 113) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0047619 k( 114) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0047619 k( 115) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0047619 k( 116) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0047619 k( 117) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0047619 k( 118) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0047619 k( 119) = ( 0.2446809 0.2446809 0.2446809), wk = 0.0047619 k( 120) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0047619 k( 121) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0047619 k( 122) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0047619 k( 123) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0047619 k( 124) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0047619 k( 125) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0047619 k( 126) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0047619 k( 127) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0047619 k( 128) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0047619 k( 129) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0047619 k( 130) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0047619 k( 131) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0047619 k( 132) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0047619 k( 133) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0047619 k( 134) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0047619 k( 135) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0047619 k( 136) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0047619 k( 137) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0047619 k( 138) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0047619 k( 139) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0047619 k( 140) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0047619 k( 141) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0047619 k( 142) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0047619 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 144) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 145) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047619 k( 146) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047619 k( 147) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047619 k( 148) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047619 k( 149) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047619 k( 150) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047619 k( 151) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047619 k( 152) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047619 k( 153) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047619 k( 154) = ( 0.3684211 0.5000000 0.3684211), wk = 0.0047619 k( 155) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047619 k( 156) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047619 k( 157) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047619 k( 158) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047619 k( 159) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047619 k( 160) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047619 k( 161) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047619 k( 162) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047619 k( 163) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047619 k( 164) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047619 k( 165) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047619 k( 166) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047619 k( 167) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047619 k( 168) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047619 k( 169) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047619 k( 170) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047619 k( 171) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047619 k( 172) = ( 0.1315790 0.5000000 0.1315790), wk = 0.0047619 k( 173) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047619 k( 174) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047619 k( 175) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047619 k( 176) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047619 k( 177) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047619 k( 178) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047619 k( 179) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047619 k( 180) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047619 k( 181) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047619 k( 182) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 183) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 184) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047619 k( 185) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047619 k( 186) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047619 k( 187) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047619 k( 188) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047619 k( 189) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047619 k( 190) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047619 k( 191) = ( 0.5000000 0.5000000 0.1481482), wk = 0.0047619 k( 192) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047619 k( 193) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047619 k( 194) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047619 k( 195) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047619 k( 196) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047619 k( 197) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047619 k( 198) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047619 k( 199) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047619 k( 200) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047619 k( 201) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047619 k( 202) = ( 0.5000000 0.5000000 0.3518519), wk = 0.0047619 k( 203) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047619 k( 204) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047619 k( 205) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047619 k( 206) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047619 k( 207) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047619 k( 208) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047619 k( 209) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047619 k( 210) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 Dense grid: 136675 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 60269 G-vectors FFT dimensions: ( 50, 50, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.36 Mb ( 312, 76) NL pseudopotentials 0.60 Mb ( 156, 252) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.02 Mb ( 2846) G-vector shells 0.00 Mb ( 631) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.45 Mb ( 312, 304) Each subspace H/S matrix 1.41 Mb ( 304, 304) Each matrix 0.58 Mb ( 252, 2, 76) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./Sr4S3O.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 48.7 secs Computing kpt #: 2 total cpu time spent up to now is 54.2 secs Computing kpt #: 3 total cpu time spent up to now is 61.7 secs Computing kpt #: 4 total cpu time spent up to now is 68.9 secs Computing kpt #: 5 total cpu time spent up to now is 76.4 secs Computing kpt #: 6 total cpu time spent up to now is 84.8 secs Computing kpt #: 7 total cpu time spent up to now is 94.4 secs Computing kpt #: 8 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 104.2 secs Computing kpt #: 9 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 114.1 secs Computing kpt #: 10 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 124.0 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 134.3 secs Computing kpt #: 12 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 144.2 secs Computing kpt #: 13 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 154.5 secs Computing kpt #: 14 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 164.7 secs Computing kpt #: 15 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 174.9 secs Computing kpt #: 16 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 185.2 secs Computing kpt #: 17 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 195.6 secs Computing kpt #: 18 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 205.8 secs Computing kpt #: 19 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 217.1 secs Computing kpt #: 20 total cpu time spent up to now is 223.7 secs Computing kpt #: 21 total cpu time spent up to now is 229.7 secs Computing kpt #: 22 total cpu time spent up to now is 235.1 secs Computing kpt #: 23 total cpu time spent up to now is 240.4 secs Computing kpt #: 24 total cpu time spent up to now is 245.7 secs Computing kpt #: 25 total cpu time spent up to now is 251.5 secs Computing kpt #: 26 total cpu time spent up to now is 257.3 secs Computing kpt #: 27 total cpu time spent up to now is 263.4 secs Computing kpt #: 28 total cpu time spent up to now is 269.9 secs Computing kpt #: 29 total cpu time spent up to now is 276.1 secs Computing kpt #: 30 total cpu time spent up to now is 282.4 secs Computing kpt #: 31 total cpu time spent up to now is 288.7 secs Computing kpt #: 32 total cpu time spent up to now is 296.2 secs Computing kpt #: 33 total cpu time spent up to now is 302.7 secs Computing kpt #: 34 total cpu time spent up to now is 310.3 secs Computing kpt #: 35 total cpu time spent up to now is 317.0 secs Computing kpt #: 36 total cpu time spent up to now is 324.5 secs Computing kpt #: 37 total cpu time spent up to now is 331.2 secs Computing kpt #: 38 total cpu time spent up to now is 338.0 secs Computing kpt #: 39 total cpu time spent up to now is 345.1 secs Computing kpt #: 40 total cpu time spent up to now is 352.8 secs Computing kpt #: 41 total cpu time spent up to now is 360.6 secs Computing kpt #: 42 total cpu time spent up to now is 369.5 secs Computing kpt #: 43 total cpu time spent up to now is 377.5 secs Computing kpt #: 44 total cpu time spent up to now is 386.2 secs Computing kpt #: 45 total cpu time spent up to now is 394.6 secs Computing kpt #: 46 total cpu time spent up to now is 401.5 secs Computing kpt #: 47 total cpu time spent up to now is 408.4 secs Computing kpt #: 48 total cpu time spent up to now is 416.2 secs Computing kpt #: 49 total cpu time spent up to now is 423.3 secs Computing kpt #: 50 total cpu time spent up to now is 430.5 secs Computing kpt #: 51 total cpu time spent up to now is 438.4 secs Computing kpt #: 52 total cpu time spent up to now is 446.1 secs Computing kpt #: 53 total cpu time spent up to now is 454.7 secs Computing kpt #: 54 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 465.4 secs Computing kpt #: 55 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 476.1 secs Computing kpt #: 56 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 486.8 secs Computing kpt #: 57 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 497.3 secs Computing kpt #: 58 total cpu time spent up to now is 505.8 secs Computing kpt #: 59 total cpu time spent up to now is 515.7 secs Computing kpt #: 60 total cpu time spent up to now is 523.5 secs Computing kpt #: 61 total cpu time spent up to now is 531.7 secs Computing kpt #: 62 total cpu time spent up to now is 541.1 secs Computing kpt #: 63 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 551.6 secs Computing kpt #: 64 total cpu time spent up to now is 560.4 secs Computing kpt #: 65 total cpu time spent up to now is 569.2 secs Computing kpt #: 66 total cpu time spent up to now is 577.0 secs Computing kpt #: 67 total cpu time spent up to now is 584.7 secs Computing kpt #: 68 total cpu time spent up to now is 591.1 secs Computing kpt #: 69 total cpu time spent up to now is 597.3 secs Computing kpt #: 70 total cpu time spent up to now is 603.4 secs Computing kpt #: 71 total cpu time spent up to now is 609.5 secs Computing kpt #: 72 total cpu time spent up to now is 615.6 secs Computing kpt #: 73 total cpu time spent up to now is 621.6 secs Computing kpt #: 74 total cpu time spent up to now is 627.7 secs Computing kpt #: 75 total cpu time spent up to now is 633.8 secs Computing kpt #: 76 total cpu time spent up to now is 639.8 secs Computing kpt #: 77 total cpu time spent up to now is 645.8 secs Computing kpt #: 78 total cpu time spent up to now is 651.8 secs Computing kpt #: 79 total cpu time spent up to now is 657.7 secs Computing kpt #: 80 total cpu time spent up to now is 663.9 secs Computing kpt #: 81 total cpu time spent up to now is 670.1 secs Computing kpt #: 82 total cpu time spent up to now is 676.1 secs Computing kpt #: 83 total cpu time spent up to now is 682.5 secs Computing kpt #: 84 total cpu time spent up to now is 689.2 secs Computing kpt #: 85 total cpu time spent up to now is 695.6 secs Computing kpt #: 86 total cpu time spent up to now is 702.1 secs Computing kpt #: 87 total cpu time spent up to now is 708.5 secs Computing kpt #: 88 total cpu time spent up to now is 715.7 secs Computing kpt #: 89 total cpu time spent up to now is 722.9 secs Computing kpt #: 90 total cpu time spent up to now is 730.1 secs Computing kpt #: 91 total cpu time spent up to now is 737.4 secs Computing kpt #: 92 total cpu time spent up to now is 744.8 secs Computing kpt #: 93 total cpu time spent up to now is 752.2 secs Computing kpt #: 94 total cpu time spent up to now is 758.1 secs Computing kpt #: 95 total cpu time spent up to now is 765.2 secs Computing kpt #: 96 total cpu time spent up to now is 772.5 secs Computing kpt #: 97 total cpu time spent up to now is 778.5 secs Computing kpt #: 98 total cpu time spent up to now is 784.6 secs Computing kpt #: 99 total cpu time spent up to now is 793.0 secs Computing kpt #: 100 total cpu time spent up to now is 801.7 secs Computing kpt #: 101 total cpu time spent up to now is 809.7 secs Computing kpt #: 102 total cpu time spent up to now is 820.3 secs Computing kpt #: 103 total cpu time spent up to now is 829.8 secs Computing kpt #: 104 total cpu time spent up to now is 836.8 secs Computing kpt #: 105 total cpu time spent up to now is 843.9 secs Computing kpt #: 106 total cpu time spent up to now is 851.1 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 860.9 secs Computing kpt #: 108 total cpu time spent up to now is 868.2 secs Computing kpt #: 109 total cpu time spent up to now is 877.0 secs Computing kpt #: 110 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 886.8 secs Computing kpt #: 111 total cpu time spent up to now is 896.7 secs Computing kpt #: 112 total cpu time spent up to now is 906.0 secs Computing kpt #: 113 total cpu time spent up to now is 914.5 secs Computing kpt #: 114 total cpu time spent up to now is 923.7 secs Computing kpt #: 115 total cpu time spent up to now is 932.1 secs Computing kpt #: 116 total cpu time spent up to now is 940.5 secs Computing kpt #: 117 total cpu time spent up to now is 949.0 secs Computing kpt #: 118 total cpu time spent up to now is 957.8 secs Computing kpt #: 119 total cpu time spent up to now is 966.6 secs Computing kpt #: 120 total cpu time spent up to now is 975.2 secs Computing kpt #: 121 total cpu time spent up to now is 984.1 secs Computing kpt #: 122 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 994.5 secs Computing kpt #: 123 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1004.9 secs Computing kpt #: 124 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1015.4 secs Computing kpt #: 125 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1025.8 secs Computing kpt #: 126 total cpu time spent up to now is 1035.2 secs Computing kpt #: 127 total cpu time spent up to now is 1045.5 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1056.6 secs Computing kpt #: 129 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1067.5 secs Computing kpt #: 130 total cpu time spent up to now is 1077.9 secs Computing kpt #: 131 total cpu time spent up to now is 1088.7 secs Computing kpt #: 132 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1099.9 secs Computing kpt #: 133 total cpu time spent up to now is 1107.4 secs Computing kpt #: 134 total cpu time spent up to now is 1116.8 secs Computing kpt #: 135 total cpu time spent up to now is 1123.9 secs Computing kpt #: 136 total cpu time spent up to now is 1130.9 secs Computing kpt #: 137 total cpu time spent up to now is 1137.8 secs Computing kpt #: 138 total cpu time spent up to now is 1145.2 secs Computing kpt #: 139 total cpu time spent up to now is 1152.5 secs Computing kpt #: 140 total cpu time spent up to now is 1163.4 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1175.0 secs Computing kpt #: 142 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1186.2 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1196.7 secs Computing kpt #: 144 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1207.3 secs Computing kpt #: 145 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1218.8 secs Computing kpt #: 146 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1230.0 secs Computing kpt #: 147 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1240.9 secs Computing kpt #: 148 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1251.9 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1263.5 secs Computing kpt #: 150 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1274.4 secs Computing kpt #: 151 total cpu time spent up to now is 1284.8 secs Computing kpt #: 152 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1295.6 secs Computing kpt #: 153 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1306.7 secs Computing kpt #: 154 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1317.8 secs Computing kpt #: 155 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1328.4 secs Computing kpt #: 156 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1339.0 secs Computing kpt #: 157 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1349.5 secs Computing kpt #: 158 total cpu time spent up to now is 1357.7 secs Computing kpt #: 159 total cpu time spent up to now is 1365.9 secs Computing kpt #: 160 total cpu time spent up to now is 1373.8 secs Computing kpt #: 161 total cpu time spent up to now is 1381.0 secs Computing kpt #: 162 total cpu time spent up to now is 1387.8 secs Computing kpt #: 163 total cpu time spent up to now is 1394.7 secs Computing kpt #: 164 total cpu time spent up to now is 1401.3 secs Computing kpt #: 165 total cpu time spent up to now is 1408.5 secs Computing kpt #: 166 total cpu time spent up to now is 1417.2 secs Computing kpt #: 167 total cpu time spent up to now is 1424.0 secs Computing kpt #: 168 total cpu time spent up to now is 1430.7 secs Computing kpt #: 169 total cpu time spent up to now is 1437.4 secs Computing kpt #: 170 total cpu time spent up to now is 1444.6 secs Computing kpt #: 171 total cpu time spent up to now is 1451.9 secs Computing kpt #: 172 total cpu time spent up to now is 1459.0 secs Computing kpt #: 173 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1469.4 secs Computing kpt #: 174 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1479.8 secs Computing kpt #: 175 total cpu time spent up to now is 1489.0 secs Computing kpt #: 176 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1499.3 secs Computing kpt #: 177 total cpu time spent up to now is 1506.8 secs Computing kpt #: 178 total cpu time spent up to now is 1514.2 secs Computing kpt #: 179 total cpu time spent up to now is 1521.5 secs Computing kpt #: 180 total cpu time spent up to now is 1528.1 secs Computing kpt #: 181 total cpu time spent up to now is 1535.5 secs Computing kpt #: 182 total cpu time spent up to now is 1541.7 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1552.8 secs Computing kpt #: 184 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1563.7 secs Computing kpt #: 185 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1574.5 secs Computing kpt #: 186 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1585.3 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1596.6 secs Computing kpt #: 188 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1607.5 secs Computing kpt #: 189 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1618.1 secs Computing kpt #: 190 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1629.0 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1640.2 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1651.3 secs Computing kpt #: 193 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1662.0 secs Computing kpt #: 194 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1672.8 secs Computing kpt #: 195 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1683.6 secs Computing kpt #: 196 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1694.3 secs Computing kpt #: 197 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1705.2 secs Computing kpt #: 198 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1718.1 secs Computing kpt #: 199 total cpu time spent up to now is 1728.4 secs Computing kpt #: 200 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1739.1 secs Computing kpt #: 201 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1750.0 secs Computing kpt #: 202 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1760.7 secs Computing kpt #: 203 total cpu time spent up to now is 1771.2 secs Computing kpt #: 204 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1781.8 secs Computing kpt #: 205 total cpu time spent up to now is 1792.7 secs Computing kpt #: 206 total cpu time spent up to now is 1801.8 secs Computing kpt #: 207 total cpu time spent up to now is 1811.5 secs Computing kpt #: 208 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1822.6 secs Computing kpt #: 209 total cpu time spent up to now is 1832.0 secs Computing kpt #: 210 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1842.7 secs ethr = 1.56E-11, avg # of iterations = 82.5 total cpu time spent up to now is 1842.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7521 PWs) bands (ev): -27.4723 -27.4723 -27.4478 -27.4478 -27.4478 -27.4478 -27.3914 -27.3914 -10.3498 -10.3498 -10.3465 -10.3465 -10.3465 -10.3465 -10.1903 -10.1903 -9.3100 -9.3100 -9.3100 -9.3100 -9.2102 -9.2102 -9.2082 -9.2082 -9.1338 -9.1338 -9.1338 -9.1338 -9.0245 -9.0245 -9.0245 -9.0245 -8.1390 -8.1390 -5.0709 -5.0709 -4.7903 -4.7903 -4.7903 -4.7903 4.5074 4.5074 4.5385 4.5385 4.5385 4.5385 5.2848 5.2848 5.2848 5.2848 5.3654 5.3654 5.5342 5.5342 5.6250 5.6250 5.6250 5.6250 6.2612 6.2612 6.3005 6.3005 6.3005 6.3005 8.4203 8.4203 8.4203 8.4203 8.4208 8.4208 9.1862 9.1862 10.5557 10.5557 10.5557 10.5557 k = 0.0000 0.0185-0.0000 ( 7517 PWs) bands (ev): -27.4723 -27.4723 -27.4478 -27.4478 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3466 -10.3466 -10.3465 -10.3465 -10.1905 -10.1905 -9.3100 -9.3100 -9.3100 -9.3100 -9.2102 -9.2102 -9.2083 -9.2083 -9.1341 -9.1341 -9.1338 -9.1338 -9.0250 -9.0250 -9.0246 -9.0246 -8.1383 -8.1383 -5.0699 -5.0699 -4.7897 -4.7897 -4.7895 -4.7895 4.5067 4.5067 4.5371 4.5371 4.5387 4.5387 5.2820 5.2820 5.2839 5.2839 5.3634 5.3634 5.5318 5.5318 5.6211 5.6211 5.6241 5.6241 6.2598 6.2598 6.2982 6.2982 6.3000 6.3000 8.4215 8.4215 8.4249 8.4249 8.4252 8.4252 9.1913 9.1913 10.5545 10.5545 10.5588 10.5588 k = 0.0000 0.0370-0.0000 ( 7521 PWs) bands (ev): -27.4722 -27.4722 -27.4478 -27.4478 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3467 -10.3467 -10.3464 -10.3464 -10.1911 -10.1911 -9.3100 -9.3100 -9.3099 -9.3099 -9.2104 -9.2104 -9.2086 -9.2086 -9.1349 -9.1349 -9.1338 -9.1338 -9.0266 -9.0266 -9.0249 -9.0249 -8.1363 -8.1363 -5.0668 -5.0668 -4.7879 -4.7879 -4.7872 -4.7872 4.5043 4.5043 4.5334 4.5334 4.5393 4.5393 5.2733 5.2733 5.2813 5.2813 5.3579 5.3579 5.5241 5.5241 5.6100 5.6100 5.6214 5.6214 6.2552 6.2552 6.2917 6.2917 6.2985 6.2985 8.4248 8.4248 8.4384 8.4384 8.4388 8.4388 9.2062 9.2062 10.5489 10.5489 10.5681 10.5681 k = 0.0000 0.0556-0.0000 ( 7541 PWs) bands (ev): -27.4721 -27.4721 -27.4479 -27.4479 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3468 -10.3468 -10.3463 -10.3463 -10.1920 -10.1920 -9.3099 -9.3099 -9.3097 -9.3097 -9.2107 -9.2107 -9.2091 -9.2091 -9.1363 -9.1363 -9.1339 -9.1339 -9.0292 -9.0292 -9.0253 -9.0253 -8.1331 -8.1331 -5.0618 -5.0618 -4.7850 -4.7850 -4.7834 -4.7834 4.4984 4.4984 4.5291 4.5291 4.5403 4.5403 5.2584 5.2584 5.2769 5.2769 5.3493 5.3493 5.5096 5.5096 5.5937 5.5937 5.6169 5.6169 6.2461 6.2461 6.2831 6.2831 6.2961 6.2961 8.4302 8.4302 8.4609 8.4609 8.4612 8.4612 9.2305 9.2305 10.5365 10.5365 10.5835 10.5835 k = 0.0000 0.0741-0.0000 ( 7561 PWs) bands (ev): -27.4719 -27.4719 -27.4480 -27.4480 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3471 -10.3471 -10.3460 -10.3460 -10.1933 -10.1933 -9.3098 -9.3098 -9.3095 -9.3095 -9.2112 -9.2112 -9.2099 -9.2099 -9.1382 -9.1382 -9.1339 -9.1339 -9.0327 -9.0327 -9.0260 -9.0260 -8.1287 -8.1287 -5.0548 -5.0548 -4.7809 -4.7809 -4.7780 -4.7780 4.4872 4.4872 4.5264 4.5264 4.5416 4.5416 5.2371 5.2371 5.2706 5.2706 5.3383 5.3383 5.4859 5.4859 5.5753 5.5753 5.6111 5.6111 6.2307 6.2307 6.2746 6.2746 6.2927 6.2927 8.4378 8.4378 8.4920 8.4920 8.4924 8.4924 9.2632 9.2632 10.5179 10.5179 10.6049 10.6049 k = 0.0000 0.0926-0.0000 ( 7561 PWs) bands (ev): -27.4717 -27.4717 -27.4482 -27.4482 -27.4478 -27.4478 -27.3916 -27.3916 -10.3499 -10.3499 -10.3474 -10.3474 -10.3456 -10.3456 -10.1950 -10.1950 -9.3096 -9.3096 -9.3092 -9.3092 -9.2117 -9.2117 -9.2109 -9.2109 -9.1406 -9.1406 -9.1339 -9.1339 -9.0372 -9.0372 -9.0268 -9.0268 -8.1231 -8.1231 -5.0460 -5.0460 -4.7758 -4.7758 -4.7713 -4.7713 4.4706 4.4706 4.5257 4.5257 4.5434 4.5434 5.2093 5.2093 5.2623 5.2623 5.3254 5.3254 5.4510 5.4510 5.5578 5.5578 5.6040 5.6040 6.2092 6.2092 6.2671 6.2671 6.2886 6.2886 8.4475 8.4475 8.5315 8.5315 8.5320 8.5320 9.3032 9.3032 10.4937 10.4937 10.6324 10.6324 k = 0.0000 0.1111-0.0000 ( 7561 PWs) bands (ev): -27.4715 -27.4715 -27.4484 -27.4484 -27.4477 -27.4477 -27.3916 -27.3916 -10.3501 -10.3501 -10.3477 -10.3477 -10.3450 -10.3450 -10.1970 -10.1970 -9.3094 -9.3094 -9.3088 -9.3088 -9.2124 -9.2124 -9.2121 -9.2121 -9.1433 -9.1433 -9.1338 -9.1338 -9.0425 -9.0425 -9.0278 -9.0278 -8.1166 -8.1166 -5.0354 -5.0354 -4.7698 -4.7698 -4.7632 -4.7632 4.4495 4.4495 4.5263 4.5263 4.5455 4.5455 5.1755 5.1755 5.2519 5.2519 5.3108 5.3108 5.4053 5.4053 5.5422 5.5422 5.5961 5.5961 6.1829 6.1829 6.2602 6.2602 6.2836 6.2836 8.4593 8.4593 8.5791 8.5791 8.5796 8.5796 9.3493 9.3493 10.4646 10.4646 10.6656 10.6656 k = 0.0000 0.1296-0.0000 ( 7537 PWs) bands (ev): -27.4712 -27.4712 -27.4486 -27.4486 -27.4477 -27.4477 -27.3917 -27.3917 -10.3503 -10.3503 -10.3481 -10.3481 -10.3442 -10.3442 -10.1994 -10.1994 -9.3091 -9.3091 -9.3083 -9.3083 -9.2136 -9.2136 -9.2131 -9.2131 -9.1465 -9.1465 -9.1336 -9.1336 -9.0485 -9.0485 -9.0289 -9.0289 -8.1091 -8.1091 -5.0231 -5.0231 -4.7628 -4.7628 -4.7540 -4.7540 4.4248 4.4248 4.5279 4.5279 4.5481 4.5481 5.1362 5.1362 5.2388 5.2388 5.2945 5.2945 5.3513 5.3513 5.5280 5.5280 5.5875 5.5875 6.1532 6.1532 6.2534 6.2534 6.2781 6.2781 8.4732 8.4732 8.6344 8.6344 8.6350 8.6350 9.4003 9.4003 10.4308 10.4308 10.7046 10.7046 k = 0.0000 0.1481-0.0000 ( 7533 PWs) bands (ev): -27.4709 -27.4709 -27.4488 -27.4488 -27.4477 -27.4477 -27.3917 -27.3917 -10.3507 -10.3507 -10.3486 -10.3486 -10.3432 -10.3432 -10.2021 -10.2021 -9.3088 -9.3088 -9.3077 -9.3077 -9.2153 -9.2153 -9.2140 -9.2140 -9.1501 -9.1501 -9.1333 -9.1333 -9.0552 -9.0552 -9.0303 -9.0303 -8.1008 -8.1008 -5.0093 -5.0093 -4.7551 -4.7551 -4.7436 -4.7436 4.3974 4.3974 4.5300 4.5300 4.5511 4.5511 5.0924 5.0924 5.2213 5.2213 5.2767 5.2767 5.2925 5.2925 5.5148 5.5148 5.5787 5.5787 6.1212 6.1212 6.2464 6.2464 6.2720 6.2720 8.4891 8.4891 8.6970 8.6970 8.6977 8.6977 9.4552 9.4552 10.3930 10.3930 10.7489 10.7489 k = 0.0000 0.1667-0.0000 ( 7521 PWs) bands (ev): -27.4706 -27.4706 -27.4491 -27.4491 -27.4477 -27.4477 -27.3918 -27.3918 -10.3511 -10.3511 -10.3491 -10.3491 -10.3421 -10.3421 -10.2051 -10.2051 -9.3084 -9.3084 -9.3069 -9.3069 -9.2173 -9.2173 -9.2149 -9.2149 -9.1539 -9.1539 -9.1329 -9.1329 -9.0625 -9.0625 -9.0318 -9.0318 -8.0919 -8.0919 -4.9942 -4.9942 -4.7468 -4.7468 -4.7323 -4.7323 4.3677 4.3677 4.5327 4.5327 4.5546 4.5546 5.0449 5.0449 5.1903 5.1903 5.2399 5.2399 5.2574 5.2574 5.5022 5.5022 5.5698 5.5698 6.0877 6.0877 6.2393 6.2393 6.2654 6.2654 8.5070 8.5070 8.7665 8.7665 8.7672 8.7672 9.5130 9.5130 10.3516 10.3516 10.7986 10.7986 k = 0.0000 0.1852-0.0000 ( 7516 PWs) bands (ev): -27.4702 -27.4702 -27.4494 -27.4494 -27.4477 -27.4477 -27.3918 -27.3918 -10.3515 -10.3515 -10.3496 -10.3496 -10.3408 -10.3408 -10.2084 -10.2084 -9.3079 -9.3079 -9.3060 -9.3060 -9.2196 -9.2196 -9.2160 -9.2160 -9.1579 -9.1579 -9.1323 -9.1323 -9.0702 -9.0702 -9.0334 -9.0334 -8.0826 -8.0826 -4.9779 -4.9779 -4.7379 -4.7379 -4.7201 -4.7201 4.3364 4.3364 4.5360 4.5360 4.5584 4.5584 4.9946 4.9946 5.1320 5.1320 5.2088 5.2088 5.2367 5.2367 5.4902 5.4902 5.5609 5.5609 6.0533 6.0533 6.2319 6.2319 6.2585 6.2585 8.5270 8.5270 8.8425 8.8425 8.8433 8.8433 9.5728 9.5728 10.3070 10.3070 10.8532 10.8532 k = 0.0000 0.2037-0.0000 ( 7536 PWs) bands (ev): -27.4698 -27.4698 -27.4497 -27.4497 -27.4477 -27.4477 -27.3919 -27.3919 -10.3521 -10.3521 -10.3502 -10.3502 -10.3393 -10.3393 -10.2120 -10.2120 -9.3073 -9.3073 -9.3050 -9.3050 -9.2221 -9.2221 -9.2170 -9.2170 -9.1622 -9.1622 -9.1316 -9.1316 -9.0783 -9.0783 -9.0351 -9.0351 -8.0728 -8.0728 -4.9607 -4.9607 -4.7288 -4.7288 -4.7073 -4.7073 4.3041 4.3041 4.5396 4.5396 4.5627 4.5627 4.9423 4.9423 5.0604 5.0604 5.1867 5.1867 5.2148 5.2148 5.4789 5.4789 5.5523 5.5523 6.0186 6.0186 6.2244 6.2244 6.2514 6.2514 8.5488 8.5488 8.9246 8.9246 8.9254 8.9254 9.6340 9.6340 10.2598 10.2598 10.9125 10.9125 k = 0.0000 0.2222-0.0000 ( 7536 PWs) bands (ev): -27.4693 -27.4693 -27.4500 -27.4500 -27.4477 -27.4477 -27.3920 -27.3920 -10.3526 -10.3526 -10.3508 -10.3508 -10.3376 -10.3376 -10.2158 -10.2158 -9.3067 -9.3067 -9.3038 -9.3038 -9.2248 -9.2248 -9.2182 -9.2182 -9.1665 -9.1665 -9.1307 -9.1307 -9.0866 -9.0866 -9.0370 -9.0370 -8.0628 -8.0628 -4.9426 -4.9426 -4.7194 -4.7194 -4.6940 -4.6940 4.2713 4.2713 4.5437 4.5437 4.5675 4.5675 4.8889 4.8889 4.9848 4.9848 5.1658 5.1658 5.1920 5.1920 5.4683 5.4683 5.5441 5.5441 5.9840 5.9840 6.2169 6.2169 6.2442 6.2442 8.5724 8.5724 9.0123 9.0123 9.0132 9.0132 9.6961 9.6961 10.2102 10.2102 10.9761 10.9761 k = 0.0000 0.2407-0.0000 ( 7556 PWs) bands (ev): -27.4688 -27.4688 -27.4504 -27.4504 -27.4477 -27.4477 -27.3921 -27.3921 -10.3532 -10.3532 -10.3514 -10.3514 -10.3357 -10.3357 -10.2199 -10.2199 -9.3059 -9.3059 -9.3024 -9.3024 -9.2278 -9.2278 -9.2194 -9.2194 -9.1709 -9.1709 -9.1296 -9.1296 -9.0951 -9.0951 -9.0390 -9.0390 -8.0528 -8.0528 -4.9239 -4.9239 -4.7099 -4.7099 -4.6804 -4.6804 4.2387 4.2387 4.5482 4.5482 4.5727 4.5727 4.8353 4.8353 4.9079 4.9079 5.1447 5.1447 5.1684 5.1684 5.4585 5.4585 5.5362 5.5362 5.9499 5.9499 6.2094 6.2094 6.2370 6.2370 8.5978 8.5978 9.1053 9.1053 9.1064 9.1064 9.7587 9.7587 10.1589 10.1589 11.0437 11.0437 k = 0.0000 0.2593-0.0000 ( 7556 PWs) bands (ev): -27.4683 -27.4683 -27.4508 -27.4508 -27.4477 -27.4477 -27.3922 -27.3922 -10.3537 -10.3537 -10.3520 -10.3520 -10.3337 -10.3337 -10.2241 -10.2241 -9.3050 -9.3050 -9.3009 -9.3009 -9.2309 -9.2309 -9.2207 -9.2207 -9.1752 -9.1752 -9.1284 -9.1284 -9.1037 -9.1037 -9.0411 -9.0411 -8.0428 -8.0428 -4.9048 -4.9048 -4.7006 -4.7006 -4.6666 -4.6666 4.2068 4.2068 4.5531 4.5531 4.5782 4.5782 4.7821 4.7821 4.8311 4.8311 5.1232 5.1232 5.1443 5.1443 5.4493 5.4493 5.5287 5.5287 5.9167 5.9167 6.2020 6.2020 6.2299 6.2299 8.6248 8.6248 9.2032 9.2032 9.2044 9.2044 9.8216 9.8216 10.1063 10.1063 11.1146 11.1146 k = 0.0000 0.2778-0.0000 ( 7544 PWs) bands (ev): -27.4678 -27.4678 -27.4513 -27.4513 -27.4477 -27.4477 -27.3922 -27.3922 -10.3543 -10.3543 -10.3526 -10.3526 -10.3314 -10.3314 -10.2285 -10.2285 -9.3040 -9.3040 -9.2991 -9.2991 -9.2342 -9.2342 -9.2220 -9.2220 -9.1795 -9.1795 -9.1270 -9.1270 -9.1122 -9.1122 -9.0432 -9.0432 -8.0330 -8.0330 -4.8856 -4.8856 -4.6915 -4.6915 -4.6530 -4.6530 4.1762 4.1762 4.5584 4.5584 4.5840 4.5840 4.7303 4.7303 4.7554 4.7554 5.1015 5.1015 5.1201 5.1201 5.4410 5.4410 5.5217 5.5217 5.8847 5.8847 6.1948 6.1948 6.2229 6.2229 8.6533 8.6533 9.3056 9.3056 9.3069 9.3069 9.8846 9.8846 10.0528 10.0528 11.1882 11.1882 k = 0.0000 0.2963-0.0000 ( 7544 PWs) bands (ev): -27.4672 -27.4672 -27.4517 -27.4517 -27.4476 -27.4476 -27.3923 -27.3923 -10.3549 -10.3549 -10.3532 -10.3532 -10.3290 -10.3290 -10.2331 -10.2331 -9.3028 -9.3028 -9.2972 -9.2972 -9.2376 -9.2376 -9.2234 -9.2234 -9.1837 -9.1837 -9.1255 -9.1255 -9.1206 -9.1206 -9.0455 -9.0455 -8.0235 -8.0235 -4.8664 -4.8664 -4.6829 -4.6829 -4.6395 -4.6395 4.1473 4.1473 4.5640 4.5640 4.5897 4.5897 4.6808 4.6808 4.6817 4.6817 5.0798 5.0798 5.0960 5.0960 5.4333 5.4333 5.5152 5.5152 5.8541 5.8541 6.1879 6.1879 6.2162 6.2162 8.6832 8.6832 9.4122 9.4122 9.4137 9.4137 9.9474 9.9474 9.9989 9.9989 11.2633 11.2633 k = 0.0000 0.3148-0.0000 ( 7552 PWs) bands (ev): -27.4667 -27.4667 -27.4522 -27.4522 -27.4476 -27.4476 -27.3924 -27.3924 -10.3554 -10.3554 -10.3538 -10.3538 -10.3264 -10.3264 -10.2378 -10.2378 -9.3015 -9.3015 -9.2951 -9.2951 -9.2412 -9.2412 -9.2248 -9.2248 -9.1877 -9.1877 -9.1287 -9.1287 -9.1239 -9.1239 -9.0477 -9.0477 -8.0145 -8.0145 -4.8476 -4.8476 -4.6749 -4.6749 -4.6265 -4.6265 4.1207 4.1207 4.5697 4.5697 4.5931 4.5931 4.6109 4.6109 4.6363 4.6363 5.0585 5.0585 5.0722 5.0722 5.4264 5.4264 5.5092 5.5092 5.8253 5.8253 6.1814 6.1814 6.2098 6.2098 8.7141 8.7141 9.5225 9.5225 9.5242 9.5242 9.9451 9.9451 10.0101 10.0101 11.3384 11.3384 k = 0.0000 0.3333-0.0000 ( 7568 PWs) bands (ev): -27.4661 -27.4661 -27.4527 -27.4527 -27.4476 -27.4476 -27.3924 -27.3924 -10.3560 -10.3560 -10.3544 -10.3544 -10.3236 -10.3236 -10.2426 -10.2426 -9.3001 -9.3001 -9.2927 -9.2927 -9.2448 -9.2448 -9.2262 -9.2262 -9.1915 -9.1915 -9.1366 -9.1366 -9.1222 -9.1222 -9.0500 -9.0500 -8.0059 -8.0059 -4.8293 -4.8293 -4.6675 -4.6675 -4.6140 -4.6140 4.0967 4.0967 4.5425 4.5425 4.5766 4.5766 4.5771 4.5771 4.6145 4.6145 5.0377 5.0377 5.0491 5.0491 5.4201 5.4201 5.5037 5.5037 5.7985 5.7985 6.1753 6.1753 6.2038 6.2038 8.7459 8.7459 9.6361 9.6361 9.6381 9.6381 9.8920 9.8920 10.0723 10.0723 11.4101 11.4101 k = 0.0000 0.3519-0.0000 ( 7544 PWs) bands (ev): -27.4655 -27.4655 -27.4531 -27.4531 -27.4476 -27.4476 -27.3925 -27.3925 -10.3565 -10.3565 -10.3549 -10.3549 -10.3206 -10.3206 -10.2474 -10.2474 -9.2985 -9.2985 -9.2903 -9.2903 -9.2484 -9.2484 -9.2276 -9.2276 -9.1951 -9.1951 -9.1440 -9.1440 -9.1205 -9.1205 -9.0522 -9.0522 -7.9980 -7.9980 -4.8118 -4.8118 -4.6610 -4.6610 -4.6024 -4.6024 4.0758 4.0758 4.4791 4.4791 4.5400 4.5400 4.5826 4.5826 4.6174 4.6174 5.0177 5.0177 5.0270 5.0270 5.4145 5.4145 5.4988 5.4988 5.7739 5.7739 6.1696 6.1696 6.1983 6.1983 8.7782 8.7782 9.7526 9.7526 9.7549 9.7549 9.8400 9.8400 10.1340 10.1340 11.3644 11.3644 k = 0.0000 0.3704-0.0000 ( 7552 PWs) bands (ev): -27.4650 -27.4650 -27.4536 -27.4536 -27.4476 -27.4476 -27.3926 -27.3926 -10.3569 -10.3569 -10.3554 -10.3554 -10.3175 -10.3175 -10.2522 -10.2522 -9.2968 -9.2968 -9.2877 -9.2877 -9.2520 -9.2520 -9.2291 -9.2291 -9.1984 -9.1984 -9.1508 -9.1508 -9.1187 -9.1187 -9.0544 -9.0544 -7.9908 -7.9908 -4.7953 -4.7953 -4.6554 -4.6554 -4.5917 -4.5917 4.0583 4.0583 4.4201 4.4201 4.5032 4.5032 4.5888 4.5888 4.6239 4.6239 4.9990 4.9990 5.0060 5.0060 5.4096 5.4096 5.4943 5.4943 5.7518 5.7518 6.1645 6.1645 6.1934 6.1934 8.8105 8.8105 9.7898 9.7898 9.8714 9.8714 9.8742 9.8742 10.1948 10.1948 11.3023 11.3023 k = 0.0000 0.3889-0.0000 ( 7560 PWs) bands (ev): -27.4644 -27.4644 -27.4541 -27.4541 -27.4476 -27.4476 -27.3926 -27.3926 -10.3573 -10.3573 -10.3558 -10.3558 -10.3142 -10.3142 -10.2570 -10.2570 -9.2949 -9.2949 -9.2851 -9.2851 -9.2555 -9.2555 -9.2305 -9.2305 -9.2015 -9.2015 -9.1570 -9.1570 -9.1170 -9.1170 -9.0564 -9.0564 -7.9844 -7.9844 -4.7801 -4.7801 -4.6508 -4.6508 -4.5821 -4.5821 4.0442 4.0442 4.3661 4.3661 4.4700 4.4700 4.5949 4.5949 4.6311 4.6311 4.9818 4.9818 4.9866 4.9866 5.4054 5.4054 5.4905 5.4905 5.7322 5.7322 6.1600 6.1600 6.1889 6.1889 8.8423 8.8423 9.7423 9.7423 9.9918 9.9918 9.9951 9.9951 10.2541 10.2541 11.2405 11.2405 k = 0.0000 0.4074-0.0000 ( 7560 PWs) bands (ev): -27.4639 -27.4639 -27.4546 -27.4546 -27.4476 -27.4476 -27.3927 -27.3927 -10.3577 -10.3577 -10.3562 -10.3562 -10.3109 -10.3109 -10.2617 -10.2617 -9.2930 -9.2930 -9.2824 -9.2824 -9.2590 -9.2590 -9.2319 -9.2319 -9.2042 -9.2042 -9.1624 -9.1624 -9.1154 -9.1154 -9.0584 -9.0584 -7.9789 -7.9789 -4.7665 -4.7665 -4.6471 -4.6471 -4.5737 -4.5737 4.0338 4.0338 4.3179 4.3179 4.4412 4.4412 4.6007 4.6007 4.6381 4.6381 4.9663 4.9663 4.9692 4.9692 5.4018 5.4018 5.4872 5.4872 5.7154 5.7154 6.1562 6.1562 6.1851 6.1851 8.8727 8.8727 9.6983 9.6983 10.1127 10.1127 10.1169 10.1169 10.3114 10.3114 11.1804 11.1804 k = 0.0000 0.4259-0.0000 ( 7568 PWs) bands (ev): -27.4634 -27.4634 -27.4551 -27.4551 -27.4476 -27.4476 -27.3927 -27.3927 -10.3580 -10.3580 -10.3565 -10.3565 -10.3074 -10.3074 -10.2662 -10.2662 -9.2909 -9.2909 -9.2799 -9.2799 -9.2623 -9.2623 -9.2333 -9.2333 -9.2066 -9.2066 -9.1669 -9.1669 -9.1140 -9.1140 -9.0601 -9.0601 -7.9743 -7.9743 -4.7548 -4.7548 -4.6444 -4.6444 -4.5666 -4.5666 4.0269 4.0269 4.2761 4.2761 4.4172 4.4172 4.6059 4.6059 4.6447 4.6447 4.9531 4.9531 4.9540 4.9540 5.3988 5.3988 5.4844 5.4844 5.7014 5.7014 6.1529 6.1529 6.1820 6.1820 8.9007 8.9007 9.6591 9.6591 10.2325 10.2325 10.2379 10.2379 10.3652 10.3652 11.1236 11.1236 k = 0.0000 0.4444-0.0000 ( 7568 PWs) bands (ev): -27.4629 -27.4629 -27.4555 -27.4555 -27.4476 -27.4476 -27.3927 -27.3927 -10.3583 -10.3583 -10.3568 -10.3568 -10.3040 -10.3040 -10.2705 -10.2705 -9.2889 -9.2889 -9.2776 -9.2776 -9.2653 -9.2653 -9.2346 -9.2346 -9.2086 -9.2086 -9.1705 -9.1705 -9.1128 -9.1128 -9.0615 -9.0615 -7.9707 -7.9707 -4.7451 -4.7451 -4.6425 -4.6425 -4.5611 -4.5611 4.0232 4.0232 4.2415 4.2415 4.3982 4.3982 4.6104 4.6104 4.6504 4.6504 4.9415 4.9415 4.9423 4.9423 5.3965 5.3965 5.4823 5.4823 5.6905 5.6905 6.1504 6.1504 6.1795 6.1795 8.9249 8.9249 9.6259 9.6259 10.3481 10.3481 10.3554 10.3554 10.4138 10.4138 11.0726 11.0726 k = 0.0000 0.4630-0.0000 ( 7568 PWs) bands (ev): -27.4626 -27.4626 -27.4558 -27.4558 -27.4476 -27.4476 -27.3928 -27.3928 -10.3584 -10.3584 -10.3569 -10.3569 -10.3009 -10.3009 -10.2743 -10.2743 -9.2870 -9.2870 -9.2758 -9.2758 -9.2679 -9.2679 -9.2356 -9.2356 -9.2100 -9.2100 -9.1731 -9.1731 -9.1118 -9.1118 -9.0625 -9.0625 -7.9680 -7.9680 -4.7380 -4.7380 -4.6413 -4.6413 -4.5570 -4.5570 4.0218 4.0218 4.2152 4.2152 4.3846 4.3846 4.6138 4.6138 4.6549 4.6549 4.9322 4.9322 4.9343 4.9343 5.3949 5.3949 5.4808 5.4808 5.6826 5.6826 6.1486 6.1486 6.1777 6.1777 8.9440 8.9440 9.6005 9.6005 10.4524 10.4524 10.4546 10.4546 10.4634 10.4634 11.0306 11.0306 k = 0.0000 0.4815-0.0000 ( 7560 PWs) bands (ev): -27.4623 -27.4623 -27.4560 -27.4560 -27.4476 -27.4476 -27.3928 -27.3928 -10.3585 -10.3585 -10.3571 -10.3571 -10.2985 -10.2985 -10.2771 -10.2771 -9.2855 -9.2855 -9.2746 -9.2746 -9.2698 -9.2698 -9.2363 -9.2363 -9.2110 -9.2110 -9.1747 -9.1747 -9.1112 -9.1112 -9.0632 -9.0632 -7.9665 -7.9665 -4.7336 -4.7336 -4.6407 -4.6407 -4.5546 -4.5546 4.0217 4.0217 4.1986 4.1986 4.3763 4.3763 4.6159 4.6159 4.6577 4.6577 4.9264 4.9264 4.9294 4.9294 5.3939 5.3939 5.4799 5.4799 5.6778 5.6778 6.1475 6.1475 6.1766 6.1766 8.9562 8.9562 9.5844 9.5844 10.4808 10.4808 10.5346 10.5346 10.5484 10.5484 11.0022 11.0022 k = 0.0000 0.5000-0.0000 ( 7528 PWs) bands (ev): -27.4623 -27.4623 -27.4561 -27.4561 -27.4476 -27.4476 -27.3928 -27.3928 -10.3586 -10.3586 -10.3571 -10.3571 -10.2975 -10.2975 -10.2782 -10.2782 -9.2850 -9.2850 -9.2741 -9.2741 -9.2705 -9.2705 -9.2366 -9.2366 -9.2113 -9.2113 -9.1752 -9.1752 -9.1110 -9.1110 -9.0634 -9.0634 -7.9659 -7.9659 -4.7320 -4.7320 -4.6405 -4.6405 -4.5537 -4.5537 4.0218 4.0218 4.1928 4.1928 4.3735 4.3735 4.6166 4.6166 4.6587 4.6587 4.9244 4.9244 4.9278 4.9278 5.3936 5.3936 5.4796 5.4796 5.6763 5.6763 6.1471 6.1471 6.1763 6.1763 8.9604 8.9604 9.5789 9.5789 10.4906 10.4906 10.5674 10.5674 10.5833 10.5833 10.9920 10.9920 k = 0.0000 0.5000-0.0000 ( 7528 PWs) bands (ev): -27.4623 -27.4623 -27.4561 -27.4561 -27.4476 -27.4476 -27.3928 -27.3928 -10.3586 -10.3586 -10.3571 -10.3571 -10.2975 -10.2975 -10.2782 -10.2782 -9.2850 -9.2850 -9.2741 -9.2741 -9.2705 -9.2705 -9.2366 -9.2366 -9.2113 -9.2113 -9.1752 -9.1752 -9.1110 -9.1110 -9.0634 -9.0634 -7.9659 -7.9659 -4.7320 -4.7320 -4.6405 -4.6405 -4.5537 -4.5537 4.0218 4.0218 4.1928 4.1928 4.3735 4.3735 4.6166 4.6166 4.6587 4.6587 4.9244 4.9244 4.9278 4.9278 5.3936 5.3936 5.4796 5.4796 5.6763 5.6763 6.1471 6.1471 6.1763 6.1763 8.9604 8.9604 9.5789 9.5789 10.4906 10.4906 10.5674 10.5674 10.5833 10.5833 10.9920 10.9920 k = 0.0185 0.5000-0.0000 ( 7570 PWs) bands (ev): -27.4623 -27.4623 -27.4561 -27.4561 -27.4476 -27.4476 -27.3928 -27.3928 -10.3587 -10.3587 -10.3570 -10.3570 -10.2977 -10.2977 -10.2783 -10.2783 -9.2871 -9.2871 -9.2747 -9.2747 -9.2684 -9.2684 -9.2366 -9.2366 -9.2116 -9.2116 -9.1750 -9.1750 -9.1109 -9.1109 -9.0634 -9.0634 -7.9655 -7.9655 -4.7311 -4.7311 -4.6398 -4.6398 -4.5531 -4.5531 4.0213 4.0213 4.1910 4.1910 4.3715 4.3715 4.6160 4.6160 4.6580 4.6580 4.9239 4.9239 4.9272 4.9272 5.3902 5.3902 5.4759 5.4759 5.6778 5.6778 6.1458 6.1458 6.1749 6.1749 8.9647 8.9647 9.5818 9.5818 10.4937 10.4937 10.5688 10.5688 10.5847 10.5847 10.9937 10.9937 k = 0.0370 0.5000-0.0000 ( 7574 PWs) bands (ev): -27.4622 -27.4622 -27.4561 -27.4561 -27.4476 -27.4476 -27.3928 -27.3928 -10.3591 -10.3591 -10.3568 -10.3568 -10.2981 -10.2981 -10.2788 -10.2788 -9.2915 -9.2915 -9.2764 -9.2764 -9.2639 -9.2639 -9.2369 -9.2369 -9.2124 -9.2124 -9.1742 -9.1742 -9.1106 -9.1106 -9.0632 -9.0632 -7.9641 -7.9641 -4.7285 -4.7285 -4.6375 -4.6375 -4.5513 -4.5513 4.0196 4.0196 4.1857 4.1857 4.3653 4.3653 4.6140 4.6140 4.6559 4.6559 4.9221 4.9221 4.9261 4.9261 5.3799 5.3799 5.4657 5.4657 5.6820 5.6820 6.1418 6.1418 6.1710 6.1710 8.9777 8.9777 9.5906 9.5906 10.5031 10.5031 10.5730 10.5730 10.5890 10.5890 10.9986 10.9986 k = 0.0556 0.5000-0.0000 ( 7570 PWs) bands (ev): -27.4622 -27.4622 -27.4560 -27.4560 -27.4477 -27.4477 -27.3928 -27.3928 -10.3596 -10.3596 -10.3566 -10.3566 -10.2988 -10.2988 -10.2795 -10.2795 -9.2966 -9.2966 -9.2790 -9.2790 -9.2587 -9.2587 -9.2376 -9.2376 -9.2138 -9.2138 -9.1729 -9.1729 -9.1100 -9.1100 -9.0630 -9.0630 -7.9618 -7.9618 -4.7240 -4.7240 -4.6338 -4.6338 -4.5483 -4.5483 4.0168 4.0168 4.1768 4.1768 4.3552 4.3552 4.6100 4.6100 4.6533 4.6533 4.9184 4.9184 4.9250 4.9250 5.3620 5.3620 5.4509 5.4509 5.6880 5.6880 6.1349 6.1349 6.1651 6.1651 8.9990 8.9990 9.6051 9.6051 10.5185 10.5185 10.5797 10.5797 10.5966 10.5966 11.0062 11.0062 k = 0.0741 0.5000-0.0000 ( 7558 PWs) bands (ev): -27.4621 -27.4621 -27.4560 -27.4560 -27.4478 -27.4478 -27.3928 -27.3928 -10.3601 -10.3601 -10.3564 -10.3564 -10.2997 -10.2997 -10.2805 -10.2805 -9.3018 -9.3018 -9.2824 -9.2824 -9.2533 -9.2533 -9.2389 -9.2389 -9.2155 -9.2155 -9.1711 -9.1711 -9.1092 -9.1092 -9.0626 -9.0626 -7.9586 -7.9586 -4.7178 -4.7178 -4.6287 -4.6287 -4.5441 -4.5441 4.0127 4.0127 4.1643 4.1643 4.3415 4.3415 4.6030 4.6030 4.6511 4.6511 4.9128 4.9128 4.9239 4.9239 5.3362 5.3362 5.4335 5.4335 5.6947 5.6947 6.1245 6.1245 6.1578 6.1578 9.0288 9.0288 9.6252 9.6252 10.5397 10.5397 10.5885 10.5885 10.6079 10.6079 11.0161 11.0161 k = 0.0926 0.5000-0.0000 ( 7562 PWs) bands (ev): -27.4620 -27.4620 -27.4560 -27.4560 -27.4479 -27.4479 -27.3928 -27.3928 -10.3608 -10.3608 -10.3563 -10.3563 -10.3010 -10.3010 -10.2817 -10.2817 -9.3070 -9.3070 -9.2862 -9.2862 -9.2482 -9.2482 -9.2407 -9.2407 -9.2174 -9.2174 -9.1688 -9.1688 -9.1083 -9.1083 -9.0623 -9.0623 -7.9547 -7.9547 -4.7100 -4.7100 -4.6222 -4.6222 -4.5389 -4.5389 4.0074 4.0074 4.1485 4.1485 4.3244 4.3244 4.5928 4.5928 4.6502 4.6502 4.9055 4.9055 4.9226 4.9226 5.3029 5.3029 5.4147 5.4147 5.7014 5.7014 6.1107 6.1107 6.1497 6.1497 9.0667 9.0667 9.6506 9.6506 10.5662 10.5662 10.5993 10.5993 10.6231 10.6231 11.0283 11.0283 k = 0.1111 0.5000-0.0000 ( 7554 PWs) bands (ev): -27.4618 -27.4618 -27.4559 -27.4559 -27.4480 -27.4480 -27.3929 -27.3929 -10.3614 -10.3614 -10.3562 -10.3562 -10.3024 -10.3024 -10.2833 -10.2833 -9.3122 -9.3122 -9.2905 -9.2905 -9.2456 -9.2456 -9.2410 -9.2410 -9.2194 -9.2194 -9.1661 -9.1661 -9.1073 -9.1073 -9.0619 -9.0619 -7.9499 -7.9499 -4.7006 -4.7006 -4.6144 -4.6144 -4.5327 -4.5327 4.0006 4.0006 4.1293 4.1293 4.3044 4.3044 4.5791 4.5791 4.6506 4.6506 4.8967 4.8967 4.9211 4.9211 5.2634 5.2634 5.3947 5.3947 5.7077 5.7077 6.0937 6.0937 6.1410 6.1410 9.1124 9.1124 9.6812 9.6812 10.5975 10.5975 10.6120 10.6120 10.6425 10.6425 11.0429 11.0429 k = 0.1296 0.5000-0.0000 ( 7554 PWs) bands (ev): -27.4616 -27.4616 -27.4559 -27.4559 -27.4482 -27.4482 -27.3929 -27.3929 -10.3621 -10.3621 -10.3561 -10.3561 -10.3042 -10.3042 -10.2850 -10.2850 -9.3171 -9.3171 -9.2949 -9.2949 -9.2484 -9.2484 -9.2374 -9.2374 -9.2211 -9.2211 -9.1630 -9.1630 -9.1062 -9.1062 -9.0615 -9.0615 -7.9445 -7.9445 -4.6898 -4.6898 -4.6055 -4.6055 -4.5255 -4.5255 3.9922 3.9922 4.1071 4.1071 4.2821 4.2821 4.5624 4.5624 4.6523 4.6523 4.8866 4.8866 4.9194 4.9194 5.2190 5.2190 5.3736 5.3736 5.7134 5.7134 6.0740 6.0740 6.1319 6.1319 9.1657 9.1657 9.7164 9.7164 10.6266 10.6266 10.6332 10.6332 10.6660 10.6660 11.0599 11.0599 k = 0.1481 0.5000-0.0000 ( 7556 PWs) bands (ev): -27.4615 -27.4615 -27.4558 -27.4558 -27.4483 -27.4483 -27.3929 -27.3929 -10.3629 -10.3629 -10.3561 -10.3561 -10.3061 -10.3061 -10.2870 -10.2870 -9.3219 -9.3219 -9.2994 -9.2994 -9.2525 -9.2525 -9.2348 -9.2348 -9.2214 -9.2214 -9.1597 -9.1597 -9.1051 -9.1051 -9.0611 -9.0611 -7.9385 -7.9385 -4.6776 -4.6776 -4.5955 -4.5955 -4.5176 -4.5176 3.9819 3.9819 4.0820 4.0820 4.2583 4.2583 4.5431 4.5431 4.6551 4.6551 4.8753 4.8753 4.9176 4.9176 5.1713 5.1713 5.3513 5.3513 5.7183 5.7183 6.0523 6.0523 6.1222 6.1222 9.2263 9.2263 9.7561 9.7561 10.6437 10.6437 10.6717 10.6717 10.6943 10.6943 11.0794 11.0794 k = 0.1667 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4612 -27.4612 -27.4558 -27.4558 -27.4485 -27.4485 -27.3930 -27.3930 -10.3636 -10.3636 -10.3560 -10.3560 -10.3082 -10.3082 -10.2892 -10.2892 -9.3264 -9.3264 -9.3039 -9.3039 -9.2573 -9.2573 -9.2349 -9.2349 -9.2192 -9.2192 -9.1562 -9.1562 -9.1039 -9.1039 -9.0608 -9.0608 -7.9320 -7.9320 -4.6642 -4.6642 -4.5845 -4.5845 -4.5090 -4.5090 3.9694 3.9694 4.0544 4.0544 4.2335 4.2335 4.5212 4.5212 4.6588 4.6588 4.8630 4.8630 4.9155 4.9155 5.1218 5.1218 5.3277 5.3277 5.7225 5.7225 6.0289 6.0289 6.1120 6.1120 9.2939 9.2939 9.7996 9.7996 10.6631 10.6631 10.7109 10.7109 10.7291 10.7291 11.1014 11.1014 k = 0.1852 0.5000-0.0000 ( 7556 PWs) bands (ev): -27.4610 -27.4610 -27.4557 -27.4557 -27.4487 -27.4487 -27.3930 -27.3930 -10.3643 -10.3643 -10.3560 -10.3560 -10.3105 -10.3105 -10.2916 -10.2916 -9.3307 -9.3307 -9.3083 -9.3083 -9.2625 -9.2625 -9.2372 -9.2372 -9.2152 -9.2152 -9.1525 -9.1525 -9.1028 -9.1028 -9.0605 -9.0605 -7.9250 -7.9250 -4.6497 -4.6497 -4.5727 -4.5727 -4.4999 -4.4999 3.9545 3.9545 4.0247 4.0247 4.2088 4.2088 4.4970 4.4970 4.6633 4.6633 4.8498 4.8498 4.9133 4.9133 5.0717 5.0717 5.3030 5.3030 5.7259 5.7259 6.0045 6.0045 6.1016 6.1016 9.3680 9.3680 9.8464 9.8464 10.6850 10.6850 10.7482 10.7482 10.7722 10.7722 11.1256 11.1256 k = 0.2037 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4608 -27.4608 -27.4556 -27.4556 -27.4490 -27.4490 -27.3931 -27.3931 -10.3650 -10.3650 -10.3559 -10.3559 -10.3129 -10.3129 -10.2941 -10.2941 -9.3347 -9.3347 -9.3126 -9.3126 -9.2681 -9.2681 -9.2404 -9.2404 -9.2106 -9.2106 -9.1489 -9.1489 -9.1017 -9.1017 -9.0604 -9.0604 -7.9177 -7.9177 -4.6344 -4.6344 -4.5603 -4.5603 -4.4903 -4.4903 3.9369 3.9369 3.9932 3.9932 4.1848 4.1848 4.4704 4.4704 4.6686 4.6686 4.8361 4.8361 4.9108 4.9108 5.0225 5.0225 5.2774 5.2774 5.7285 5.7285 5.9796 5.9796 6.0908 6.0908 9.4483 9.4483 9.8960 9.8960 10.7096 10.7096 10.7855 10.7855 10.8210 10.8210 11.1506 11.1506 k = 0.2222 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4605 -27.4605 -27.4556 -27.4556 -27.4492 -27.4492 -27.3931 -27.3931 -10.3656 -10.3656 -10.3559 -10.3559 -10.3155 -10.3155 -10.2968 -10.2968 -9.3384 -9.3384 -9.3167 -9.3167 -9.2738 -9.2738 -9.2442 -9.2442 -9.2057 -9.2057 -9.1453 -9.1453 -9.1006 -9.1006 -9.0604 -9.0604 -7.9102 -7.9102 -4.6183 -4.6183 -4.5475 -4.5475 -4.4805 -4.4805 3.9164 3.9164 3.9606 3.9606 4.1623 4.1623 4.4414 4.4414 4.6746 4.6746 4.8219 4.8219 4.9081 4.9081 4.9753 4.9753 5.2510 5.2510 5.7306 5.7306 5.9544 5.9544 6.0800 6.0800 9.5345 9.5345 9.9477 9.9477 10.7370 10.7370 10.8242 10.8242 10.8733 10.8733 11.1718 11.1718 k = 0.2407 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4602 -27.4602 -27.4555 -27.4555 -27.4495 -27.4495 -27.3932 -27.3932 -10.3662 -10.3662 -10.3558 -10.3558 -10.3181 -10.3181 -10.2996 -10.2996 -9.3417 -9.3417 -9.3206 -9.3206 -9.2796 -9.2796 -9.2481 -9.2481 -9.2009 -9.2009 -9.1419 -9.1419 -9.0995 -9.0995 -9.0604 -9.0604 -7.9026 -7.9026 -4.6016 -4.6016 -4.5343 -4.5343 -4.4707 -4.4707 3.8932 3.8932 3.9272 3.9272 4.1419 4.1419 4.4100 4.4100 4.6814 4.6814 4.8075 4.8075 4.9043 4.9043 4.9320 4.9320 5.2240 5.2240 5.7320 5.7320 5.9295 5.9295 6.0692 6.0692 9.6261 9.6261 10.0006 10.0006 10.7675 10.7675 10.8643 10.8643 10.9283 10.9283 11.1879 11.1879 k = 0.2593 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4599 -27.4599 -27.4554 -27.4554 -27.4498 -27.4498 -27.3932 -27.3932 -10.3667 -10.3667 -10.3557 -10.3557 -10.3209 -10.3209 -10.3025 -10.3025 -9.3448 -9.3448 -9.3243 -9.3243 -9.2854 -9.2854 -9.2522 -9.2522 -9.1963 -9.1963 -9.1386 -9.1386 -9.0983 -9.0983 -9.0607 -9.0607 -7.8950 -7.8950 -4.5846 -4.5846 -4.5209 -4.5209 -4.4609 -4.4609 3.8675 3.8675 3.8937 3.8937 4.1236 4.1236 4.3764 4.3764 4.6889 4.6889 4.7931 4.7931 4.8857 4.8857 4.9070 4.9070 5.1967 5.1967 5.7329 5.7329 5.9051 5.9051 6.0585 6.0585 9.7229 9.7229 10.0540 10.0540 10.8012 10.8012 10.9056 10.9056 10.9855 10.9855 11.2029 11.2029 k = 0.2778 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4596 -27.4596 -27.4553 -27.4553 -27.4501 -27.4501 -27.3933 -27.3933 -10.3672 -10.3672 -10.3555 -10.3555 -10.3236 -10.3236 -10.3055 -10.3055 -9.3475 -9.3475 -9.3277 -9.3277 -9.2912 -9.2912 -9.2563 -9.2563 -9.1917 -9.1917 -9.1356 -9.1356 -9.0972 -9.0972 -9.0610 -9.0610 -7.8875 -7.8875 -4.5674 -4.5674 -4.5076 -4.5076 -4.4514 -4.4514 3.8400 3.8400 3.8605 3.8605 4.1077 4.1077 4.3410 4.3410 4.6972 4.6972 4.7791 4.7791 4.8505 4.8505 4.9026 4.9026 5.1691 5.1691 5.7333 5.7333 5.8815 5.8815 6.0481 6.0481 9.8243 9.8243 10.1071 10.1071 10.8381 10.8381 10.9475 10.9475 11.0443 11.0443 11.2178 11.2178 k = 0.2963 0.5000-0.0000 ( 7552 PWs) bands (ev): -27.4592 -27.4592 -27.4553 -27.4553 -27.4504 -27.4504 -27.3933 -27.3933 -10.3675 -10.3675 -10.3553 -10.3553 -10.3263 -10.3263 -10.3085 -10.3085 -9.3498 -9.3498 -9.3308 -9.3308 -9.2969 -9.2969 -9.2604 -9.2604 -9.1874 -9.1874 -9.1328 -9.1328 -9.0959 -9.0959 -9.0615 -9.0615 -7.8801 -7.8801 -4.5503 -4.5503 -4.4945 -4.4945 -4.4423 -4.4423 3.8113 3.8113 3.8281 3.8281 4.0938 4.0938 4.3043 4.3043 4.7060 4.7060 4.7656 4.7656 4.8180 4.8180 4.8998 4.8998 5.1415 5.1415 5.7333 5.7333 5.8590 5.8590 6.0381 6.0381 9.9300 9.9300 10.1589 10.1589 10.8783 10.8783 10.9895 10.9895 11.1041 11.1041 11.2328 11.2328 k = 0.3148 0.5000-0.0000 ( 7546 PWs) bands (ev): -27.4589 -27.4589 -27.4552 -27.4552 -27.4508 -27.4508 -27.3934 -27.3934 -10.3677 -10.3677 -10.3550 -10.3550 -10.3290 -10.3290 -10.3116 -10.3116 -9.3518 -9.3518 -9.3336 -9.3336 -9.3024 -9.3024 -9.2643 -9.2643 -9.1833 -9.1833 -9.1304 -9.1304 -9.0946 -9.0946 -9.0622 -9.0622 -7.8730 -7.8730 -4.5333 -4.5333 -4.4818 -4.4818 -4.4338 -4.4338 3.7823 3.7823 3.7971 3.7971 4.0817 4.0817 4.2672 4.2672 4.7151 4.7151 4.7533 4.7533 4.7895 4.7895 4.8973 4.8973 5.1141 5.1141 5.7331 5.7331 5.8378 5.8378 6.0286 6.0286 10.0395 10.0395 10.2086 10.2086 10.9214 10.9214 11.0310 11.0310 11.1644 11.1644 11.2476 11.2476 k = 0.3333 0.5000-0.0000 ( 7550 PWs) bands (ev): -27.4585 -27.4585 -27.4551 -27.4551 -27.4512 -27.4512 -27.3934 -27.3934 -10.3678 -10.3678 -10.3547 -10.3547 -10.3316 -10.3316 -10.3146 -10.3146 -9.3534 -9.3534 -9.3361 -9.3361 -9.3078 -9.3078 -9.2681 -9.2681 -9.1794 -9.1794 -9.1284 -9.1284 -9.0932 -9.0932 -9.0629 -9.0629 -7.8664 -7.8664 -4.5168 -4.5168 -4.4697 -4.4697 -4.4261 -4.4261 3.7537 3.7537 3.7677 3.7677 4.0712 4.0712 4.2304 4.2304 4.7225 4.7225 4.7443 4.7443 4.7649 4.7649 4.8949 4.8949 5.0870 5.0870 5.7326 5.7326 5.8182 5.8182 6.0198 6.0198 10.1524 10.1524 10.2554 10.2554 10.9670 10.9670 11.0715 11.0715 11.2238 11.2238 11.2623 11.2623 k = 0.3519 0.5000-0.0000 ( 7548 PWs) bands (ev): -27.4581 -27.4581 -27.4551 -27.4551 -27.4515 -27.4515 -27.3935 -27.3935 -10.3678 -10.3678 -10.3543 -10.3543 -10.3341 -10.3341 -10.3176 -10.3176 -9.3546 -9.3546 -9.3383 -9.3383 -9.3129 -9.3129 -9.2716 -9.2716 -9.1757 -9.1757 -9.1268 -9.1268 -9.0916 -9.0916 -9.0639 -9.0639 -7.8601 -7.8601 -4.5008 -4.5008 -4.4584 -4.4584 -4.4193 -4.4193 3.7264 3.7264 3.7404 3.7404 4.0620 4.0620 4.1949 4.1949 4.7213 4.7213 4.7438 4.7438 4.7457 4.7457 4.8928 4.8928 5.0603 5.0603 5.7318 5.7318 5.8002 5.8002 6.0116 6.0116 10.2680 10.2680 10.2986 10.2986 11.0142 11.0142 11.1105 11.1105 11.2713 11.2713 11.2867 11.2867 k = 0.3704 0.5000-0.0000 ( 7552 PWs) bands (ev): -27.4577 -27.4577 -27.4550 -27.4550 -27.4519 -27.4519 -27.3935 -27.3935 -10.3677 -10.3677 -10.3540 -10.3540 -10.3363 -10.3363 -10.3205 -10.3205 -9.3555 -9.3555 -9.3402 -9.3402 -9.3178 -9.3178 -9.2749 -9.2749 -9.1724 -9.1724 -9.1255 -9.1255 -9.0898 -9.0898 -9.0649 -9.0649 -7.8544 -7.8544 -4.4856 -4.4856 -4.4479 -4.4479 -4.4135 -4.4135 3.7008 3.7008 3.7156 3.7156 4.0539 4.0539 4.1616 4.1616 4.7132 4.7132 4.7262 4.7262 4.7559 4.7559 4.8908 4.8908 5.0341 5.0341 5.7310 5.7310 5.7841 5.7841 6.0042 6.0042 10.3376 10.3376 10.3859 10.3859 11.0618 11.0618 11.1474 11.1474 11.2856 11.2856 11.3402 11.3402 k = 0.3889 0.5000-0.0000 ( 7548 PWs) bands (ev): -27.4573 -27.4573 -27.4550 -27.4550 -27.4523 -27.4523 -27.3936 -27.3936 -10.3675 -10.3675 -10.3537 -10.3537 -10.3382 -10.3382 -10.3234 -10.3234 -9.3560 -9.3560 -9.3418 -9.3418 -9.3223 -9.3223 -9.2778 -9.2778 -9.1694 -9.1694 -9.1246 -9.1246 -9.0880 -9.0880 -9.0661 -9.0661 -7.8493 -7.8493 -4.4713 -4.4713 -4.4386 -4.4386 -4.4090 -4.4090 3.6775 3.6775 3.6936 3.6936 4.0466 4.0466 4.1314 4.1314 4.7046 4.7046 4.7115 4.7115 4.7687 4.7687 4.8890 4.8890 5.0086 5.0086 5.7300 5.7300 5.7700 5.7700 5.9976 5.9976 10.3721 10.3721 10.5047 10.5047 11.1081 11.1081 11.1814 11.1814 11.2958 11.2958 11.3920 11.3920 k = 0.4074 0.5000-0.0000 ( 7546 PWs) bands (ev): -27.4569 -27.4569 -27.4549 -27.4549 -27.4527 -27.4527 -27.3936 -27.3936 -10.3671 -10.3671 -10.3535 -10.3535 -10.3396 -10.3396 -10.3261 -10.3261 -9.3562 -9.3562 -9.3431 -9.3431 -9.3264 -9.3264 -9.2804 -9.2804 -9.1668 -9.1668 -9.1240 -9.1240 -9.0861 -9.0861 -9.0675 -9.0675 -7.8449 -7.8449 -4.4581 -4.4581 -4.4304 -4.4304 -4.4058 -4.4058 3.6571 3.6571 3.6745 3.6745 4.0399 4.0399 4.1053 4.1053 4.6969 4.6969 4.6995 4.6995 4.7828 4.7828 4.8875 4.8875 4.9838 4.9838 5.7289 5.7289 5.7581 5.7581 5.9920 5.9920 10.4018 10.4018 10.6234 10.6234 11.1512 11.1512 11.2120 11.2120 11.3029 11.3029 11.4386 11.4386 k = 0.4259 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4565 -27.4565 -27.4549 -27.4549 -27.4531 -27.4531 -27.3936 -27.3936 -10.3667 -10.3667 -10.3536 -10.3536 -10.3404 -10.3404 -10.3287 -10.3287 -9.3561 -9.3561 -9.3441 -9.3441 -9.3300 -9.3300 -9.2826 -9.2826 -9.1645 -9.1645 -9.1236 -9.1236 -9.0840 -9.0840 -9.0690 -9.0690 -7.8413 -7.8413 -4.4462 -4.4462 -4.4235 -4.4235 -4.4040 -4.4040 3.6399 3.6399 3.6587 3.6587 4.0335 4.0335 4.0841 4.0841 4.6900 4.6900 4.6903 4.6903 4.7981 4.7981 4.8862 4.8862 4.9599 4.9599 5.7277 5.7277 5.7486 5.7486 5.9873 5.9873 10.4263 10.4263 10.7401 10.7401 11.1889 11.1889 11.2385 11.2385 11.3057 11.3057 11.4786 11.4786 k = 0.4444 0.5000-0.0000 ( 7556 PWs) bands (ev): -27.4561 -27.4561 -27.4549 -27.4549 -27.4535 -27.4535 -27.3936 -27.3936 -10.3662 -10.3662 -10.3539 -10.3539 -10.3407 -10.3407 -10.3311 -10.3311 -9.3558 -9.3558 -9.3449 -9.3449 -9.3332 -9.3332 -9.2843 -9.2843 -9.1627 -9.1627 -9.1234 -9.1234 -9.0820 -9.0820 -9.0706 -9.0706 -7.8383 -7.8383 -4.4355 -4.4355 -4.4181 -4.4181 -4.4037 -4.4037 3.6262 3.6262 3.6462 3.6462 4.0271 4.0271 4.0685 4.0685 4.6828 4.6828 4.6850 4.6850 4.8143 4.8143 4.8852 4.8852 4.9369 4.9369 5.7261 5.7261 5.7416 5.7416 5.9836 5.9836 10.4455 10.4455 10.8517 10.8517 11.2196 11.2196 11.2600 11.2600 11.3025 11.3025 11.5107 11.5107 k = 0.4630 0.5000-0.0000 ( 7560 PWs) bands (ev): -27.4556 -27.4556 -27.4548 -27.4548 -27.4539 -27.4539 -27.3936 -27.3936 -10.3657 -10.3657 -10.3543 -10.3543 -10.3403 -10.3403 -10.3332 -10.3332 -9.3554 -9.3554 -9.3454 -9.3454 -9.3357 -9.3357 -9.2856 -9.2856 -9.1614 -9.1614 -9.1233 -9.1233 -9.0800 -9.0800 -9.0723 -9.0723 -7.8362 -7.8362 -4.4264 -4.4264 -4.4141 -4.4141 -4.4049 -4.4049 3.6162 3.6162 3.6372 3.6372 4.0212 4.0212 4.0584 4.0584 4.6777 4.6777 4.6812 4.6812 4.8312 4.8312 4.8844 4.8844 4.9151 4.9151 5.7243 5.7243 5.7373 5.7373 5.9810 5.9810 10.4594 10.4594 10.9527 10.9527 11.2419 11.2419 11.2755 11.2755 11.2919 11.2919 11.5338 11.5338 k = 0.4815 0.5000-0.0000 ( 7544 PWs) bands (ev): -27.4552 -27.4552 -27.4548 -27.4548 -27.4544 -27.4544 -27.3937 -27.3937 -10.3654 -10.3654 -10.3546 -10.3546 -10.3396 -10.3396 -10.3349 -10.3349 -9.3551 -9.3551 -9.3456 -9.3456 -9.3373 -9.3373 -9.2863 -9.2863 -9.1606 -9.1606 -9.1233 -9.1233 -9.0779 -9.0779 -9.0741 -9.0741 -7.8350 -7.8350 -4.4188 -4.4188 -4.4117 -4.4117 -4.4077 -4.4077 3.6101 3.6101 3.6318 3.6318 4.0169 4.0169 4.0531 4.0531 4.6747 4.6747 4.6789 4.6789 4.8480 4.8480 4.8840 4.8840 4.8954 4.8954 5.7228 5.7228 5.7351 5.7351 5.9794 5.9794 10.4677 10.4677 11.0319 11.0319 11.2548 11.2548 11.2725 11.2725 11.2873 11.2873 11.5472 11.5472 k = 0.5000 0.5000-0.0000 ( 7532 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3937 -27.3937 -10.3653 -10.3653 -10.3547 -10.3547 -10.3392 -10.3392 -10.3357 -10.3357 -9.3550 -9.3550 -9.3456 -9.3456 -9.3379 -9.3379 -9.2866 -9.2866 -9.1603 -9.1603 -9.1233 -9.1233 -9.0762 -9.0762 -9.0757 -9.0757 -7.8345 -7.8345 -4.4140 -4.4140 -4.4114 -4.4114 -4.4104 -4.4104 3.6081 3.6081 3.6300 3.6300 4.0153 4.0153 4.0514 4.0514 4.6737 4.6737 4.6782 4.6782 4.8586 4.8586 4.8838 4.8838 4.8839 4.8839 5.7222 5.7222 5.7344 5.7344 5.9789 5.9789 10.4705 10.4705 11.0654 11.0654 11.2557 11.2557 11.2650 11.2650 11.2902 11.2902 11.5512 11.5512 k = 0.5000 0.5000-0.0000 ( 7532 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3937 -27.3937 -10.3653 -10.3653 -10.3547 -10.3547 -10.3392 -10.3392 -10.3357 -10.3357 -9.3550 -9.3550 -9.3456 -9.3456 -9.3379 -9.3379 -9.2866 -9.2866 -9.1603 -9.1603 -9.1233 -9.1233 -9.0762 -9.0762 -9.0757 -9.0757 -7.8345 -7.8345 -4.4140 -4.4140 -4.4114 -4.4114 -4.4104 -4.4104 3.6081 3.6081 3.6300 3.6300 4.0153 4.0153 4.0514 4.0514 4.6737 4.6737 4.6782 4.6782 4.8586 4.8586 4.8838 4.8838 4.8839 4.8839 5.7222 5.7222 5.7344 5.7344 5.9789 5.9789 10.4705 10.4705 11.0654 11.0654 11.2557 11.2557 11.2650 11.2650 11.2902 11.2902 11.5512 11.5512 k = 0.4868 0.4868-0.0000 ( 7544 PWs) bands (ev): -27.4552 -27.4552 -27.4548 -27.4548 -27.4544 -27.4544 -27.3937 -27.3937 -10.3654 -10.3654 -10.3546 -10.3546 -10.3396 -10.3396 -10.3349 -10.3349 -9.3551 -9.3551 -9.3456 -9.3456 -9.3373 -9.3373 -9.2863 -9.2863 -9.1606 -9.1606 -9.1233 -9.1233 -9.0780 -9.0780 -9.0740 -9.0740 -7.8350 -7.8350 -4.4189 -4.4189 -4.4116 -4.4116 -4.4078 -4.4078 3.6102 3.6102 3.6318 3.6318 4.0169 4.0169 4.0530 4.0530 4.6747 4.6747 4.6790 4.6790 4.8478 4.8478 4.8844 4.8844 4.8951 4.8951 5.7228 5.7228 5.7351 5.7351 5.9794 5.9794 10.4677 10.4677 11.0335 11.0335 11.2359 11.2359 11.2837 11.2837 11.2937 11.2937 11.5435 11.5435 k = 0.4737 0.4737-0.0000 ( 7558 PWs) bands (ev): -27.4557 -27.4557 -27.4548 -27.4548 -27.4540 -27.4540 -27.3936 -27.3936 -10.3658 -10.3658 -10.3542 -10.3542 -10.3405 -10.3405 -10.3331 -10.3331 -9.3555 -9.3555 -9.3453 -9.3453 -9.3357 -9.3357 -9.2855 -9.2855 -9.1614 -9.1614 -9.1233 -9.1233 -9.0800 -9.0800 -9.0722 -9.0722 -7.8363 -7.8363 -4.4268 -4.4268 -4.4135 -4.4135 -4.4053 -4.4053 3.6161 3.6161 3.6375 3.6375 4.0218 4.0218 4.0580 4.0580 4.6773 4.6773 4.6817 4.6817 4.8304 4.8304 4.8862 4.8862 4.9142 4.9142 5.7246 5.7246 5.7370 5.7370 5.9810 5.9810 10.4590 10.4590 10.9665 10.9665 11.1721 11.1721 11.2751 11.2751 11.3538 11.3538 11.5161 11.5161 k = 0.4605 0.4605-0.0000 ( 7558 PWs) bands (ev): -27.4562 -27.4562 -27.4547 -27.4547 -27.4536 -27.4536 -27.3936 -27.3936 -10.3662 -10.3662 -10.3536 -10.3536 -10.3413 -10.3413 -10.3306 -10.3306 -9.3559 -9.3559 -9.3448 -9.3448 -9.3333 -9.3333 -9.2842 -9.2842 -9.1627 -9.1627 -9.1234 -9.1234 -9.0822 -9.0822 -9.0704 -9.0704 -7.8384 -7.8384 -4.4365 -4.4365 -4.4167 -4.4167 -4.4044 -4.4044 3.6256 3.6256 3.6474 3.6474 4.0296 4.0296 4.0664 4.0664 4.6808 4.6808 4.6870 4.6870 4.8125 4.8125 4.8891 4.8891 4.9349 4.9349 5.7275 5.7275 5.7404 5.7404 5.9837 5.9837 10.4441 10.4441 10.8897 10.8897 11.0839 11.0839 11.2577 11.2577 11.4239 11.4239 11.4717 11.4717 k = 0.4474 0.4474-0.0000 ( 7556 PWs) bands (ev): -27.4566 -27.4566 -27.4546 -27.4546 -27.4532 -27.4532 -27.3936 -27.3936 -10.3667 -10.3667 -10.3530 -10.3530 -10.3419 -10.3419 -10.3277 -10.3277 -9.3562 -9.3562 -9.3439 -9.3439 -9.3304 -9.3304 -9.2823 -9.2823 -9.1645 -9.1645 -9.1236 -9.1236 -9.0845 -9.0845 -9.0685 -9.0685 -7.8414 -7.8414 -4.4479 -4.4479 -4.4212 -4.4212 -4.4053 -4.4053 3.6378 3.6378 3.6620 3.6620 4.0401 4.0401 4.0786 4.0786 4.6851 4.6851 4.6952 4.6952 4.7950 4.7950 4.8931 4.8931 4.9563 4.9563 5.7311 5.7311 5.7455 5.7455 5.9874 5.9874 10.4217 10.4217 10.8120 10.8120 10.9827 10.9827 11.2325 11.2325 11.4102 11.4102 11.4971 11.4971 k = 0.4342 0.4342-0.0000 ( 7558 PWs) bands (ev): -27.4572 -27.4572 -27.4545 -27.4545 -27.4528 -27.4528 -27.3936 -27.3936 -10.3671 -10.3671 -10.3522 -10.3522 -10.3424 -10.3424 -10.3244 -10.3244 -9.3563 -9.3563 -9.3427 -9.3427 -9.3271 -9.3271 -9.2799 -9.2799 -9.1666 -9.1666 -9.1239 -9.1239 -9.0869 -9.0869 -9.0667 -9.0667 -7.8452 -7.8452 -4.4610 -4.4610 -4.4269 -4.4269 -4.4079 -4.4079 3.6524 3.6524 3.6819 3.6819 4.0528 4.0528 4.0949 4.0949 4.6903 4.6903 4.7058 4.7058 4.7781 4.7781 4.8983 4.8983 4.9783 4.9783 5.7354 5.7354 5.7524 5.7524 5.9922 5.9922 10.3902 10.3902 10.7380 10.7380 10.8745 10.8745 11.1989 11.1989 11.3362 11.3362 11.5687 11.5687 k = 0.4211 0.4211-0.0000 ( 7556 PWs) bands (ev): -27.4577 -27.4577 -27.4544 -27.4544 -27.4525 -27.4525 -27.3935 -27.3935 -10.3675 -10.3675 -10.3515 -10.3515 -10.3428 -10.3428 -10.3207 -10.3207 -9.3561 -9.3561 -9.3412 -9.3412 -9.3235 -9.3235 -9.2767 -9.2767 -9.1691 -9.1691 -9.1243 -9.1243 -9.0895 -9.0895 -9.0649 -9.0649 -7.8499 -7.8499 -4.4757 -4.4757 -4.4338 -4.4338 -4.4122 -4.4122 3.6691 3.6691 3.7070 3.7070 4.0672 4.0672 4.1153 4.1153 4.6965 4.6965 4.7188 4.7188 4.7619 4.7619 4.9046 4.9046 5.0008 5.0008 5.7403 5.7403 5.7611 5.7611 5.9979 5.9979 10.3473 10.3473 10.6720 10.6720 10.7628 10.7628 11.1552 11.1552 11.2521 11.2521 11.6165 11.6165 k = 0.4079 0.4079-0.0000 ( 7556 PWs) bands (ev): -27.4582 -27.4582 -27.4543 -27.4543 -27.4522 -27.4522 -27.3935 -27.3935 -10.3677 -10.3677 -10.3508 -10.3508 -10.3431 -10.3431 -10.3166 -10.3166 -9.3556 -9.3556 -9.3395 -9.3395 -9.3197 -9.3197 -9.2730 -9.2730 -9.1718 -9.1718 -9.1249 -9.1249 -9.0922 -9.0922 -9.0630 -9.0630 -7.8553 -7.8553 -4.4920 -4.4920 -4.4418 -4.4418 -4.4180 -4.4180 3.6880 3.6880 3.7371 3.7371 4.0832 4.0832 4.1400 4.1400 4.7037 4.7037 4.7328 4.7328 4.7479 4.7479 4.9121 4.9121 5.0237 5.0237 5.7459 5.7459 5.7715 5.7715 6.0046 6.0046 10.2915 10.2915 10.6166 10.6166 10.6495 10.6495 11.0950 11.0950 11.1670 11.1670 11.6402 11.6402 k = 0.3947 0.3947-0.0000 ( 7556 PWs) bands (ev): -27.4588 -27.4588 -27.4541 -27.4541 -27.4519 -27.4519 -27.3935 -27.3935 -10.3677 -10.3677 -10.3502 -10.3502 -10.3433 -10.3433 -10.3121 -10.3121 -9.3547 -9.3547 -9.3375 -9.3375 -9.3158 -9.3158 -9.2685 -9.2685 -9.1747 -9.1747 -9.1257 -9.1257 -9.0950 -9.0950 -9.0611 -9.0611 -7.8615 -7.8615 -4.5097 -4.5097 -4.4509 -4.4509 -4.4254 -4.4254 3.7092 3.7092 3.7718 3.7718 4.1006 4.1006 4.1688 4.1688 4.7108 4.7108 4.7309 4.7309 4.7541 4.7541 4.9206 4.9206 5.0470 5.0470 5.7521 5.7521 5.7836 5.7836 6.0121 6.0121 10.2235 10.2235 10.5352 10.5352 10.5729 10.5729 11.0076 11.0076 11.0945 11.0945 11.6103 11.6103 k = 0.3816 0.3816-0.0000 ( 7543 PWs) bands (ev): -27.4594 -27.4594 -27.4539 -27.4539 -27.4516 -27.4516 -27.3934 -27.3934 -10.3676 -10.3676 -10.3495 -10.3495 -10.3434 -10.3434 -10.3074 -10.3074 -9.3535 -9.3535 -9.3354 -9.3354 -9.3119 -9.3119 -9.2634 -9.2634 -9.1778 -9.1778 -9.1266 -9.1266 -9.0979 -9.0979 -9.0592 -9.0592 -7.8685 -7.8685 -4.5287 -4.5287 -4.4610 -4.4610 -4.4342 -4.4342 3.7327 3.7327 3.8110 3.8110 4.1193 4.1193 4.2015 4.2015 4.7099 4.7099 4.7280 4.7280 4.7734 4.7734 4.9301 4.9301 5.0706 5.0706 5.7591 5.7591 5.7972 5.7972 6.0206 6.0206 10.1460 10.1460 10.4217 10.4217 10.5382 10.5382 10.8999 10.8999 11.0310 11.0310 11.5459 11.5459 k = 0.3684 0.3684-0.0000 ( 7559 PWs) bands (ev): -27.4599 -27.4599 -27.4537 -27.4537 -27.4513 -27.4513 -27.3934 -27.3934 -10.3674 -10.3674 -10.3490 -10.3490 -10.3435 -10.3435 -10.3024 -10.3024 -9.3520 -9.3520 -9.3331 -9.3331 -9.3078 -9.3078 -9.2576 -9.2576 -9.1809 -9.1809 -9.1277 -9.1277 -9.1010 -9.1010 -9.0573 -9.0573 -7.8762 -7.8762 -4.5490 -4.5490 -4.4721 -4.4721 -4.4443 -4.4443 3.7583 3.7583 3.8544 3.8544 4.1392 4.1392 4.2378 4.2378 4.6983 4.6983 4.7373 4.7373 4.7954 4.7954 4.9407 4.9407 5.0944 5.0944 5.7670 5.7670 5.8123 5.8123 6.0298 6.0298 10.0620 10.0620 10.3088 10.3088 10.5109 10.5109 10.7830 10.7830 10.9678 10.9678 11.4827 11.4827 k = 0.3553 0.3553-0.0000 ( 7561 PWs) bands (ev): -27.4605 -27.4605 -27.4535 -27.4535 -27.4510 -27.4510 -27.3933 -27.3933 -10.3670 -10.3670 -10.3484 -10.3484 -10.3436 -10.3436 -10.2972 -10.2972 -9.3501 -9.3501 -9.3307 -9.3307 -9.3037 -9.3037 -9.2511 -9.2511 -9.1841 -9.1841 -9.1289 -9.1289 -9.1040 -9.1040 -9.0554 -9.0554 -7.8845 -7.8845 -4.5704 -4.5704 -4.4841 -4.4841 -4.4557 -4.4557 3.7860 3.7860 3.9019 3.9019 4.1600 4.1600 4.2776 4.2776 4.6855 4.6855 4.7498 4.7498 4.8195 4.8195 4.9523 4.9523 5.1185 5.1185 5.7757 5.7757 5.8286 5.8286 6.0397 6.0397 9.9743 9.9743 10.1971 10.1971 10.4887 10.4887 10.6618 10.6618 10.9025 10.9025 11.4211 11.4211 k = 0.3421 0.3421-0.0000 ( 7553 PWs) bands (ev): -27.4611 -27.4611 -27.4532 -27.4532 -27.4507 -27.4507 -27.3932 -27.3932 -10.3664 -10.3664 -10.3479 -10.3479 -10.3437 -10.3437 -10.2918 -10.2918 -9.3480 -9.3480 -9.3283 -9.3283 -9.2995 -9.2995 -9.2441 -9.2441 -9.1872 -9.1872 -9.1302 -9.1302 -9.1072 -9.1072 -9.0534 -9.0534 -7.8935 -7.8935 -4.5929 -4.5929 -4.4968 -4.4968 -4.4682 -4.4682 3.8157 3.8157 3.9531 3.9531 4.1817 4.1817 4.3206 4.3206 4.6730 4.6730 4.7641 4.7641 4.8457 4.8457 4.9648 4.9648 5.1428 5.1428 5.7854 5.7854 5.8462 5.8462 6.0503 6.0503 9.8847 9.8847 10.0870 10.0870 10.4705 10.4705 10.5383 10.5383 10.8350 10.8350 11.3612 11.3612 k = 0.3289 0.3289-0.0000 ( 7563 PWs) bands (ev): -27.4618 -27.4618 -27.4530 -27.4530 -27.4505 -27.4505 -27.3932 -27.3932 -10.3658 -10.3658 -10.3474 -10.3474 -10.3437 -10.3437 -10.2863 -10.2863 -9.3455 -9.3455 -9.3259 -9.3259 -9.2951 -9.2951 -9.2367 -9.2367 -9.1901 -9.1901 -9.1315 -9.1315 -9.1103 -9.1103 -9.0515 -9.0515 -7.9031 -7.9031 -4.6162 -4.6162 -4.5103 -4.5103 -4.4817 -4.4817 3.8472 3.8472 4.0078 4.0078 4.2040 4.2040 4.3665 4.3665 4.6609 4.6609 4.7801 4.7801 4.8737 4.8737 4.9783 4.9783 5.1672 5.1672 5.7960 5.7960 5.8648 5.8648 6.0615 6.0615 9.7945 9.7945 9.9787 9.9787 10.4140 10.4140 10.4558 10.4558 10.7651 10.7651 11.3031 11.3031 k = 0.3158 0.3158-0.0000 ( 7561 PWs) bands (ev): -27.4624 -27.4624 -27.4527 -27.4527 -27.4503 -27.4503 -27.3931 -27.3931 -10.3650 -10.3650 -10.3470 -10.3470 -10.3437 -10.3437 -10.2806 -10.2806 -9.3428 -9.3428 -9.3235 -9.3235 -9.2906 -9.2906 -9.2290 -9.2290 -9.1928 -9.1928 -9.1329 -9.1329 -9.1134 -9.1134 -9.0496 -9.0496 -7.9133 -7.9133 -4.6403 -4.6403 -4.5243 -4.5243 -4.4961 -4.4961 3.8803 3.8803 4.0658 4.0658 4.2266 4.2266 4.4152 4.4152 4.6495 4.6495 4.7977 4.7977 4.9034 4.9034 4.9926 4.9926 5.1917 5.1917 5.8076 5.8076 5.8844 5.8844 6.0731 6.0731 9.7045 9.7045 9.8724 9.8724 10.2900 10.2900 10.4436 10.4436 10.6933 10.6933 11.2469 11.2469 k = 0.3026 0.3026-0.0000 ( 7561 PWs) bands (ev): -27.4630 -27.4630 -27.4524 -27.4524 -27.4500 -27.4500 -27.3930 -27.3930 -10.3641 -10.3641 -10.3466 -10.3466 -10.3438 -10.3438 -10.2749 -10.2749 -9.3400 -9.3400 -9.3212 -9.3212 -9.2859 -9.2859 -9.2214 -9.2214 -9.1947 -9.1947 -9.1343 -9.1343 -9.1163 -9.1163 -9.0477 -9.0477 -7.9240 -7.9240 -4.6649 -4.6649 -4.5389 -4.5389 -4.5114 -4.5114 3.9149 3.9149 4.1267 4.1267 4.2494 4.2494 4.4663 4.4663 4.6386 4.6386 4.8169 4.8169 4.9347 4.9347 5.0078 5.0078 5.2162 5.2162 5.8203 5.8203 5.9049 5.9049 6.0852 6.0852 9.6154 9.6154 9.7685 9.7685 10.1670 10.1670 10.4341 10.4341 10.6198 10.6198 11.1926 11.1926 k = 0.2895 0.2895-0.0000 ( 7545 PWs) bands (ev): -27.4636 -27.4636 -27.4522 -27.4522 -27.4498 -27.4498 -27.3929 -27.3929 -10.3632 -10.3632 -10.3463 -10.3463 -10.3439 -10.3439 -10.2692 -10.2692 -9.3370 -9.3370 -9.3191 -9.3191 -9.2810 -9.2810 -9.2149 -9.2149 -9.1951 -9.1951 -9.1355 -9.1355 -9.1192 -9.1192 -9.0459 -9.0459 -7.9352 -7.9352 -4.6901 -4.6901 -4.5539 -4.5539 -4.5272 -4.5272 3.9506 3.9506 4.1903 4.1903 4.2722 4.2722 4.5197 4.5197 4.6283 4.6283 4.8378 4.8378 4.9674 4.9674 5.0238 5.0238 5.2408 5.2408 5.8341 5.8341 5.9261 5.9261 6.0976 6.0976 9.5276 9.5276 9.6671 9.6671 10.0455 10.0455 10.4270 10.4270 10.5447 10.5447 11.1404 11.1404 k = 0.2763 0.2763-0.0000 ( 7543 PWs) bands (ev): -27.4642 -27.4642 -27.4519 -27.4519 -27.4496 -27.4496 -27.3928 -27.3928 -10.3622 -10.3622 -10.3460 -10.3460 -10.3439 -10.3439 -10.2634 -10.2634 -9.3339 -9.3339 -9.3171 -9.3171 -9.2759 -9.2759 -9.2113 -9.2113 -9.1922 -9.1922 -9.1367 -9.1367 -9.1218 -9.1218 -9.0441 -9.0441 -7.9467 -7.9467 -4.7155 -4.7155 -4.5693 -4.5693 -4.5436 -4.5436 3.9873 3.9873 4.2556 4.2556 4.2952 4.2952 4.5751 4.5751 4.6187 4.6187 4.8603 4.8603 5.0011 5.0011 5.0407 5.0407 5.2652 5.2652 5.8491 5.8491 5.9479 5.9479 6.1103 6.1103 9.4415 9.4415 9.5683 9.5683 9.9260 9.9260 10.4222 10.4222 10.4685 10.4685 11.0903 11.0903 k = 0.2632 0.2632-0.0000 ( 7541 PWs) bands (ev): -27.4649 -27.4649 -27.4516 -27.4516 -27.4494 -27.4494 -27.3927 -27.3927 -10.3612 -10.3612 -10.3457 -10.3457 -10.3441 -10.3441 -10.2577 -10.2577 -9.3308 -9.3308 -9.3153 -9.3153 -9.2706 -9.2706 -9.2108 -9.2108 -9.1859 -9.1859 -9.1378 -9.1378 -9.1240 -9.1240 -9.0424 -9.0424 -7.9586 -7.9586 -4.7412 -4.7412 -4.5848 -4.5848 -4.5604 -4.5604 4.0246 4.0246 4.3111 4.3111 4.3296 4.3296 4.6093 4.6093 4.6325 4.6325 4.8842 4.8842 5.0353 5.0353 5.0590 5.0590 5.2895 5.2895 5.8652 5.8652 5.9701 5.9701 6.1231 6.1231 9.3575 9.3575 9.4724 9.4724 9.8090 9.8090 10.3906 10.3906 10.4200 10.4200 11.0423 11.0423 k = 0.2500 0.2500-0.0000 ( 7549 PWs) bands (ev): -27.4655 -27.4655 -27.4513 -27.4513 -27.4493 -27.4493 -27.3927 -27.3927 -10.3601 -10.3601 -10.3455 -10.3455 -10.3442 -10.3442 -10.2520 -10.2520 -9.3278 -9.3278 -9.3137 -9.3137 -9.2652 -9.2652 -9.2118 -9.2118 -9.1779 -9.1779 -9.1387 -9.1387 -9.1258 -9.1258 -9.0407 -9.0407 -7.9708 -7.9708 -4.7668 -4.7668 -4.6005 -4.6005 -4.5774 -4.5774 4.0625 4.0625 4.3351 4.3351 4.3961 4.3961 4.6009 4.6009 4.6909 4.6909 4.9095 4.9095 5.0665 5.0665 5.0818 5.0818 5.3137 5.3137 5.8826 5.8826 5.9927 5.9927 6.1360 6.1360 9.2757 9.2757 9.3795 9.3795 9.6948 9.6948 10.3126 10.3126 10.4194 10.4194 10.9965 10.9965 k = 0.2368 0.2368-0.0000 ( 7533 PWs) bands (ev): -27.4661 -27.4661 -27.4510 -27.4510 -27.4491 -27.4491 -27.3926 -27.3926 -10.3590 -10.3590 -10.3454 -10.3454 -10.3444 -10.3444 -10.2465 -10.2465 -9.3249 -9.3249 -9.3124 -9.3124 -9.2597 -9.2597 -9.2131 -9.2131 -9.1698 -9.1698 -9.1394 -9.1394 -9.1266 -9.1266 -9.0391 -9.0391 -7.9831 -7.9831 -4.7923 -4.7923 -4.6161 -4.6161 -4.5945 -4.5945 4.1004 4.1004 4.3556 4.3556 4.4666 4.4666 4.5930 4.5930 4.7506 4.7506 4.9360 4.9360 5.0892 5.0892 5.1143 5.1143 5.3376 5.3376 5.9012 5.9012 6.0155 6.0155 6.1488 6.1488 9.1965 9.1965 9.2898 9.2898 9.5835 9.5835 10.2336 10.2336 10.4210 10.4210 10.9528 10.9528 k = 0.2237 0.2237-0.0000 ( 7537 PWs) bands (ev): -27.4666 -27.4666 -27.4507 -27.4507 -27.4489 -27.4489 -27.3925 -27.3925 -10.3579 -10.3579 -10.3453 -10.3453 -10.3446 -10.3446 -10.2410 -10.2410 -9.3221 -9.3221 -9.3112 -9.3112 -9.2542 -9.2542 -9.2143 -9.2143 -9.1624 -9.1624 -9.1399 -9.1399 -9.1260 -9.1260 -9.0376 -9.0376 -7.9956 -7.9956 -4.8175 -4.8175 -4.6317 -4.6317 -4.6117 -4.6117 4.1383 4.1383 4.3748 4.3748 4.5380 4.5380 4.5857 4.5857 4.8112 4.8112 4.9636 4.9636 5.1088 5.1088 5.1509 5.1509 5.3611 5.3611 5.9211 5.9211 6.0383 6.0383 6.1616 6.1616 9.1201 9.1201 9.2035 9.2035 9.4756 9.4756 10.1543 10.1543 10.4244 10.4244 10.9114 10.9114 k = 0.2105 0.2105-0.0000 ( 7537 PWs) bands (ev): -27.4672 -27.4672 -27.4504 -27.4504 -27.4488 -27.4488 -27.3924 -27.3924 -10.3569 -10.3569 -10.3453 -10.3453 -10.3448 -10.3448 -10.2358 -10.2358 -9.3196 -9.3196 -9.3103 -9.3103 -9.2488 -9.2488 -9.2153 -9.2153 -9.1566 -9.1566 -9.1402 -9.1402 -9.1233 -9.1233 -9.0362 -9.0362 -8.0082 -8.0082 -4.8423 -4.8423 -4.6470 -4.6470 -4.6286 -4.6286 4.1758 4.1758 4.3928 4.3928 4.5785 4.5785 4.6101 4.6101 4.8723 4.8723 4.9918 4.9918 5.1279 5.1279 5.1885 5.1885 5.3843 5.3843 5.9423 5.9423 6.0609 6.0609 6.1741 6.1741 9.0466 9.0466 9.1207 9.1207 9.3712 9.3712 10.0747 10.0747 10.4297 10.4297 10.8722 10.8722 k = 0.1974 0.1974-0.0000 ( 7535 PWs) bands (ev): -27.4678 -27.4678 -27.4502 -27.4502 -27.4487 -27.4487 -27.3923 -27.3923 -10.3558 -10.3558 -10.3453 -10.3453 -10.3450 -10.3450 -10.2307 -10.2307 -9.3173 -9.3173 -9.3096 -9.3096 -9.2435 -9.2435 -9.2160 -9.2160 -9.1530 -9.1530 -9.1404 -9.1404 -9.1181 -9.1181 -9.0348 -9.0348 -8.0207 -8.0207 -4.8665 -4.8665 -4.6620 -4.6620 -4.6454 -4.6454 4.2126 4.2126 4.4096 4.4096 4.5724 4.5724 4.6812 4.6812 4.9336 4.9336 5.0205 5.0205 5.1471 5.1471 5.2264 5.2264 5.4070 5.4070 5.9648 5.9648 6.0834 6.0834 6.1864 6.1864 8.9763 8.9763 9.0416 9.0416 9.2706 9.2706 9.9952 9.9952 10.4365 10.4365 10.8353 10.8353 k = 0.1842 0.1842-0.0000 ( 7523 PWs) bands (ev): -27.4683 -27.4683 -27.4499 -27.4499 -27.4485 -27.4485 -27.3922 -27.3922 -10.3549 -10.3549 -10.3455 -10.3455 -10.3451 -10.3451 -10.2258 -10.2258 -9.3154 -9.3154 -9.3090 -9.3090 -9.2384 -9.2384 -9.2164 -9.2164 -9.1510 -9.1510 -9.1403 -9.1403 -9.1108 -9.1108 -9.0335 -9.0335 -8.0331 -8.0331 -4.8899 -4.8899 -4.6766 -4.6766 -4.6617 -4.6617 4.2485 4.2485 4.4253 4.4253 4.5666 4.5666 4.7514 4.7514 4.9947 4.9947 5.0494 5.0494 5.1664 5.1664 5.2642 5.2642 5.4291 5.4291 5.9886 5.9886 6.1053 6.1053 6.1984 6.1984 8.9093 8.9093 8.9664 8.9664 9.1740 9.1740 9.9161 9.9161 10.4448 10.4448 10.8007 10.8007 k = 0.1711 0.1711-0.0000 ( 7529 PWs) bands (ev): -27.4688 -27.4688 -27.4496 -27.4496 -27.4484 -27.4484 -27.3921 -27.3921 -10.3539 -10.3539 -10.3457 -10.3457 -10.3452 -10.3452 -10.2212 -10.2212 -9.3137 -9.3137 -9.3087 -9.3087 -9.2337 -9.2337 -9.2164 -9.2164 -9.1499 -9.1499 -9.1401 -9.1401 -9.1023 -9.1023 -9.0323 -9.0323 -8.0452 -8.0452 -4.9125 -4.9125 -4.6907 -4.6907 -4.6775 -4.6775 4.2831 4.2831 4.4397 4.4397 4.5613 4.5613 4.8198 4.8198 5.0550 5.0550 5.0782 5.0782 5.1858 5.1858 5.3016 5.3016 5.4507 5.4507 6.0135 6.0135 6.1267 6.1267 6.2099 6.2099 8.8458 8.8458 8.8953 8.8953 9.0817 9.0817 9.8378 9.8378 10.4542 10.4542 10.7684 10.7684 k = 0.1579 0.1579-0.0000 ( 7517 PWs) bands (ev): -27.4693 -27.4693 -27.4494 -27.4494 -27.4483 -27.4483 -27.3920 -27.3920 -10.3530 -10.3530 -10.3460 -10.3460 -10.3453 -10.3453 -10.2169 -10.2169 -9.3124 -9.3124 -9.3085 -9.3085 -9.2294 -9.2294 -9.2160 -9.2160 -9.1491 -9.1491 -9.1398 -9.1398 -9.0933 -9.0933 -9.0311 -9.0311 -8.0571 -8.0571 -4.9340 -4.9340 -4.7042 -4.7042 -4.6926 -4.6926 4.3161 4.3161 4.4530 4.4530 4.5565 4.5565 4.8856 4.8856 5.1045 5.1045 5.1160 5.1160 5.2056 5.2056 5.3381 5.3381 5.4715 5.4715 6.0394 6.0394 6.1474 6.1474 6.2210 6.2210 8.7861 8.7861 8.8284 8.8284 8.9938 8.9938 9.7606 9.7606 10.4646 10.4646 10.7384 10.7384 k = 0.1447 0.1447-0.0000 ( 7521 PWs) bands (ev): -27.4697 -27.4697 -27.4491 -27.4491 -27.4482 -27.4482 -27.3919 -27.3919 -10.3522 -10.3522 -10.3463 -10.3463 -10.3454 -10.3454 -10.2128 -10.2128 -9.3114 -9.3114 -9.3084 -9.3084 -9.2257 -9.2257 -9.2154 -9.2154 -9.1482 -9.1482 -9.1393 -9.1393 -9.0842 -9.0842 -9.0301 -9.0301 -8.0685 -8.0685 -4.9544 -4.9544 -4.7170 -4.7170 -4.7070 -4.7070 4.3474 4.3474 4.4652 4.4652 4.5523 4.5523 4.9481 4.9481 5.1322 5.1322 5.1716 5.1716 5.2268 5.2268 5.3736 5.3736 5.4915 5.4915 6.0662 6.0662 6.1671 6.1671 6.2316 6.2316 8.7303 8.7303 8.7660 8.7660 8.9106 8.9106 9.6852 9.6852 10.4756 10.4756 10.7107 10.7107 k = 0.1316 0.1316-0.0000 ( 7519 PWs) bands (ev): -27.4702 -27.4702 -27.4489 -27.4489 -27.4481 -27.4481 -27.3919 -27.3919 -10.3515 -10.3515 -10.3466 -10.3466 -10.3455 -10.3455 -10.2090 -10.2090 -9.3107 -9.3107 -9.3084 -9.3084 -9.2224 -9.2224 -9.2145 -9.2145 -9.1471 -9.1471 -9.1387 -9.1387 -9.0752 -9.0752 -9.0291 -9.0291 -8.0795 -8.0795 -4.9735 -4.9735 -4.7290 -4.7290 -4.7206 -4.7206 4.3766 4.3766 4.4762 4.4762 4.5485 4.5485 5.0066 5.0066 5.1579 5.1579 5.2196 5.2196 5.2545 5.2545 5.4077 5.4077 5.5107 5.5107 6.0934 6.0934 6.1859 6.1859 6.2417 6.2417 8.6785 8.6785 8.7081 8.7081 8.8325 8.8325 9.6120 9.6120 10.4871 10.4871 10.6855 10.6855 k = 0.1184 0.1184-0.0000 ( 7527 PWs) bands (ev): -27.4705 -27.4705 -27.4487 -27.4487 -27.4481 -27.4481 -27.3918 -27.3918 -10.3509 -10.3509 -10.3468 -10.3468 -10.3457 -10.3457 -10.2055 -10.2055 -9.3102 -9.3102 -9.3085 -9.3085 -9.2197 -9.2197 -9.2135 -9.2135 -9.1458 -9.1458 -9.1381 -9.1381 -9.0666 -9.0666 -9.0283 -9.0283 -8.0898 -8.0898 -4.9911 -4.9911 -4.7401 -4.7401 -4.7331 -4.7331 4.4036 4.4036 4.4861 4.4861 4.5453 4.5453 5.0604 5.0604 5.1816 5.1816 5.2496 5.2496 5.2974 5.2974 5.4402 5.4402 5.5289 5.5289 6.1208 6.1208 6.2034 6.2034 6.2511 6.2511 8.6310 8.6310 8.6551 8.6551 8.7599 8.7599 9.5419 9.5419 10.4986 10.4986 10.6625 10.6625 k = 0.1053 0.1053-0.0000 ( 7531 PWs) bands (ev): -27.4709 -27.4709 -27.4485 -27.4485 -27.4480 -27.4480 -27.3917 -27.3917 -10.3504 -10.3504 -10.3470 -10.3470 -10.3458 -10.3458 -10.2024 -10.2024 -9.3099 -9.3099 -9.3087 -9.3087 -9.2174 -9.2174 -9.2125 -9.2125 -9.1442 -9.1442 -9.1374 -9.1374 -9.0585 -9.0585 -9.0275 -9.0275 -8.0994 -8.0994 -5.0073 -5.0073 -4.7502 -4.7502 -4.7446 -4.7446 4.4279 4.4279 4.4950 4.4950 4.5426 4.5426 5.1089 5.1089 5.2033 5.2033 5.2706 5.2706 5.3455 5.3455 5.4709 5.4709 5.5462 5.5462 6.1478 6.1478 6.2196 6.2196 6.2600 6.2600 8.5879 8.5879 8.6071 8.6071 8.6930 8.6930 9.4755 9.4755 10.5100 10.5100 10.6420 10.6420 k = 0.0921 0.0921-0.0000 ( 7545 PWs) bands (ev): -27.4712 -27.4712 -27.4483 -27.4483 -27.4480 -27.4480 -27.3917 -27.3917 -10.3500 -10.3500 -10.3471 -10.3471 -10.3460 -10.3460 -10.1996 -10.1996 -9.3097 -9.3097 -9.3089 -9.3089 -9.2155 -9.2155 -9.2116 -9.2116 -9.1424 -9.1424 -9.1367 -9.1367 -9.0510 -9.0510 -9.0268 -9.0268 -8.1082 -8.1082 -5.0218 -5.0218 -4.7593 -4.7593 -4.7550 -4.7550 4.4494 4.4494 4.5030 4.5030 4.5405 4.5405 5.1517 5.1517 5.2225 5.2225 5.2891 5.2891 5.3912 5.3912 5.4998 5.4998 5.5623 5.5623 6.1737 6.1737 6.2345 6.2345 6.2682 6.2682 8.5495 8.5495 8.5641 8.5641 8.6323 8.6323 9.4137 9.4137 10.5208 10.5208 10.6237 10.6237 k = 0.0789 0.0789-0.0000 ( 7551 PWs) bands (ev): -27.4715 -27.4715 -27.4482 -27.4482 -27.4479 -27.4479 -27.3916 -27.3916 -10.3498 -10.3498 -10.3471 -10.3471 -10.3461 -10.3461 -10.1972 -10.1972 -9.3097 -9.3097 -9.3092 -9.3092 -9.2139 -9.2139 -9.2108 -9.2108 -9.1405 -9.1405 -9.1360 -9.1360 -9.0443 -9.0443 -9.0262 -9.0262 -8.1160 -8.1160 -5.0345 -5.0345 -4.7674 -4.7674 -4.7642 -4.7642 4.4678 4.4678 4.5101 4.5101 4.5389 4.5389 5.1885 5.1885 5.2392 5.2392 5.3064 5.3064 5.4317 5.4317 5.5270 5.5270 5.5772 5.5772 6.1977 6.1977 6.2481 6.2481 6.2758 6.2758 8.5157 8.5157 8.5266 8.5266 8.5783 8.5783 9.3575 9.3575 10.5308 10.5308 10.6079 10.6079 k = 0.0658 0.0658-0.0000 ( 7557 PWs) bands (ev): -27.4717 -27.4717 -27.4481 -27.4481 -27.4479 -27.4479 -27.3916 -27.3916 -10.3497 -10.3497 -10.3470 -10.3470 -10.3462 -10.3462 -10.1951 -10.1951 -9.3097 -9.3097 -9.3094 -9.3094 -9.2126 -9.2126 -9.2101 -9.2101 -9.1387 -9.1387 -9.1354 -9.1354 -9.0385 -9.0385 -9.0257 -9.0257 -8.1228 -8.1228 -5.0455 -5.0455 -4.7743 -4.7743 -4.7720 -4.7720 4.4826 4.4826 4.5167 4.5167 4.5380 4.5380 5.2190 5.2190 5.2532 5.2532 5.3223 5.3223 5.4655 5.4655 5.5524 5.5524 5.5906 5.5906 6.2186 6.2186 6.2606 6.2606 6.2826 6.2826 8.4869 8.4869 8.4945 8.4945 8.5315 8.5315 9.3077 9.3077 10.5395 10.5395 10.5943 10.5943 k = 0.0526 0.0526-0.0000 ( 7545 PWs) bands (ev): -27.4719 -27.4719 -27.4480 -27.4480 -27.4478 -27.4478 -27.3915 -27.3915 -10.3497 -10.3497 -10.3469 -10.3469 -10.3463 -10.3463 -10.1934 -10.1934 -9.3098 -9.3098 -9.3096 -9.3096 -9.2116 -9.2116 -9.2096 -9.2096 -9.1371 -9.1371 -9.1349 -9.1349 -9.0335 -9.0335 -9.0252 -9.0252 -8.1285 -8.1285 -5.0546 -5.0546 -4.7800 -4.7800 -4.7786 -4.7786 4.4934 4.4934 4.5230 4.5230 4.5377 4.5377 5.2434 5.2434 5.2647 5.2647 5.3366 5.3366 5.4920 5.4920 5.5758 5.5758 5.6023 5.6023 6.2355 6.2355 6.2724 6.2724 6.2886 6.2886 8.4632 8.4632 8.4680 8.4680 8.4923 8.4923 9.2654 9.2654 10.5466 10.5466 10.5827 10.5827 k = 0.0395 0.0395-0.0000 ( 7539 PWs) bands (ev): -27.4721 -27.4721 -27.4479 -27.4479 -27.4478 -27.4478 -27.3915 -27.3915 -10.3497 -10.3497 -10.3468 -10.3468 -10.3464 -10.3464 -10.1920 -10.1920 -9.3099 -9.3099 -9.3098 -9.3098 -9.2109 -9.2109 -9.2090 -9.2090 -9.1357 -9.1357 -9.1344 -9.1344 -9.0296 -9.0296 -9.0249 -9.0249 -8.1330 -8.1330 -5.0617 -5.0617 -4.7845 -4.7845 -4.7837 -4.7837 4.5006 4.5006 4.5290 4.5290 4.5378 4.5378 5.2619 5.2619 5.2735 5.2735 5.3486 5.3486 5.5114 5.5114 5.5960 5.5960 5.6119 5.6119 6.2477 6.2477 6.2833 6.2833 6.2936 6.2936 8.4446 8.4446 8.4473 8.4473 8.4612 8.4612 9.2314 9.2314 10.5518 10.5518 10.5727 10.5727 k = 0.0263 0.0263-0.0000 ( 7519 PWs) bands (ev): -27.4722 -27.4722 -27.4478 -27.4478 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3466 -10.3466 -10.3465 -10.3465 -10.1911 -10.1911 -9.3100 -9.3100 -9.3099 -9.3099 -9.2105 -9.2105 -9.2086 -9.2086 -9.1347 -9.1347 -9.1341 -9.1341 -9.0268 -9.0268 -9.0247 -9.0247 -8.1363 -8.1363 -5.0668 -5.0668 -4.7877 -4.7877 -4.7874 -4.7874 4.5047 4.5047 4.5341 4.5341 4.5381 4.5381 5.2747 5.2747 5.2798 5.2798 5.3577 5.3577 5.5244 5.5244 5.6117 5.6117 5.6191 5.6191 6.2555 6.2555 6.2924 6.2924 6.2974 6.2974 8.4312 8.4312 8.4324 8.4324 8.4387 8.4387 9.2065 9.2065 10.5546 10.5546 10.5642 10.5642 k = 0.0132 0.0132-0.0000 ( 7513 PWs) bands (ev): -27.4723 -27.4723 -27.4478 -27.4478 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3465 -10.3465 -10.3465 -10.3465 -10.1905 -10.1905 -9.3100 -9.3100 -9.3100 -9.3100 -9.2102 -9.2102 -9.2083 -9.2083 -9.1340 -9.1340 -9.1339 -9.1339 -9.0251 -9.0251 -9.0245 -9.0245 -8.1383 -8.1383 -5.0699 -5.0699 -4.7897 -4.7897 -4.7896 -4.7896 4.5068 4.5068 4.5374 4.5374 4.5384 4.5384 5.2823 5.2823 5.2836 5.2836 5.3634 5.3634 5.5318 5.5318 5.6216 5.6216 5.6235 5.6235 6.2598 6.2598 6.2984 6.2984 6.2997 6.2997 8.4231 8.4231 8.4235 8.4235 8.4251 8.4251 9.1913 9.1913 10.5556 10.5556 10.5579 10.5579 k = 0.0000 0.0000 0.0000 ( 7521 PWs) bands (ev): -27.4723 -27.4723 -27.4478 -27.4478 -27.4478 -27.4478 -27.3914 -27.3914 -10.3498 -10.3498 -10.3465 -10.3465 -10.3465 -10.3465 -10.1903 -10.1903 -9.3100 -9.3100 -9.3100 -9.3100 -9.2102 -9.2102 -9.2082 -9.2082 -9.1338 -9.1338 -9.1338 -9.1338 -9.0245 -9.0245 -9.0245 -9.0245 -8.1390 -8.1390 -5.0709 -5.0709 -4.7903 -4.7903 -4.7903 -4.7903 4.5074 4.5074 4.5385 4.5385 4.5385 4.5385 5.2848 5.2848 5.2848 5.2848 5.3654 5.3654 5.5342 5.5342 5.6250 5.6250 5.6250 5.6250 6.2612 6.2612 6.3005 6.3005 6.3005 6.3005 8.4203 8.4203 8.4203 8.4203 8.4208 8.4208 9.1862 9.1862 10.5557 10.5557 10.5557 10.5557 k = 0.0000 0.0000 0.0000 ( 7521 PWs) bands (ev): -27.4723 -27.4723 -27.4478 -27.4478 -27.4478 -27.4478 -27.3914 -27.3914 -10.3498 -10.3498 -10.3465 -10.3465 -10.3465 -10.3465 -10.1903 -10.1903 -9.3100 -9.3100 -9.3100 -9.3100 -9.2102 -9.2102 -9.2082 -9.2082 -9.1338 -9.1338 -9.1338 -9.1338 -9.0245 -9.0245 -9.0245 -9.0245 -8.1390 -8.1390 -5.0709 -5.0709 -4.7903 -4.7903 -4.7903 -4.7903 4.5074 4.5074 4.5385 4.5385 4.5385 4.5385 5.2848 5.2848 5.2848 5.2848 5.3654 5.3654 5.5342 5.5342 5.6250 5.6250 5.6250 5.6250 6.2612 6.2612 6.3005 6.3005 6.3005 6.3005 8.4203 8.4203 8.4203 8.4203 8.4208 8.4208 9.1862 9.1862 10.5557 10.5557 10.5557 10.5557 k = 0.0106 0.0106 0.0106 ( 7509 PWs) bands (ev): -27.4723 -27.4723 -27.4478 -27.4478 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3465 -10.3465 -10.3465 -10.3465 -10.1905 -10.1905 -9.3100 -9.3100 -9.3100 -9.3100 -9.2102 -9.2102 -9.2083 -9.2083 -9.1340 -9.1340 -9.1339 -9.1339 -9.0251 -9.0251 -9.0245 -9.0245 -8.1383 -8.1383 -5.0699 -5.0699 -4.7896 -4.7896 -4.7896 -4.7896 4.5068 4.5068 4.5376 4.5376 4.5383 4.5383 5.2825 5.2825 5.2834 5.2834 5.3635 5.3635 5.5319 5.5319 5.6220 5.6220 5.6233 5.6233 6.2598 6.2598 6.2986 6.2986 6.2996 6.2996 8.4235 8.4235 8.4238 8.4238 8.4242 8.4242 9.1912 9.1912 10.5560 10.5560 10.5575 10.5575 k = 0.0213 0.0213 0.0213 ( 7515 PWs) bands (ev): -27.4722 -27.4722 -27.4478 -27.4478 -27.4478 -27.4478 -27.3915 -27.3915 -10.3498 -10.3498 -10.3466 -10.3466 -10.3465 -10.3465 -10.1911 -10.1911 -9.3100 -9.3100 -9.3099 -9.3099 -9.2105 -9.2105 -9.2086 -9.2086 -9.1345 -9.1345 -9.1342 -9.1342 -9.0268 -9.0268 -9.0246 -9.0246 -8.1364 -8.1364 -5.0669 -5.0669 -4.7876 -4.7876 -4.7876 -4.7876 4.5049 4.5049 4.5348 4.5348 4.5374 4.5374 5.2758 5.2758 5.2791 5.2791 5.3578 5.3578 5.5247 5.5247 5.6130 5.6130 5.6181 5.6181 6.2557 6.2557 6.2930 6.2930 6.2969 6.2969 8.4330 8.4330 8.4341 8.4341 8.4345 8.4345 9.2062 9.2062 10.5567 10.5567 10.5630 10.5630 k = 0.0319 0.0319 0.0319 ( 7538 PWs) bands (ev): -27.4721 -27.4721 -27.4478 -27.4478 -27.4478 -27.4478 -27.3915 -27.3915 -10.3497 -10.3497 -10.3467 -10.3467 -10.3464 -10.3464 -10.1920 -10.1920 -9.3099 -9.3099 -9.3098 -9.3098 -9.2109 -9.2109 -9.2090 -9.2090 -9.1354 -9.1354 -9.1347 -9.1347 -9.0297 -9.0297 -9.0248 -9.0248 -8.1331 -8.1331 -5.0619 -5.0619 -4.7842 -4.7842 -4.7842 -4.7842 4.5013 4.5013 4.5304 4.5304 4.5359 4.5359 5.2646 5.2646 5.2716 5.2716 5.3487 5.3487 5.5123 5.5123 5.5986 5.5986 5.6094 5.6094 6.2484 6.2484 6.2844 6.2844 6.2924 6.2924 8.4486 8.4486 8.4512 8.4512 8.4515 8.4515 9.2307 9.2307 10.5569 10.5569 10.5721 10.5721 k = 0.0426 0.0426 0.0426 ( 7538 PWs) bands (ev): -27.4719 -27.4719 -27.4479 -27.4479 -27.4479 -27.4479 -27.3915 -27.3915 -10.3497 -10.3497 -10.3469 -10.3469 -10.3464 -10.3464 -10.1933 -10.1933 -9.3098 -9.3098 -9.3096 -9.3096 -9.2117 -9.2117 -9.2094 -9.2094 -9.1364 -9.1364 -9.1354 -9.1354 -9.0336 -9.0336 -9.0250 -9.0250 -8.1287 -8.1287 -5.0548 -5.0548 -4.7795 -4.7795 -4.7795 -4.7795 4.4956 4.4956 4.5251 4.5251 4.5338 4.5338 5.2491 5.2491 5.2607 5.2607 5.3366 5.3366 5.4942 5.4942 5.5800 5.5800 5.5977 5.5977 6.2373 6.2373 6.2739 6.2739 6.2862 6.2862 8.4701 8.4701 8.4749 8.4749 8.4753 8.4753 9.2644 9.2644 10.5564 10.5564 10.5849 10.5849 k = 0.0532 0.0532 0.0532 ( 7565 PWs) bands (ev): -27.4717 -27.4717 -27.4480 -27.4480 -27.4480 -27.4480 -27.3916 -27.3916 -10.3496 -10.3496 -10.3471 -10.3471 -10.3463 -10.3463 -10.1950 -10.1950 -9.3098 -9.3098 -9.3094 -9.3094 -9.2129 -9.2129 -9.2098 -9.2098 -9.1377 -9.1377 -9.1363 -9.1363 -9.0386 -9.0386 -9.0253 -9.0253 -8.1231 -8.1231 -5.0459 -5.0459 -4.7734 -4.7734 -4.7734 -4.7734 4.4868 4.4868 4.5196 4.5196 4.5311 4.5311 5.2292 5.2292 5.2457 5.2457 5.3221 5.3221 5.4696 5.4696 5.5583 5.5583 5.5829 5.5829 6.2221 6.2221 6.2626 6.2626 6.2783 6.2783 8.4974 8.4974 8.5050 8.5050 8.5054 8.5054 9.3066 9.3066 10.5553 10.5553 10.6012 10.6012 k = 0.0638 0.0638 0.0638 ( 7559 PWs) bands (ev): -27.4715 -27.4715 -27.4480 -27.4480 -27.4480 -27.4480 -27.3916 -27.3916 -10.3495 -10.3495 -10.3474 -10.3474 -10.3462 -10.3462 -10.1970 -10.1970 -9.3098 -9.3098 -9.3093 -9.3093 -9.2144 -9.2144 -9.2102 -9.2102 -9.1390 -9.1390 -9.1372 -9.1372 -9.0445 -9.0445 -9.0256 -9.0256 -8.1163 -8.1163 -5.0351 -5.0351 -4.7661 -4.7661 -4.7661 -4.7661 4.4748 4.4748 4.5143 4.5143 4.5277 4.5277 5.2054 5.2054 5.2262 5.2262 5.3062 5.3062 5.4377 5.4377 5.5351 5.5351 5.5655 5.5655 6.2028 6.2028 6.2509 6.2509 6.2688 6.2688 8.5301 8.5301 8.5414 8.5414 8.5418 8.5418 9.3565 9.3565 10.5541 10.5541 10.6210 10.6210 k = 0.0745 0.0745 0.0745 ( 7553 PWs) bands (ev): -27.4712 -27.4712 -27.4481 -27.4481 -27.4481 -27.4481 -27.3917 -27.3917 -10.3494 -10.3494 -10.3477 -10.3477 -10.3461 -10.3461 -10.1995 -10.1995 -9.3100 -9.3100 -9.3091 -9.3091 -9.2164 -9.2164 -9.2106 -9.2106 -9.1403 -9.1403 -9.1383 -9.1383 -9.0513 -9.0513 -9.0260 -9.0260 -8.1085 -8.1085 -5.0224 -5.0224 -4.7575 -4.7575 -4.7575 -4.7575 4.4593 4.4593 4.5090 4.5090 4.5236 4.5236 5.1776 5.1776 5.2017 5.2017 5.2892 5.2892 5.3985 5.3985 5.5111 5.5111 5.5457 5.5457 6.1804 6.1804 6.2387 6.2387 6.2580 6.2580 8.5680 8.5680 8.5837 8.5837 8.5842 8.5842 9.4133 9.4133 10.5532 10.5532 10.6443 10.6443 k = 0.0851 0.0851 0.0851 ( 7535 PWs) bands (ev): -27.4709 -27.4709 -27.4482 -27.4482 -27.4482 -27.4482 -27.3917 -27.3917 -10.3494 -10.3494 -10.3481 -10.3481 -10.3459 -10.3459 -10.2022 -10.2022 -9.3103 -9.3103 -9.3089 -9.3089 -9.2188 -9.2188 -9.2110 -9.2110 -9.1415 -9.1415 -9.1394 -9.1394 -9.0589 -9.0589 -9.0265 -9.0265 -8.0997 -8.0997 -5.0080 -5.0080 -4.7478 -4.7478 -4.7477 -4.7477 4.4407 4.4407 4.5037 4.5037 4.5187 4.5187 5.1464 5.1464 5.1725 5.1725 5.2715 5.2715 5.3527 5.3527 5.4865 5.4865 5.5237 5.5237 6.1557 6.1557 6.2259 6.2259 6.2458 6.2458 8.6108 8.6108 8.6317 8.6317 8.6322 8.6322 9.4760 9.4760 10.5531 10.5531 10.6709 10.6709 k = 0.0957 0.0957 0.0957 ( 7523 PWs) bands (ev): -27.4706 -27.4706 -27.4484 -27.4484 -27.4484 -27.4484 -27.3918 -27.3918 -10.3494 -10.3494 -10.3486 -10.3486 -10.3458 -10.3458 -10.2053 -10.2053 -9.3109 -9.3109 -9.3089 -9.3089 -9.2217 -9.2217 -9.2113 -9.2113 -9.1425 -9.1425 -9.1404 -9.1404 -9.0671 -9.0671 -9.0270 -9.0270 -8.0901 -8.0901 -4.9918 -4.9918 -4.7368 -4.7368 -4.7367 -4.7367 4.4193 4.4193 4.4980 4.4980 4.5129 4.5129 5.1119 5.1119 5.1388 5.1388 5.2521 5.2521 5.3019 5.3019 5.4613 5.4613 5.4998 5.4998 6.1295 6.1295 6.2124 6.2124 6.2323 6.2323 8.6581 8.6581 8.6851 8.6851 8.6856 8.6856 9.5436 9.5436 10.5544 10.5544 10.7009 10.7009 k = 0.1064 0.1064 0.1064 ( 7517 PWs) bands (ev): -27.4702 -27.4702 -27.4485 -27.4485 -27.4485 -27.4485 -27.3919 -27.3919 -10.3495 -10.3495 -10.3491 -10.3491 -10.3456 -10.3456 -10.2088 -10.2088 -9.3117 -9.3117 -9.3089 -9.3089 -9.2252 -9.2252 -9.2114 -9.2114 -9.1432 -9.1432 -9.1415 -9.1415 -9.0758 -9.0758 -9.0275 -9.0275 -8.0797 -8.0797 -4.9741 -4.9741 -4.7248 -4.7248 -4.7247 -4.7247 4.3950 4.3950 4.4916 4.4916 4.5061 4.5061 5.0748 5.0748 5.1015 5.1015 5.2249 5.2249 5.2532 5.2532 5.4353 5.4353 5.4742 5.4742 6.1024 6.1024 6.1980 6.1980 6.2178 6.2178 8.7098 8.7098 8.7436 8.7436 8.7441 8.7441 9.6150 9.6150 10.5577 10.5577 10.7341 10.7341 k = 0.1170 0.1170 0.1170 ( 7517 PWs) bands (ev): -27.4698 -27.4698 -27.4487 -27.4487 -27.4487 -27.4487 -27.3919 -27.3919 -10.3498 -10.3498 -10.3496 -10.3496 -10.3455 -10.3455 -10.2126 -10.2126 -9.3129 -9.3129 -9.3091 -9.3091 -9.2293 -9.2293 -9.2113 -9.2113 -9.1438 -9.1438 -9.1424 -9.1424 -9.0849 -9.0849 -9.0281 -9.0281 -8.0685 -8.0685 -4.9548 -4.9548 -4.7117 -4.7117 -4.7116 -4.7116 4.3682 4.3682 4.4844 4.4844 4.4981 4.4981 5.0355 5.0355 5.0613 5.0613 5.1732 5.1732 5.2241 5.2241 5.4084 5.4084 5.4471 5.4471 6.0751 6.0751 6.1829 6.1829 6.2024 6.2024 8.7654 8.7654 8.8070 8.8070 8.8075 8.8075 9.6890 9.6890 10.5637 10.5637 10.7705 10.7705 k = 0.1277 0.1277 0.1277 ( 7514 PWs) bands (ev): -27.4693 -27.4693 -27.4488 -27.4488 -27.4488 -27.4488 -27.3920 -27.3920 -10.3505 -10.3505 -10.3498 -10.3498 -10.3453 -10.3453 -10.2167 -10.2167 -9.3144 -9.3144 -9.3094 -9.3094 -9.2340 -9.2340 -9.2109 -9.2109 -9.1442 -9.1442 -9.1433 -9.1433 -9.0940 -9.0940 -9.0287 -9.0287 -8.0568 -8.0568 -4.9341 -4.9341 -4.6976 -4.6976 -4.6975 -4.6975 4.3389 4.3389 4.4760 4.4760 4.4886 4.4886 4.9946 4.9946 5.0189 5.0189 5.1095 5.1095 5.2026 5.2026 5.3806 5.3806 5.4188 5.4188 6.0479 6.0479 6.1671 6.1671 6.1861 6.1861 8.8247 8.8247 8.8749 8.8749 8.8755 8.8755 9.7643 9.7643 10.5735 10.5735 10.8100 10.8100 k = 0.1383 0.1383 0.1383 ( 7523 PWs) bands (ev): -27.4689 -27.4689 -27.4490 -27.4490 -27.4490 -27.4490 -27.3921 -27.3921 -10.3513 -10.3513 -10.3501 -10.3501 -10.3452 -10.3452 -10.2211 -10.2211 -9.3163 -9.3163 -9.3098 -9.3098 -9.2392 -9.2392 -9.2102 -9.2102 -9.1447 -9.1447 -9.1439 -9.1439 -9.1029 -9.1029 -9.0294 -9.0294 -8.0445 -8.0445 -4.9120 -4.9120 -4.6826 -4.6826 -4.6824 -4.6824 4.3072 4.3072 4.4662 4.4662 4.4774 4.4774 4.9529 4.9529 4.9752 4.9752 5.0415 5.0415 5.1818 5.1818 5.3518 5.3518 5.3893 5.3893 6.0212 6.0212 6.1507 6.1507 6.1691 6.1691 8.8876 8.8876 8.9473 8.9473 8.9478 8.9478 9.8395 9.8395 10.5880 10.5880 10.8525 10.8525 k = 0.1489 0.1489 0.1489 ( 7523 PWs) bands (ev): -27.4684 -27.4684 -27.4492 -27.4492 -27.4492 -27.4492 -27.3922 -27.3922 -10.3522 -10.3522 -10.3504 -10.3504 -10.3451 -10.3451 -10.2258 -10.2258 -9.3186 -9.3186 -9.3105 -9.3105 -9.2449 -9.2449 -9.2091 -9.2091 -9.1461 -9.1461 -9.1443 -9.1443 -9.1107 -9.1107 -9.0301 -9.0301 -8.0318 -8.0318 -4.8888 -4.8888 -4.6668 -4.6668 -4.6666 -4.6666 4.2733 4.2733 4.4546 4.4546 4.4639 4.4639 4.9112 4.9112 4.9310 4.9310 4.9709 4.9709 5.1606 5.1606 5.3222 5.3222 5.3590 5.3590 5.9952 5.9952 6.1337 6.1337 6.1515 6.1515 8.9537 8.9537 9.0237 9.0237 9.0242 9.0242 9.9128 9.9128 10.6085 10.6085 10.8979 10.8979 k = 0.1596 0.1596 0.1596 ( 7529 PWs) bands (ev): -27.4679 -27.4679 -27.4494 -27.4494 -27.4494 -27.4494 -27.3923 -27.3923 -10.3532 -10.3532 -10.3509 -10.3509 -10.3451 -10.3451 -10.2307 -10.2307 -9.3213 -9.3213 -9.3114 -9.3114 -9.2510 -9.2510 -9.2078 -9.2078 -9.1492 -9.1492 -9.1444 -9.1444 -9.1164 -9.1164 -9.0308 -9.0308 -8.0187 -8.0187 -4.8643 -4.8643 -4.6501 -4.6501 -4.6499 -4.6499 4.2373 4.2373 4.4407 4.4407 4.4478 4.4478 4.8703 4.8703 4.8873 4.8873 4.8985 4.8985 5.1389 5.1389 5.2919 5.2919 5.3278 5.3278 5.9703 5.9703 6.1163 6.1163 6.1334 6.1334 9.0229 9.0229 9.1040 9.1040 9.1046 9.1046 9.9825 9.9825 10.6363 10.6363 10.9463 10.9463 k = 0.1702 0.1702 0.1702 ( 7553 PWs) bands (ev): -27.4673 -27.4673 -27.4496 -27.4496 -27.4496 -27.4496 -27.3924 -27.3924 -10.3544 -10.3544 -10.3515 -10.3515 -10.3451 -10.3451 -10.2359 -10.2359 -9.3243 -9.3243 -9.3125 -9.3125 -9.2575 -9.2575 -9.2064 -9.2064 -9.1545 -9.1545 -9.1442 -9.1442 -9.1194 -9.1194 -9.0315 -9.0315 -8.0054 -8.0054 -4.8389 -4.8389 -4.6328 -4.6328 -4.6325 -4.6325 4.1994 4.1994 4.4239 4.4239 4.4284 4.4284 4.8246 4.8246 4.8312 4.8312 4.8452 4.8452 5.1166 5.1166 5.2608 5.2608 5.2959 5.2959 5.9465 5.9465 6.0985 6.0985 6.1149 6.1149 9.0948 9.0948 9.1881 9.1881 9.1886 9.1886 10.0472 10.0472 10.6726 10.6726 10.9973 10.9973 k = 0.1809 0.1809 0.1809 ( 7541 PWs) bands (ev): -27.4668 -27.4668 -27.4498 -27.4498 -27.4498 -27.4498 -27.3925 -27.3925 -10.3556 -10.3556 -10.3522 -10.3522 -10.3451 -10.3451 -10.2414 -10.2414 -9.3277 -9.3277 -9.3139 -9.3139 -9.2642 -9.2642 -9.2050 -9.2050 -9.1616 -9.1616 -9.1437 -9.1437 -9.1198 -9.1198 -9.0322 -9.0322 -7.9918 -7.9918 -4.8126 -4.8126 -4.6148 -4.6148 -4.6145 -4.6145 4.1596 4.1596 4.4036 4.4036 4.4052 4.4052 4.7501 4.7501 4.7949 4.7949 4.8055 4.8055 5.0939 5.0939 5.2293 5.2293 5.2635 5.2635 5.9240 5.9240 6.0804 6.0804 6.0962 6.0962 9.1695 9.1695 9.2756 9.2756 9.2761 9.2761 10.1055 10.1055 10.7184 10.7184 11.0511 11.0511 k = 0.1915 0.1915 0.1915 ( 7547 PWs) bands (ev): -27.4662 -27.4662 -27.4500 -27.4500 -27.4500 -27.4500 -27.3926 -27.3926 -10.3569 -10.3569 -10.3530 -10.3530 -10.3452 -10.3452 -10.2471 -10.2471 -9.3313 -9.3313 -9.3155 -9.3155 -9.2712 -9.2712 -9.2044 -9.2044 -9.1690 -9.1690 -9.1429 -9.1429 -9.1186 -9.1186 -9.0329 -9.0329 -7.9781 -7.9781 -4.7855 -4.7855 -4.5963 -4.5963 -4.5960 -4.5960 4.1182 4.1182 4.3777 4.3777 4.3792 4.3792 4.6753 4.6753 4.7621 4.7621 4.7693 4.7693 5.0708 5.0708 5.1973 5.1973 5.2308 5.2308 5.9028 5.9028 6.0621 6.0621 6.0773 6.0773 9.2465 9.2465 9.3664 9.3664 9.3668 9.3668 10.1570 10.1570 10.7736 10.7736 11.1073 11.1073 k = 0.2021 0.2021 0.2021 ( 7547 PWs) bands (ev): -27.4656 -27.4656 -27.4502 -27.4502 -27.4502 -27.4502 -27.3927 -27.3927 -10.3584 -10.3584 -10.3540 -10.3540 -10.3454 -10.3454 -10.2529 -10.2529 -9.3351 -9.3351 -9.3172 -9.3172 -9.2782 -9.2782 -9.2056 -9.2056 -9.1748 -9.1748 -9.1417 -9.1417 -9.1163 -9.1163 -9.0336 -9.0336 -7.9643 -7.9643 -4.7577 -4.7577 -4.5774 -4.5774 -4.5770 -4.5770 4.0753 4.0753 4.3457 4.3457 4.3503 4.3503 4.6006 4.6006 4.7333 4.7333 4.7371 4.7371 5.0474 5.0474 5.1650 5.1650 5.1978 5.1978 5.8831 5.8831 6.0438 6.0438 6.0583 6.0583 9.3257 9.3257 9.4602 9.4602 9.4606 9.4606 10.2019 10.2019 10.8376 10.8376 11.1659 11.1659 k = 0.2128 0.2128 0.2128 ( 7541 PWs) bands (ev): -27.4650 -27.4650 -27.4504 -27.4504 -27.4504 -27.4504 -27.3927 -27.3927 -10.3600 -10.3600 -10.3551 -10.3551 -10.3457 -10.3457 -10.2589 -10.2589 -9.3391 -9.3391 -9.3192 -9.3192 -9.2853 -9.2853 -9.2100 -9.2100 -9.1775 -9.1775 -9.1403 -9.1403 -9.1135 -9.1135 -9.0343 -9.0343 -7.9506 -7.9506 -4.7294 -4.7294 -4.5580 -4.5580 -4.5576 -4.5576 4.0312 4.0312 4.3094 4.3094 4.3168 4.3168 4.5264 4.5264 4.7088 4.7088 4.7095 4.7095 5.0237 5.0237 5.1326 5.1326 5.1648 5.1648 5.8649 5.8649 6.0254 6.0254 6.0393 6.0393 9.4070 9.4070 9.5570 9.5570 9.5573 9.5573 10.2413 10.2413 10.9088 10.9088 11.2267 11.2267 k = 0.2234 0.2234 0.2234 ( 7541 PWs) bands (ev): -27.4644 -27.4644 -27.4506 -27.4506 -27.4506 -27.4506 -27.3928 -27.3928 -10.3617 -10.3617 -10.3563 -10.3563 -10.3460 -10.3460 -10.2651 -10.2651 -9.3432 -9.3432 -9.3213 -9.3213 -9.2924 -9.2924 -9.2173 -9.2173 -9.1771 -9.1771 -9.1385 -9.1385 -9.1101 -9.1101 -9.0349 -9.0349 -7.9368 -7.9368 -4.7007 -4.7007 -4.5384 -4.5384 -4.5380 -4.5380 3.9859 3.9859 4.2692 4.2692 4.2791 4.2791 4.4531 4.4531 4.6865 4.6865 4.6882 4.6882 4.9999 4.9999 5.1002 5.1002 5.1318 5.1318 5.8480 5.8480 6.0070 6.0070 6.0204 6.0204 9.4901 9.4901 9.6564 9.6564 9.6567 9.6567 10.2765 10.2765 10.9853 10.9853 11.2894 11.2894 k = 0.2340 0.2340 0.2340 ( 7550 PWs) bands (ev): -27.4638 -27.4638 -27.4509 -27.4509 -27.4509 -27.4509 -27.3929 -27.3929 -10.3635 -10.3635 -10.3576 -10.3576 -10.3465 -10.3465 -10.2713 -10.2713 -9.3474 -9.3474 -9.3236 -9.3236 -9.2995 -9.2995 -9.2263 -9.2263 -9.1748 -9.1748 -9.1365 -9.1365 -9.1065 -9.1065 -9.0355 -9.0355 -7.9232 -7.9232 -4.6717 -4.6717 -4.5186 -4.5186 -4.5181 -4.5181 3.9397 3.9397 4.2259 4.2259 4.2377 4.2377 4.3810 4.3810 4.6676 4.6676 4.6712 4.6712 4.9761 4.9761 5.0679 5.0679 5.0989 5.0989 5.8326 5.8326 5.9888 5.9888 6.0017 6.0017 9.5748 9.5748 9.7583 9.7583 9.7585 9.7585 10.3090 10.3090 11.0654 11.0654 11.3537 11.3537 k = 0.2447 0.2447 0.2447 ( 7544 PWs) bands (ev): -27.4632 -27.4632 -27.4511 -27.4511 -27.4511 -27.4511 -27.3930 -27.3930 -10.3654 -10.3654 -10.3591 -10.3591 -10.3471 -10.3471 -10.2776 -10.2776 -9.3516 -9.3516 -9.3260 -9.3260 -9.3064 -9.3064 -9.2359 -9.2359 -9.1713 -9.1713 -9.1342 -9.1342 -9.1026 -9.1026 -9.0361 -9.0361 -7.9098 -7.9098 -4.6426 -4.6426 -4.4986 -4.4986 -4.4981 -4.4981 3.8928 3.8928 4.1802 4.1802 4.1934 4.1934 4.3104 4.3104 4.6524 4.6524 4.6574 4.6574 4.9523 4.9523 5.0359 5.0359 5.0664 5.0664 5.8186 5.8186 5.9707 5.9707 5.9832 5.9832 9.6607 9.6607 9.8624 9.8624 9.8625 9.8625 10.3399 10.3399 11.1470 11.1470 11.4193 11.4193 k = 0.2553 0.2553 0.2553 ( 7547 PWs) bands (ev): -27.4626 -27.4626 -27.4513 -27.4513 -27.4513 -27.4513 -27.3931 -27.3931 -10.3673 -10.3673 -10.3607 -10.3607 -10.3477 -10.3477 -10.2840 -10.2840 -9.3557 -9.3557 -9.3285 -9.3285 -9.3132 -9.3132 -9.2458 -9.2458 -9.1673 -9.1673 -9.1318 -9.1318 -9.0985 -9.0985 -9.0367 -9.0367 -7.8965 -7.8965 -4.6134 -4.6134 -4.4786 -4.4786 -4.4781 -4.4781 3.8453 3.8453 4.1328 4.1328 4.1470 4.1470 4.2417 4.2417 4.6402 4.6402 4.6460 4.6460 4.9287 4.9287 5.0042 5.0042 5.0342 5.0342 5.8060 5.8060 5.9529 5.9529 5.9650 5.9650 9.7477 9.7477 9.9684 9.9684 9.9685 9.9685 10.3703 10.3703 11.2287 11.2287 11.4854 11.4854 k = 0.2660 0.2660 0.2660 ( 7556 PWs) bands (ev): -27.4620 -27.4620 -27.4516 -27.4516 -27.4515 -27.4515 -27.3931 -27.3931 -10.3694 -10.3694 -10.3625 -10.3625 -10.3485 -10.3485 -10.2903 -10.2903 -9.3598 -9.3598 -9.3310 -9.3310 -9.3198 -9.3198 -9.2557 -9.2557 -9.1630 -9.1630 -9.1291 -9.1291 -9.0944 -9.0944 -9.0372 -9.0372 -7.8835 -7.8835 -4.5842 -4.5842 -4.4587 -4.4587 -4.4582 -4.4582 3.7975 3.7975 4.0845 4.0845 4.0993 4.0993 4.1750 4.1750 4.6304 4.6304 4.6367 4.6367 4.9054 4.9054 4.9730 4.9730 5.0026 5.0026 5.7946 5.7946 5.9355 5.9355 5.9472 5.9472 9.8354 9.8354 10.0761 10.0761 10.0763 10.0763 10.4010 10.4010 11.3088 11.3088 11.5515 11.5515 k = 0.2766 0.2766 0.2766 ( 7568 PWs) bands (ev): -27.4615 -27.4615 -27.4518 -27.4518 -27.4518 -27.4518 -27.3932 -27.3932 -10.3716 -10.3716 -10.3643 -10.3643 -10.3493 -10.3493 -10.2966 -10.2966 -9.3639 -9.3639 -9.3335 -9.3335 -9.3263 -9.3263 -9.2654 -9.2654 -9.1584 -9.1584 -9.1264 -9.1264 -9.0901 -9.0901 -9.0376 -9.0376 -7.8708 -7.8708 -4.5553 -4.5553 -4.4389 -4.4389 -4.4384 -4.4384 3.7495 3.7495 4.0359 4.0359 4.0510 4.0510 4.1106 4.1106 4.6227 4.6227 4.6291 4.6291 4.8824 4.8824 4.9424 4.9424 4.9717 4.9717 5.7844 5.7844 5.9184 5.9184 5.9298 5.9298 9.9234 9.9234 10.1850 10.1850 10.1855 10.1855 10.4327 10.4327 11.3860 11.3860 11.6162 11.6162 k = 0.2872 0.2872 0.2872 ( 7577 PWs) bands (ev): -27.4609 -27.4609 -27.4520 -27.4520 -27.4520 -27.4520 -27.3932 -27.3932 -10.3738 -10.3738 -10.3663 -10.3663 -10.3503 -10.3503 -10.3028 -10.3028 -9.3678 -9.3678 -9.3360 -9.3360 -9.3325 -9.3325 -9.2747 -9.2747 -9.1536 -9.1536 -9.1235 -9.1235 -9.0859 -9.0859 -9.0380 -9.0380 -7.8585 -7.8585 -4.5267 -4.5267 -4.4194 -4.4194 -4.4188 -4.4188 3.7016 3.7016 3.9874 3.9874 4.0025 4.0025 4.0488 4.0488 4.6165 4.6165 4.6229 4.6229 4.8599 4.8599 4.9126 4.9126 4.9415 4.9415 5.7754 5.7754 5.9018 5.9018 5.9129 5.9129 10.0112 10.0112 10.2950 10.2950 10.2958 10.2958 10.4662 10.4662 11.4593 11.4593 11.6778 11.6778 k = 0.2979 0.2979 0.2979 ( 7568 PWs) bands (ev): -27.4603 -27.4603 -27.4522 -27.4522 -27.4522 -27.4522 -27.3933 -27.3933 -10.3760 -10.3760 -10.3684 -10.3684 -10.3513 -10.3513 -10.3090 -10.3090 -9.3715 -9.3715 -9.3385 -9.3385 -9.3385 -9.3385 -9.2837 -9.2837 -9.1488 -9.1488 -9.1206 -9.1206 -9.0816 -9.0816 -9.0382 -9.0382 -7.8465 -7.8465 -4.4986 -4.4986 -4.4002 -4.4002 -4.3996 -4.3996 3.6540 3.6540 3.9394 3.9394 3.9543 3.9543 3.9898 3.9898 4.6117 4.6117 4.6177 4.6177 4.8379 4.8379 4.8836 4.8836 4.9122 4.9122 5.7674 5.7674 5.8856 5.8856 5.8965 5.8965 10.0979 10.0979 10.4056 10.4056 10.4067 10.4067 10.5022 10.5022 11.5274 11.5274 11.7338 11.7338 k = 0.3085 0.3085 0.3085 ( 7568 PWs) bands (ev): -27.4598 -27.4598 -27.4524 -27.4524 -27.4524 -27.4524 -27.3933 -27.3933 -10.3783 -10.3783 -10.3706 -10.3706 -10.3525 -10.3525 -10.3149 -10.3149 -9.3751 -9.3751 -9.3442 -9.3442 -9.3409 -9.3409 -9.2923 -9.2923 -9.1440 -9.1440 -9.1178 -9.1178 -9.0773 -9.0773 -9.0384 -9.0384 -7.8349 -7.8349 -4.4710 -4.4710 -4.3813 -4.3813 -4.3807 -4.3807 3.6068 3.6068 3.8924 3.8924 3.9067 3.9067 3.9337 3.9337 4.6079 4.6079 4.6135 4.6135 4.8165 4.8165 4.8555 4.8555 4.8839 4.8839 5.7605 5.7605 5.8700 5.8700 5.8807 5.8807 10.1827 10.1827 10.5154 10.5154 10.5178 10.5178 10.5423 10.5423 11.5897 11.5897 11.7811 11.7811 k = 0.3191 0.3191 0.3191 ( 7574 PWs) bands (ev): -27.4593 -27.4593 -27.4527 -27.4527 -27.4527 -27.4527 -27.3934 -27.3934 -10.3806 -10.3806 -10.3729 -10.3729 -10.3537 -10.3537 -10.3206 -10.3206 -9.3785 -9.3785 -9.3497 -9.3497 -9.3432 -9.3432 -9.3005 -9.3005 -9.1392 -9.1392 -9.1149 -9.1149 -9.0731 -9.0731 -9.0385 -9.0385 -7.8238 -7.8238 -4.4442 -4.4442 -4.3630 -4.3630 -4.3624 -4.3624 3.5604 3.5604 3.8466 3.8466 3.8600 3.8600 3.8809 3.8809 4.6049 4.6049 4.6100 4.6100 4.7959 4.7959 4.8285 4.8285 4.8566 4.8566 5.7544 5.7544 5.8551 5.8551 5.8656 5.8656 10.2643 10.2643 10.5836 10.5836 10.6281 10.6281 10.6286 10.6286 11.6454 11.6454 11.8163 11.8163 k = 0.3298 0.3298 0.3298 ( 7583 PWs) bands (ev): -27.4588 -27.4588 -27.4529 -27.4529 -27.4529 -27.4529 -27.3934 -27.3934 -10.3829 -10.3829 -10.3753 -10.3753 -10.3550 -10.3550 -10.3261 -10.3261 -9.3818 -9.3818 -9.3549 -9.3549 -9.3454 -9.3454 -9.3082 -9.3082 -9.1345 -9.1345 -9.1121 -9.1121 -9.0690 -9.0690 -9.0385 -9.0385 -7.8132 -7.8132 -4.4181 -4.4181 -4.3452 -4.3452 -4.3446 -4.3446 3.5150 3.5150 3.8023 3.8023 3.8142 3.8142 3.8316 3.8316 4.6026 4.6026 4.6072 4.6072 4.7760 4.7760 4.8025 4.8025 4.8304 4.8304 5.7492 5.7492 5.8408 5.8408 5.8512 5.8512 10.3409 10.3409 10.6333 10.6333 10.7371 10.7371 10.7384 10.7384 11.6943 11.6943 11.8384 11.8384 k = 0.3404 0.3404 0.3404 ( 7577 PWs) bands (ev): -27.4583 -27.4583 -27.4531 -27.4531 -27.4531 -27.4531 -27.3934 -27.3934 -10.3852 -10.3852 -10.3778 -10.3778 -10.3565 -10.3565 -10.3312 -10.3312 -9.3849 -9.3849 -9.3599 -9.3599 -9.3476 -9.3476 -9.3153 -9.3153 -9.1299 -9.1299 -9.1095 -9.1095 -9.0650 -9.0650 -9.0383 -9.0383 -7.8030 -7.8030 -4.3930 -4.3930 -4.3281 -4.3281 -4.3275 -4.3275 3.4708 3.4708 3.7598 3.7598 3.7697 3.7697 3.7857 3.7857 4.6008 4.6008 4.6048 4.6048 4.7571 4.7571 4.7778 4.7778 4.8055 4.8055 5.7448 5.7448 5.8272 5.8272 5.8375 5.8375 10.4111 10.4111 10.6896 10.6896 10.8446 10.8446 10.8466 10.8466 11.7362 11.7362 11.8491 11.8491 k = 0.3511 0.3511 0.3511 ( 7574 PWs) bands (ev): -27.4578 -27.4578 -27.4532 -27.4532 -27.4532 -27.4532 -27.3935 -27.3935 -10.3874 -10.3874 -10.3803 -10.3803 -10.3580 -10.3580 -10.3360 -10.3360 -9.3877 -9.3877 -9.3646 -9.3646 -9.3496 -9.3496 -9.3220 -9.3220 -9.1254 -9.1254 -9.1070 -9.1070 -9.0611 -9.0611 -9.0381 -9.0381 -7.7934 -7.7934 -4.3689 -4.3689 -4.3117 -4.3117 -4.3110 -4.3110 3.4281 3.4281 3.7191 3.7191 3.7269 3.7269 3.7431 3.7431 4.5995 4.5995 4.6029 4.6029 4.7390 4.7390 4.7543 4.7543 4.7819 4.7819 5.7410 5.7410 5.8143 5.8143 5.8245 5.8245 10.4737 10.4737 10.7536 10.7536 10.9496 10.9496 10.9522 10.9522 11.7714 11.7714 11.8519 11.8519 k = 0.3617 0.3617 0.3617 ( 7568 PWs) bands (ev): -27.4574 -27.4574 -27.4534 -27.4534 -27.4534 -27.4534 -27.3935 -27.3935 -10.3896 -10.3896 -10.3829 -10.3829 -10.3596 -10.3596 -10.3403 -10.3403 -9.3904 -9.3904 -9.3690 -9.3690 -9.3514 -9.3514 -9.3281 -9.3281 -9.1211 -9.1211 -9.1046 -9.1046 -9.0574 -9.0574 -9.0378 -9.0378 -7.7844 -7.7844 -4.3459 -4.3459 -4.2960 -4.2960 -4.2954 -4.2954 3.3871 3.3871 3.6806 3.6806 3.6863 3.6863 3.7034 3.7034 4.5985 4.5985 4.6013 4.6013 4.7220 4.7220 4.7322 4.7322 4.7597 4.7597 5.7378 5.7378 5.8022 5.8022 5.8123 5.8123 10.5286 10.5286 10.8246 10.8246 11.0510 11.0510 11.0542 11.0542 11.8005 11.8005 11.8503 11.8503 k = 0.3723 0.3723 0.3723 ( 7571 PWs) bands (ev): -27.4570 -27.4570 -27.4536 -27.4536 -27.4536 -27.4536 -27.3935 -27.3935 -10.3917 -10.3917 -10.3855 -10.3855 -10.3613 -10.3613 -10.3442 -10.3442 -9.3929 -9.3929 -9.3732 -9.3732 -9.3532 -9.3532 -9.3337 -9.3337 -9.1170 -9.1170 -9.1024 -9.1024 -9.0539 -9.0539 -9.0373 -9.0373 -7.7759 -7.7759 -4.3242 -4.3242 -4.2813 -4.2813 -4.2806 -4.2806 3.3482 3.3482 3.6444 3.6444 3.6483 3.6483 3.6664 3.6664 4.5977 4.5977 4.6000 4.6000 4.7060 4.7060 4.7115 4.7115 4.7390 4.7390 5.7351 5.7351 5.7910 5.7910 5.8010 5.8010 10.5770 10.5770 10.9012 10.9012 11.1474 11.1474 11.1515 11.1515 11.8240 11.8240 11.8468 11.8468 k = 0.3830 0.3830 0.3830 ( 7547 PWs) bands (ev): -27.4566 -27.4566 -27.4537 -27.4537 -27.4537 -27.4537 -27.3935 -27.3935 -10.3937 -10.3937 -10.3881 -10.3881 -10.3631 -10.3631 -10.3476 -10.3476 -9.3952 -9.3952 -9.3771 -9.3771 -9.3548 -9.3548 -9.3387 -9.3387 -9.1131 -9.1131 -9.1005 -9.1005 -9.0505 -9.0505 -9.0368 -9.0368 -7.7681 -7.7681 -4.3038 -4.3038 -4.2674 -4.2674 -4.2668 -4.2668 3.3115 3.3115 3.6105 3.6105 3.6131 3.6131 3.6322 3.6322 4.5970 4.5970 4.5988 4.5988 4.6906 4.6906 4.6930 4.6930 4.7197 4.7197 5.7328 5.7328 5.7807 5.7807 5.7905 5.7905 10.6199 10.6199 10.9815 10.9815 11.2377 11.2377 11.2428 11.2428 11.8426 11.8426 11.8435 11.8435 k = 0.3936 0.3936 0.3936 ( 7553 PWs) bands (ev): -27.4563 -27.4563 -27.4539 -27.4539 -27.4539 -27.4539 -27.3935 -27.3935 -10.3957 -10.3957 -10.3906 -10.3906 -10.3650 -10.3650 -10.3504 -10.3504 -9.3973 -9.3973 -9.3807 -9.3807 -9.3562 -9.3562 -9.3432 -9.3432 -9.1095 -9.1095 -9.0987 -9.0987 -9.0474 -9.0474 -9.0362 -9.0362 -7.7608 -7.7608 -4.2849 -4.2849 -4.2546 -4.2546 -4.2539 -4.2539 3.2772 3.2772 3.5792 3.5792 3.5808 3.5808 3.6007 3.6007 4.5965 4.5965 4.5978 4.5978 4.6738 4.6738 4.6785 4.6785 4.7021 4.7021 5.7309 5.7309 5.7712 5.7712 5.7809 5.7809 10.6586 10.6586 11.0636 11.0636 11.3203 11.3203 11.3265 11.3265 11.8412 11.8412 11.8490 11.8490 k = 0.4043 0.4043 0.4043 ( 7562 PWs) bands (ev): -27.4560 -27.4560 -27.4540 -27.4540 -27.4540 -27.4540 -27.3935 -27.3935 -10.3975 -10.3975 -10.3931 -10.3931 -10.3670 -10.3670 -10.3529 -10.3529 -9.3992 -9.3992 -9.3840 -9.3840 -9.3575 -9.3575 -9.3472 -9.3472 -9.1062 -9.1062 -9.0971 -9.0971 -9.0445 -9.0445 -9.0356 -9.0356 -7.7542 -7.7542 -4.2675 -4.2675 -4.2428 -4.2428 -4.2421 -4.2421 3.2456 3.2456 3.5506 3.5506 3.5514 3.5514 3.5720 3.5720 4.5958 4.5958 4.5969 4.5969 4.6577 4.6577 4.6664 4.6664 4.6861 4.6861 5.7292 5.7292 5.7628 5.7628 5.7721 5.7721 10.6936 10.6936 11.1460 11.1460 11.3938 11.3938 11.4014 11.4014 11.8410 11.8410 11.8484 11.8484 k = 0.4149 0.4149 0.4149 ( 7559 PWs) bands (ev): -27.4557 -27.4557 -27.4542 -27.4542 -27.4542 -27.4542 -27.3935 -27.3935 -10.3991 -10.3991 -10.3955 -10.3955 -10.3689 -10.3689 -10.3549 -10.3549 -9.4009 -9.4009 -9.3870 -9.3870 -9.3587 -9.3587 -9.3507 -9.3507 -9.1031 -9.1031 -9.0958 -9.0958 -9.0419 -9.0419 -9.0350 -9.0350 -7.7483 -7.7483 -4.2516 -4.2516 -4.2320 -4.2320 -4.2313 -4.2313 3.2169 3.2169 3.5247 3.5247 3.5251 3.5251 3.5461 3.5461 4.5950 4.5950 4.5960 4.5960 4.6431 4.6431 4.6557 4.6557 4.6719 4.6719 5.7276 5.7276 5.7554 5.7554 5.7642 5.7642 10.7253 10.7253 11.2273 11.2273 11.4570 11.4570 11.4660 11.4660 11.8431 11.8431 11.8502 11.8502 k = 0.4255 0.4255 0.4255 ( 7559 PWs) bands (ev): -27.4555 -27.4555 -27.4543 -27.4543 -27.4543 -27.4543 -27.3935 -27.3935 -10.4006 -10.4006 -10.3977 -10.3977 -10.3707 -10.3707 -10.3565 -10.3565 -9.4025 -9.4025 -9.3897 -9.3897 -9.3597 -9.3597 -9.3537 -9.3537 -9.1003 -9.1003 -9.0946 -9.0946 -9.0395 -9.0395 -9.0343 -9.0343 -7.7430 -7.7430 -4.2375 -4.2375 -4.2225 -4.2225 -4.2218 -4.2218 3.1912 3.1912 3.5016 3.5016 3.5018 3.5018 3.5231 3.5231 4.5941 4.5941 4.5951 4.5951 4.6301 4.6301 4.6467 4.6467 4.6594 4.6594 5.7260 5.7260 5.7492 5.7492 5.7573 5.7573 10.7538 10.7538 11.3062 11.3062 11.5093 11.5093 11.5197 11.5197 11.8477 11.8477 11.8546 11.8546 k = 0.4362 0.4362 0.4362 ( 7556 PWs) bands (ev): -27.4552 -27.4552 -27.4544 -27.4544 -27.4544 -27.4544 -27.3935 -27.3935 -10.4019 -10.4019 -10.3997 -10.3997 -10.3723 -10.3723 -10.3579 -10.3579 -9.4039 -9.4039 -9.3920 -9.3920 -9.3606 -9.3606 -9.3562 -9.3562 -9.0979 -9.0979 -9.0936 -9.0936 -9.0375 -9.0375 -9.0337 -9.0337 -7.7384 -7.7384 -4.2251 -4.2251 -4.2141 -4.2141 -4.2134 -4.2134 3.1686 3.1686 3.4815 3.4815 3.4815 3.4815 3.5031 3.5031 4.5928 4.5928 4.5940 4.5940 4.6188 4.6188 4.6392 4.6392 4.6489 4.6489 5.7243 5.7243 5.7442 5.7442 5.7512 5.7512 10.7790 10.7790 11.3814 11.3814 11.5506 11.5506 11.5623 11.5623 11.8543 11.8543 11.8609 11.8609 k = 0.4468 0.4468 0.4468 ( 7550 PWs) bands (ev): -27.4551 -27.4551 -27.4544 -27.4544 -27.4544 -27.4544 -27.3935 -27.3935 -10.4031 -10.4031 -10.4015 -10.4015 -10.3737 -10.3737 -10.3590 -10.3590 -9.4050 -9.4050 -9.3939 -9.3939 -9.3613 -9.3613 -9.3584 -9.3584 -9.0959 -9.0959 -9.0928 -9.0928 -9.0357 -9.0357 -9.0331 -9.0331 -7.7345 -7.7345 -4.2145 -4.2145 -4.2069 -4.2069 -4.2062 -4.2062 3.1493 3.1493 3.4643 3.4643 3.4644 3.4644 3.4861 3.4861 4.5913 4.5913 4.5929 4.5929 4.6093 4.6093 4.6333 4.6333 4.6402 4.6402 5.7225 5.7225 5.7405 5.7405 5.7461 5.7461 10.8008 10.8008 11.4512 11.4512 11.5820 11.5820 11.5947 11.5947 11.8619 11.8619 11.8683 11.8683 k = 0.4574 0.4574 0.4574 ( 7565 PWs) bands (ev): -27.4549 -27.4549 -27.4545 -27.4545 -27.4545 -27.4545 -27.3935 -27.3935 -10.4040 -10.4040 -10.4030 -10.4030 -10.3749 -10.3749 -10.3599 -10.3599 -9.4060 -9.4060 -9.3955 -9.3955 -9.3620 -9.3620 -9.3601 -9.3601 -9.0942 -9.0942 -9.0922 -9.0922 -9.0342 -9.0342 -9.0326 -9.0326 -7.7313 -7.7313 -4.2058 -4.2058 -4.2010 -4.2010 -4.2003 -4.2003 3.1333 3.1333 3.4502 3.4502 3.4503 3.4503 3.4721 3.4721 4.5896 4.5896 4.5916 4.5916 4.6014 4.6014 4.6289 4.6289 4.6334 4.6334 5.7205 5.7205 5.7379 5.7379 5.7419 5.7419 10.8191 10.8191 11.5137 11.5137 11.6051 11.6051 11.6184 11.6184 11.8696 11.8696 11.8753 11.8753 k = 0.4681 0.4681 0.4681 ( 7592 PWs) bands (ev): -27.4548 -27.4548 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4048 -10.4048 -10.4042 -10.4042 -10.3758 -10.3758 -10.3606 -10.3606 -9.4068 -9.4068 -9.3967 -9.3967 -9.3624 -9.3624 -9.3614 -9.3614 -9.0928 -9.0928 -9.0917 -9.0917 -9.0331 -9.0331 -9.0321 -9.0321 -7.7288 -7.7288 -4.1990 -4.1990 -4.1963 -4.1963 -4.1957 -4.1957 3.1208 3.1208 3.4392 3.4392 3.4392 3.4392 3.4612 3.4612 4.5878 4.5878 4.5904 4.5904 4.5954 4.5954 4.6259 4.6259 4.6283 4.6283 5.7187 5.7187 5.7362 5.7362 5.7387 5.7387 10.8335 10.8335 11.5662 11.5662 11.6218 11.6218 11.6349 11.6349 11.8762 11.8762 11.8810 11.8810 k = 0.4787 0.4787 0.4787 ( 7586 PWs) bands (ev): -27.4547 -27.4547 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4053 -10.4053 -10.4050 -10.4050 -10.3765 -10.3765 -10.3610 -10.3610 -9.4074 -9.4074 -9.3976 -9.3976 -9.3628 -9.3628 -9.3623 -9.3623 -9.0919 -9.0919 -9.0913 -9.0913 -9.0322 -9.0322 -9.0318 -9.0318 -7.7270 -7.7270 -4.1942 -4.1942 -4.1929 -4.1929 -4.1924 -4.1924 3.1119 3.1119 3.4313 3.4313 3.4314 3.4314 3.4534 3.4534 4.5862 4.5862 4.5892 4.5892 4.5913 4.5913 4.6239 4.6239 4.6250 4.6250 5.7172 5.7172 5.7352 5.7352 5.7363 5.7363 10.8440 10.8440 11.6049 11.6049 11.6349 11.6349 11.6456 11.6456 11.8812 11.8812 11.8842 11.8842 k = 0.4894 0.4894 0.4894 ( 7568 PWs) bands (ev): -27.4547 -27.4547 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4056 -10.4056 -10.4056 -10.4056 -10.3769 -10.3769 -10.3613 -10.3613 -9.4077 -9.4077 -9.3981 -9.3981 -9.3630 -9.3630 -9.3628 -9.3628 -9.0913 -9.0913 -9.0911 -9.0911 -9.0317 -9.0317 -9.0316 -9.0316 -7.7259 -7.7259 -4.1916 -4.1916 -4.1906 -4.1906 -4.1904 -4.1904 3.1065 3.1065 3.4266 3.4266 3.4266 3.4266 3.4487 3.4487 4.5849 4.5849 4.5885 4.5885 4.5889 4.5889 4.6228 4.6228 4.6231 4.6231 5.7163 5.7163 5.7346 5.7346 5.7349 5.7349 10.8503 10.8503 11.6247 11.6247 11.6474 11.6474 11.6517 11.6517 11.8843 11.8843 11.8852 11.8852 k = 0.5000 0.5000 0.5000 ( 7568 PWs) bands (ev): -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4057 -10.4057 -10.4057 -10.4057 -10.3771 -10.3771 -10.3614 -10.3614 -9.4079 -9.4079 -9.3983 -9.3983 -9.3630 -9.3630 -9.3630 -9.3630 -9.0911 -9.0911 -9.0911 -9.0911 -9.0316 -9.0316 -9.0316 -9.0316 -7.7255 -7.7255 -4.1908 -4.1908 -4.1897 -4.1897 -4.1897 -4.1897 3.1047 3.1047 3.4250 3.4250 3.4250 3.4250 3.4471 3.4471 4.5844 4.5844 4.5882 4.5882 4.5882 4.5882 4.6224 4.6224 4.6224 4.6224 5.7160 5.7160 5.7345 5.7345 5.7345 5.7345 10.8524 10.8524 11.6294 11.6294 11.6537 11.6537 11.6537 11.6537 11.8853 11.8853 11.8853 11.8853 k = 0.5000 0.5000 0.5000 ( 7568 PWs) bands (ev): -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4057 -10.4057 -10.4057 -10.4057 -10.3771 -10.3771 -10.3614 -10.3614 -9.4079 -9.4079 -9.3983 -9.3983 -9.3630 -9.3630 -9.3630 -9.3630 -9.0911 -9.0911 -9.0911 -9.0911 -9.0316 -9.0316 -9.0316 -9.0316 -7.7255 -7.7255 -4.1908 -4.1908 -4.1897 -4.1897 -4.1897 -4.1897 3.1047 3.1047 3.4250 3.4250 3.4250 3.4250 3.4471 3.4471 4.5844 4.5844 4.5882 4.5882 4.5882 4.5882 4.6224 4.6224 4.6224 4.6224 5.7160 5.7160 5.7345 5.7345 5.7345 5.7345 10.8524 10.8524 11.6294 11.6294 11.6537 11.6537 11.6537 11.6537 11.8853 11.8853 11.8853 11.8853 k = 0.4868 0.5000 0.4868 ( 7568 PWs) bands (ev): -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4056 -10.4056 -10.4056 -10.4056 -10.3769 -10.3769 -10.3613 -10.3613 -9.4077 -9.4077 -9.3981 -9.3981 -9.3630 -9.3630 -9.3628 -9.3628 -9.0913 -9.0913 -9.0912 -9.0912 -9.0317 -9.0317 -9.0316 -9.0316 -7.7259 -7.7259 -4.1916 -4.1916 -4.1906 -4.1906 -4.1904 -4.1904 3.1065 3.1065 3.4264 3.4264 3.4269 3.4269 3.4487 3.4487 4.5849 4.5849 4.5885 4.5885 4.5889 4.5889 4.6228 4.6228 4.6230 4.6230 5.7163 5.7163 5.7346 5.7346 5.7350 5.7350 10.8503 10.8503 11.6247 11.6247 11.6474 11.6474 11.6515 11.6515 11.8842 11.8842 11.8852 11.8852 k = 0.4737 0.5000 0.4737 ( 7584 PWs) bands (ev): -27.4547 -27.4547 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4053 -10.4053 -10.4050 -10.4050 -10.3765 -10.3765 -10.3610 -10.3610 -9.4074 -9.4074 -9.3976 -9.3976 -9.3627 -9.3627 -9.3623 -9.3623 -9.0918 -9.0918 -9.0914 -9.0914 -9.0322 -9.0322 -9.0319 -9.0319 -7.7270 -7.7270 -4.1942 -4.1942 -4.1931 -4.1931 -4.1924 -4.1924 3.1120 3.1120 3.4305 3.4305 3.4323 3.4323 3.4536 3.4536 4.5862 4.5862 4.5894 4.5894 4.5911 4.5911 4.6239 4.6239 4.6250 4.6250 5.7172 5.7172 5.7350 5.7350 5.7365 5.7365 10.8438 10.8438 11.6060 11.6060 11.6328 11.6328 11.6458 11.6458 11.8806 11.8806 11.8849 11.8849 k = 0.4605 0.5000 0.4605 ( 7596 PWs) bands (ev): -27.4548 -27.4548 -27.4546 -27.4546 -27.4545 -27.4545 -27.3935 -27.3935 -10.4047 -10.4047 -10.4042 -10.4042 -10.3758 -10.3758 -10.3605 -10.3605 -9.4068 -9.4068 -9.3967 -9.3967 -9.3624 -9.3624 -9.3614 -9.3614 -9.0928 -9.0928 -9.0918 -9.0918 -9.0330 -9.0330 -9.0322 -9.0322 -7.7288 -7.7288 -4.1987 -4.1987 -4.1971 -4.1971 -4.1956 -4.1956 3.1211 3.1211 3.4373 3.4373 3.4411 3.4411 3.4620 3.4620 4.5880 4.5880 4.5910 4.5910 4.5948 4.5948 4.6259 4.6259 4.6284 4.6284 5.7187 5.7187 5.7358 5.7358 5.7392 5.7392 10.8332 10.8332 11.5687 11.5687 11.6153 11.6153 11.6379 11.6379 11.8737 11.8737 11.8840 11.8840 k = 0.4474 0.5000 0.4474 ( 7586 PWs) bands (ev): -27.4548 -27.4548 -27.4547 -27.4547 -27.4545 -27.4545 -27.3935 -27.3935 -10.4039 -10.4039 -10.4030 -10.4030 -10.3749 -10.3749 -10.3599 -10.3599 -9.4060 -9.4060 -9.3955 -9.3955 -9.3619 -9.3619 -9.3601 -9.3601 -9.0941 -9.0941 -9.0923 -9.0923 -9.0341 -9.0341 -9.0327 -9.0327 -7.7314 -7.7314 -4.2053 -4.2053 -4.2025 -4.2025 -4.1999 -4.1999 3.1338 3.1338 3.4467 3.4467 3.4527 3.4527 3.4743 3.4743 4.5900 4.5900 4.5935 4.5935 4.5996 4.5996 4.6288 4.6288 4.6337 4.6337 5.7205 5.7205 5.7369 5.7369 5.7431 5.7431 10.8186 10.8186 11.5165 11.5165 11.5933 11.5933 11.6284 11.6284 11.8631 11.8631 11.8819 11.8819 k = 0.4342 0.5000 0.4342 ( 7578 PWs) bands (ev): -27.4550 -27.4550 -27.4547 -27.4547 -27.4543 -27.4543 -27.3935 -27.3935 -10.4030 -10.4030 -10.4014 -10.4014 -10.3736 -10.3736 -10.3590 -10.3590 -9.4050 -9.4050 -9.3939 -9.3939 -9.3612 -9.3612 -9.3584 -9.3584 -9.0958 -9.0958 -9.0930 -9.0930 -9.0356 -9.0356 -9.0333 -9.0333 -7.7346 -7.7346 -4.2136 -4.2136 -4.2094 -4.2094 -4.2055 -4.2055 3.1499 3.1499 3.4587 3.4587 3.4667 3.4667 3.4909 3.4909 4.5920 4.5920 4.5969 4.5969 4.6051 4.6051 4.6327 4.6327 4.6413 4.6413 5.7225 5.7225 5.7384 5.7384 5.7484 5.7484 10.8003 10.8003 11.4527 11.4527 11.5665 11.5665 11.6171 11.6171 11.8486 11.8486 11.8783 11.8783 k = 0.4211 0.5000 0.4211 ( 7568 PWs) bands (ev): -27.4551 -27.4551 -27.4547 -27.4547 -27.4542 -27.4542 -27.3935 -27.3935 -10.4018 -10.4018 -10.3996 -10.3996 -10.3722 -10.3722 -10.3579 -10.3579 -9.4037 -9.4037 -9.3919 -9.3919 -9.3603 -9.3603 -9.3564 -9.3564 -9.0979 -9.0979 -9.0938 -9.0938 -9.0373 -9.0373 -9.0341 -9.0341 -7.7385 -7.7385 -4.2237 -4.2237 -4.2177 -4.2177 -4.2121 -4.2121 3.1694 3.1694 3.4732 3.4732 3.4825 3.4825 3.5122 3.5122 4.5940 4.5940 4.6010 4.6010 4.6109 4.6109 4.6377 4.6377 4.6516 4.6516 5.7246 5.7246 5.7403 5.7403 5.7551 5.7551 10.7785 10.7785 11.3798 11.3798 11.5352 11.5352 11.6039 11.6039 11.8299 11.8299 11.8727 11.8727 k = 0.4079 0.5000 0.4079 ( 7564 PWs) bands (ev): -27.4553 -27.4553 -27.4547 -27.4547 -27.4541 -27.4541 -27.3935 -27.3935 -10.4005 -10.4005 -10.3975 -10.3975 -10.3705 -10.3705 -10.3567 -10.3567 -9.4023 -9.4023 -9.3896 -9.3896 -9.3593 -9.3593 -9.3540 -9.3540 -9.1004 -9.1004 -9.0948 -9.0948 -9.0392 -9.0392 -9.0349 -9.0349 -7.7431 -7.7431 -4.2354 -4.2354 -4.2274 -4.2274 -4.2199 -4.2199 3.1921 3.1921 3.4900 3.4900 3.5003 3.5003 3.5380 3.5380 4.5960 4.5960 4.6059 4.6059 4.6169 4.6169 4.6438 4.6438 4.6646 4.6646 5.7267 5.7267 5.7428 5.7428 5.7631 5.7631 10.7536 10.7536 11.2993 11.2993 11.5000 11.5000 11.5889 11.5889 11.8067 11.8067 11.8644 11.8644 k = 0.3947 0.5000 0.3947 ( 7562 PWs) bands (ev): -27.4554 -27.4554 -27.4547 -27.4547 -27.4539 -27.4539 -27.3935 -27.3935 -10.3990 -10.3990 -10.3952 -10.3952 -10.3686 -10.3686 -10.3552 -10.3552 -9.4008 -9.4008 -9.3869 -9.3869 -9.3580 -9.3580 -9.3513 -9.3513 -9.1032 -9.1032 -9.0959 -9.0959 -9.0415 -9.0415 -9.0358 -9.0358 -7.7484 -7.7484 -4.2487 -4.2487 -4.2384 -4.2384 -4.2287 -4.2287 3.2178 3.2178 3.5090 3.5090 3.5200 3.5200 3.5680 3.5680 4.5979 4.5979 4.6115 4.6115 4.6232 4.6232 4.6511 4.6511 4.6803 4.6803 5.7288 5.7288 5.7458 5.7458 5.7724 5.7724 10.7257 10.7257 11.2128 11.2128 11.4616 11.4616 11.5720 11.5720 11.7786 11.7786 11.8527 11.8527 k = 0.3816 0.5000 0.3816 ( 7550 PWs) bands (ev): -27.4556 -27.4556 -27.4547 -27.4547 -27.4537 -27.4537 -27.3935 -27.3935 -10.3974 -10.3974 -10.3926 -10.3926 -10.3666 -10.3666 -10.3534 -10.3534 -9.3990 -9.3990 -9.3840 -9.3840 -9.3565 -9.3565 -9.3481 -9.3481 -9.1063 -9.1063 -9.0972 -9.0972 -9.0439 -9.0439 -9.0368 -9.0368 -7.7542 -7.7542 -4.2635 -4.2635 -4.2506 -4.2506 -4.2385 -4.2385 3.2465 3.2465 3.5299 3.5299 3.5417 3.5417 3.6021 3.6021 4.5998 4.5998 4.6177 4.6177 4.6299 4.6299 4.6595 4.6595 4.6985 4.6985 5.7308 5.7308 5.7496 5.7496 5.7830 5.7830 10.6952 10.6952 11.1214 11.1214 11.4204 11.4204 11.5534 11.5534 11.7457 11.7457 11.8369 11.8369 k = 0.3684 0.5000 0.3684 ( 7544 PWs) bands (ev): -27.4559 -27.4559 -27.4547 -27.4547 -27.4535 -27.4535 -27.3935 -27.3935 -10.3957 -10.3957 -10.3899 -10.3899 -10.3644 -10.3644 -10.3514 -10.3514 -9.3971 -9.3971 -9.3808 -9.3808 -9.3547 -9.3547 -9.3446 -9.3446 -9.1098 -9.1098 -9.0986 -9.0986 -9.0465 -9.0465 -9.0379 -9.0379 -7.7607 -7.7607 -4.2796 -4.2796 -4.2639 -4.2639 -4.2492 -4.2492 3.2778 3.2778 3.5525 3.5525 3.5655 3.5655 3.6399 3.6399 4.6016 4.6016 4.6246 4.6246 4.6372 4.6372 4.6690 4.6690 4.7190 4.7190 5.7327 5.7327 5.7542 5.7542 5.7946 5.7946 10.6623 10.6623 11.0261 11.0261 11.3769 11.3769 11.5333 11.5333 11.7078 11.7078 11.8158 11.8159 k = 0.3553 0.5000 0.3553 ( 7536 PWs) bands (ev): -27.4561 -27.4561 -27.4547 -27.4547 -27.4533 -27.4533 -27.3935 -27.3935 -10.3939 -10.3939 -10.3871 -10.3871 -10.3620 -10.3620 -10.3491 -10.3491 -9.3950 -9.3950 -9.3773 -9.3773 -9.3527 -9.3527 -9.3408 -9.3408 -9.1136 -9.1136 -9.1002 -9.1002 -9.0494 -9.0494 -9.0390 -9.0390 -7.7677 -7.7677 -4.2970 -4.2970 -4.2782 -4.2782 -4.2607 -4.2607 3.3115 3.3115 3.5766 3.5766 3.5913 3.5913 3.6813 3.6813 4.6033 4.6033 4.6322 4.6322 4.6453 4.6453 4.6795 4.6795 4.7416 4.7416 5.7346 5.7346 5.7595 5.7595 5.8073 5.8073 10.6272 10.6272 10.9279 10.9279 11.3317 11.3317 11.5119 11.5119 11.6652 11.6652 11.7887 11.7887 k = 0.3421 0.5000 0.3421 ( 7550 PWs) bands (ev): -27.4564 -27.4564 -27.4548 -27.4548 -27.4530 -27.4530 -27.3935 -27.3935 -10.3921 -10.3921 -10.3842 -10.3842 -10.3596 -10.3596 -10.3466 -10.3466 -9.3927 -9.3927 -9.3736 -9.3736 -9.3502 -9.3502 -9.3366 -9.3366 -9.1177 -9.1177 -9.1020 -9.1020 -9.0524 -9.0524 -9.0402 -9.0402 -7.7752 -7.7752 -4.3154 -4.3154 -4.2935 -4.2935 -4.2730 -4.2730 3.3476 3.3476 3.6017 3.6017 3.6192 3.6192 3.7260 3.7260 4.6050 4.6050 4.6405 4.6405 4.6541 4.6541 4.6908 4.6908 4.7661 4.7661 5.7363 5.7363 5.7658 5.7658 5.8210 5.8210 10.5901 10.5901 10.8276 10.8276 11.2850 11.2850 11.4894 11.4894 11.6181 11.6181 11.7556 11.7556 k = 0.3289 0.5000 0.3289 ( 7558 PWs) bands (ev): -27.4566 -27.4566 -27.4548 -27.4548 -27.4528 -27.4528 -27.3935 -27.3935 -10.3902 -10.3902 -10.3813 -10.3813 -10.3571 -10.3571 -10.3438 -10.3438 -9.3903 -9.3903 -9.3698 -9.3698 -9.3473 -9.3473 -9.3321 -9.3321 -9.1221 -9.1221 -9.1039 -9.1039 -9.0555 -9.0555 -9.0414 -9.0414 -7.7832 -7.7832 -4.3349 -4.3349 -4.3097 -4.3097 -4.2859 -4.2859 3.3856 3.3856 3.6276 3.6276 3.6490 3.6490 3.7738 3.7738 4.6067 4.6067 4.6496 4.6496 4.6640 4.6640 4.7029 4.7029 4.7925 4.7925 5.7380 5.7380 5.7729 5.7729 5.8355 5.8355 10.5510 10.5510 10.7259 10.7259 11.2374 11.2374 11.4661 11.4661 11.5672 11.5672 11.7166 11.7166 k = 0.3158 0.5000 0.3158 ( 7552 PWs) bands (ev): -27.4569 -27.4569 -27.4548 -27.4548 -27.4525 -27.4525 -27.3935 -27.3935 -10.3883 -10.3883 -10.3784 -10.3784 -10.3545 -10.3545 -10.3407 -10.3407 -9.3877 -9.3877 -9.3660 -9.3660 -9.3440 -9.3440 -9.3273 -9.3273 -9.1267 -9.1267 -9.1061 -9.1061 -9.0587 -9.0587 -9.0426 -9.0426 -7.7916 -7.7916 -4.3552 -4.3552 -4.3265 -4.3265 -4.2995 -4.2995 3.4255 3.4255 3.6542 3.6542 3.6805 3.6805 3.8242 3.8242 4.6083 4.6083 4.6595 4.6595 4.6749 4.6749 4.7157 4.7157 4.8205 4.8205 5.7395 5.7395 5.7811 5.7811 5.8508 5.8508 10.5101 10.5101 10.6235 10.6235 11.1893 11.1893 11.4422 11.4422 11.5131 11.5131 11.6721 11.6721 k = 0.3026 0.5000 0.3026 ( 7552 PWs) bands (ev): -27.4572 -27.4572 -27.4549 -27.4549 -27.4523 -27.4523 -27.3935 -27.3935 -10.3863 -10.3863 -10.3756 -10.3756 -10.3518 -10.3518 -10.3374 -10.3374 -9.3849 -9.3849 -9.3622 -9.3622 -9.3401 -9.3401 -9.3222 -9.3222 -9.1316 -9.1316 -9.1083 -9.1083 -9.0619 -9.0619 -9.0439 -9.0439 -7.8004 -7.8004 -4.3762 -4.3762 -4.3439 -4.3439 -4.3135 -4.3135 3.4669 3.4669 3.6811 3.6811 3.7136 3.7136 3.8771 3.8771 4.6099 4.6099 4.6702 4.6702 4.6870 4.6870 4.7290 4.7290 4.8500 4.8500 5.7409 5.7409 5.7902 5.7902 5.8668 5.8668 10.4674 10.4674 10.5209 10.5209 11.1412 11.1412 11.4179 11.4179 11.4565 11.4565 11.6225 11.6225 k = 0.2895 0.5000 0.2895 ( 7544 PWs) bands (ev): -27.4575 -27.4575 -27.4549 -27.4549 -27.4520 -27.4520 -27.3935 -27.3935 -10.3844 -10.3844 -10.3730 -10.3730 -10.3489 -10.3489 -10.3340 -10.3340 -9.3820 -9.3820 -9.3584 -9.3584 -9.3357 -9.3357 -9.3168 -9.3168 -9.1368 -9.1368 -9.1108 -9.1108 -9.0652 -9.0652 -9.0451 -9.0451 -7.8096 -7.8096 -4.3977 -4.3977 -4.3618 -4.3618 -4.3280 -4.3280 3.5096 3.5096 3.7081 3.7081 3.7481 3.7481 3.9318 3.9318 4.6116 4.6116 4.6817 4.6817 4.7005 4.7005 4.7428 4.7428 4.8808 4.8808 5.7421 5.7421 5.8005 5.8005 5.8833 5.8833 10.4175 10.4175 10.4243 10.4243 11.0935 11.0935 11.3933 11.3933 11.3983 11.3983 11.5682 11.5682 k = 0.2763 0.5000 0.2763 ( 7550 PWs) bands (ev): -27.4578 -27.4578 -27.4550 -27.4550 -27.4517 -27.4517 -27.3934 -27.3934 -10.3825 -10.3825 -10.3705 -10.3705 -10.3459 -10.3459 -10.3304 -10.3304 -9.3789 -9.3789 -9.3546 -9.3546 -9.3308 -9.3308 -9.3112 -9.3112 -9.1421 -9.1421 -9.1135 -9.1135 -9.0686 -9.0686 -9.0464 -9.0464 -7.8190 -7.8190 -4.4197 -4.4197 -4.3801 -4.3801 -4.3427 -4.3427 3.5533 3.5533 3.7348 3.7348 3.7838 3.7838 3.9880 3.9880 4.6132 4.6132 4.6940 4.6940 4.7156 4.7156 4.7568 4.7568 4.9128 4.9128 5.7432 5.7432 5.8120 5.8120 5.9004 5.9004 10.3169 10.3169 10.3777 10.3777 11.0467 11.0467 11.3384 11.3384 11.3692 11.3692 11.5100 11.5100 k = 0.2632 0.5000 0.2632 ( 7562 PWs) bands (ev): -27.4581 -27.4581 -27.4550 -27.4550 -27.4514 -27.4514 -27.3934 -27.3934 -10.3806 -10.3806 -10.3683 -10.3683 -10.3428 -10.3428 -10.3267 -10.3267 -9.3756 -9.3756 -9.3508 -9.3508 -9.3254 -9.3254 -9.3054 -9.3054 -9.1476 -9.1476 -9.1163 -9.1163 -9.0718 -9.0718 -9.0476 -9.0476 -7.8286 -7.8286 -4.4419 -4.4419 -4.3985 -4.3985 -4.3576 -4.3576 3.5978 3.5978 3.7612 3.7612 3.8204 3.8204 4.0451 4.0451 4.6149 4.6149 4.7070 4.7070 4.7325 4.7325 4.7710 4.7710 4.9458 4.9458 5.7440 5.7440 5.8246 5.8246 5.9178 5.9178 10.2166 10.2166 10.3305 10.3305 11.0011 11.0011 11.2783 11.2783 11.3451 11.3451 11.4485 11.4485 k = 0.2500 0.5000 0.2500 ( 7562 PWs) bands (ev): -27.4584 -27.4584 -27.4551 -27.4551 -27.4511 -27.4511 -27.3934 -27.3934 -10.3788 -10.3788 -10.3663 -10.3663 -10.3396 -10.3396 -10.3229 -10.3229 -9.3722 -9.3722 -9.3470 -9.3470 -9.3197 -9.3197 -9.2995 -9.2995 -9.1532 -9.1532 -9.1193 -9.1193 -9.0751 -9.0751 -9.0489 -9.0489 -7.8384 -7.8384 -4.4642 -4.4642 -4.4171 -4.4171 -4.3726 -4.3726 3.6427 3.6427 3.7869 3.7869 3.8579 3.8579 4.1023 4.1023 4.6165 4.6165 4.7208 4.7208 4.7516 4.7516 4.7852 4.7852 4.9795 4.9795 5.7445 5.7445 5.8385 5.8385 5.9354 5.9354 10.1179 10.1179 10.2821 10.2821 10.9573 10.9573 11.2185 11.2185 11.3215 11.3215 11.3843 11.3843 k = 0.2368 0.5000 0.2368 ( 7556 PWs) bands (ev): -27.4588 -27.4588 -27.4552 -27.4552 -27.4508 -27.4508 -27.3934 -27.3934 -10.3770 -10.3770 -10.3645 -10.3645 -10.3363 -10.3363 -10.3191 -10.3191 -9.3686 -9.3686 -9.3432 -9.3432 -9.3136 -9.3136 -9.2934 -9.2934 -9.1590 -9.1590 -9.1225 -9.1225 -9.0783 -9.0783 -9.0501 -9.0501 -7.8483 -7.8483 -4.4865 -4.4865 -4.4357 -4.4357 -4.3876 -4.3876 3.6878 3.6878 3.8118 3.8118 3.8958 3.8958 4.1591 4.1591 4.6182 4.6182 4.7352 4.7352 4.7733 4.7733 4.7994 4.7994 5.0139 5.0139 5.7448 5.7448 5.8537 5.8537 5.9532 5.9532 10.0210 10.0210 10.2326 10.2326 10.9154 10.9154 11.1594 11.1594 11.2985 11.2985 11.3181 11.3181 k = 0.2237 0.5000 0.2237 ( 7556 PWs) bands (ev): -27.4591 -27.4591 -27.4552 -27.4552 -27.4505 -27.4505 -27.3933 -27.3933 -10.3753 -10.3753 -10.3630 -10.3630 -10.3329 -10.3329 -10.3154 -10.3154 -9.3648 -9.3648 -9.3392 -9.3392 -9.3073 -9.3073 -9.2872 -9.2872 -9.1649 -9.1649 -9.1259 -9.1259 -9.0814 -9.0814 -9.0513 -9.0513 -7.8582 -7.8582 -4.5085 -4.5085 -4.4541 -4.4541 -4.4025 -4.4025 3.7327 3.7327 3.8355 3.8355 3.9341 3.9341 4.2145 4.2145 4.6198 4.6198 4.7501 4.7501 4.7979 4.7979 4.8136 4.8136 5.0486 5.0486 5.7447 5.7447 5.8702 5.8702 5.9710 5.9710 9.9263 9.9263 10.1823 10.1823 10.8758 10.8758 11.1015 11.1015 11.2506 11.2506 11.2762 11.2762 k = 0.2105 0.5000 0.2105 ( 7550 PWs) bands (ev): -27.4594 -27.4594 -27.4553 -27.4553 -27.4502 -27.4502 -27.3933 -27.3933 -10.3737 -10.3737 -10.3616 -10.3616 -10.3295 -10.3295 -10.3117 -10.3117 -9.3609 -9.3609 -9.3351 -9.3351 -9.3009 -9.3009 -9.2810 -9.2810 -9.1708 -9.1708 -9.1294 -9.1294 -9.0844 -9.0844 -9.0524 -9.0524 -7.8681 -7.8681 -4.5303 -4.5303 -4.4722 -4.4722 -4.4172 -4.4172 3.7772 3.7772 3.8580 3.8580 3.9725 3.9725 4.2676 4.2676 4.6215 4.6215 4.7653 4.7653 4.8230 4.8230 4.8303 4.8303 5.0834 5.0834 5.7442 5.7442 5.8880 5.8880 5.9887 5.9887 9.8340 9.8340 10.1315 10.1315 10.8387 10.8387 11.0454 11.0454 11.1825 11.1825 11.2548 11.2548 k = 0.1974 0.5000 0.1974 ( 7542 PWs) bands (ev): -27.4597 -27.4597 -27.4554 -27.4554 -27.4500 -27.4500 -27.3932 -27.3932 -10.3721 -10.3721 -10.3605 -10.3605 -10.3262 -10.3262 -10.3081 -10.3081 -9.3568 -9.3568 -9.3309 -9.3309 -9.2943 -9.2943 -9.2749 -9.2749 -9.1769 -9.1769 -9.1331 -9.1331 -9.0872 -9.0872 -9.0536 -9.0536 -7.8779 -7.8779 -4.5516 -4.5516 -4.4899 -4.4899 -4.4316 -4.4316 3.8210 3.8210 3.8791 3.8791 4.0107 4.0107 4.3178 4.3178 4.6231 4.6231 4.7808 4.7808 4.8384 4.8384 4.8600 4.8600 5.1182 5.1182 5.7433 5.7433 5.9069 5.9069 6.0063 6.0063 9.7445 9.7445 10.0806 10.0806 10.8041 10.8041 10.9913 10.9913 11.1144 11.1144 11.2344 11.2344 k = 0.1842 0.5000 0.1842 ( 7542 PWs) bands (ev): -27.4600 -27.4600 -27.4554 -27.4554 -27.4497 -27.4497 -27.3932 -27.3932 -10.3706 -10.3706 -10.3595 -10.3595 -10.3229 -10.3229 -10.3046 -10.3046 -9.3525 -9.3525 -9.3266 -9.3266 -9.2878 -9.2878 -9.2688 -9.2688 -9.1829 -9.1829 -9.1368 -9.1368 -9.0900 -9.0900 -9.0547 -9.0547 -7.8875 -7.8875 -4.5722 -4.5722 -4.5071 -4.5071 -4.4455 -4.4455 3.8636 3.8636 3.8988 3.8988 4.0484 4.0484 4.3642 4.3642 4.6247 4.6247 4.7962 4.7962 4.8510 4.8510 4.8960 4.8960 5.1526 5.1526 5.7419 5.7419 5.9270 5.9270 6.0235 6.0235 9.6579 9.6579 10.0297 10.0297 10.7720 10.7720 10.9398 10.9398 11.0471 11.0471 11.2149 11.2149 k = 0.1711 0.5000 0.1711 ( 7532 PWs) bands (ev): -27.4603 -27.4603 -27.4555 -27.4555 -27.4494 -27.4494 -27.3932 -27.3932 -10.3692 -10.3692 -10.3586 -10.3586 -10.3198 -10.3198 -10.3012 -10.3012 -9.3481 -9.3481 -9.3222 -9.3222 -9.2813 -9.2813 -9.2630 -9.2630 -9.1889 -9.1889 -9.1407 -9.1407 -9.0926 -9.0926 -9.0557 -9.0557 -7.8968 -7.8968 -4.5921 -4.5921 -4.5237 -4.5237 -4.4590 -4.4590 3.9048 3.9048 3.9170 3.9170 4.0855 4.0855 4.4063 4.4063 4.6264 4.6264 4.8116 4.8116 4.8625 4.8625 4.9362 4.9362 5.1865 5.1865 5.7400 5.7400 5.9481 5.9481 6.0402 6.0402 9.5745 9.5745 9.9795 9.9795 10.7426 10.7426 10.8909 10.8909 10.9811 10.9811 11.1964 11.1964 k = 0.1579 0.5000 0.1579 ( 7550 PWs) bands (ev): -27.4605 -27.4605 -27.4556 -27.4556 -27.4492 -27.4492 -27.3931 -27.3931 -10.3678 -10.3678 -10.3580 -10.3580 -10.3167 -10.3167 -10.2980 -10.2980 -9.3435 -9.3435 -9.3176 -9.3176 -9.2750 -9.2750 -9.2574 -9.2574 -9.1949 -9.1949 -9.1446 -9.1446 -9.0951 -9.0951 -9.0567 -9.0567 -7.9059 -7.9059 -4.6111 -4.6111 -4.5396 -4.5396 -4.4718 -4.4718 3.9334 3.9334 3.9444 3.9444 4.1217 4.1217 4.4440 4.4440 4.6280 4.6280 4.8265 4.8265 4.8732 4.8732 4.9802 4.9802 5.2196 5.2196 5.7375 5.7375 5.9698 5.9698 6.0565 6.0565 9.4946 9.4946 9.9302 9.9302 10.7157 10.7157 10.8452 10.8452 10.9172 10.9172 11.1780 11.1780 k = 0.1447 0.5000 0.1447 ( 7566 PWs) bands (ev): -27.4608 -27.4608 -27.4556 -27.4556 -27.4489 -27.4489 -27.3931 -27.3931 -10.3666 -10.3666 -10.3574 -10.3574 -10.3139 -10.3139 -10.2950 -10.2950 -9.3388 -9.3388 -9.3130 -9.3130 -9.2690 -9.2690 -9.2521 -9.2521 -9.2008 -9.2008 -9.1485 -9.1485 -9.0975 -9.0975 -9.0577 -9.0577 -7.9145 -7.9145 -4.6291 -4.6291 -4.5546 -4.5546 -4.4840 -4.4840 3.9485 3.9485 3.9817 3.9817 4.1566 4.1566 4.4772 4.4772 4.6297 4.6297 4.8410 4.8410 4.8828 4.8828 5.0270 5.0270 5.2515 5.2515 5.7343 5.7343 5.9921 5.9921 6.0720 6.0720 9.4186 9.4186 9.8823 9.8823 10.6912 10.6912 10.8026 10.8026 10.8560 10.8560 11.1566 11.1566 k = 0.1316 0.5000 0.1316 ( 7550 PWs) bands (ev): -27.4610 -27.4610 -27.4557 -27.4557 -27.4487 -27.4487 -27.3930 -27.3930 -10.3654 -10.3654 -10.3570 -10.3570 -10.3112 -10.3112 -10.2922 -10.2922 -9.3339 -9.3339 -9.3083 -9.3083 -9.2633 -9.2633 -9.2475 -9.2475 -9.2063 -9.2063 -9.1524 -9.1524 -9.0996 -9.0996 -9.0586 -9.0586 -7.9227 -7.9227 -4.6459 -4.6459 -4.5687 -4.5687 -4.4954 -4.4954 3.9619 3.9619 4.0167 4.0167 4.1899 4.1899 4.5062 4.5062 4.6315 4.6315 4.8547 4.8547 4.8915 4.8915 5.0758 5.0758 5.2822 5.2822 5.7306 5.7306 6.0144 6.0144 6.0869 6.0869 9.3467 9.3467 9.8362 9.8362 10.6691 10.6691 10.7634 10.7634 10.7983 10.7983 11.1313 11.1313 k = 0.1184 0.5000 0.1184 ( 7546 PWs) bands (ev): -27.4613 -27.4613 -27.4558 -27.4558 -27.4485 -27.4485 -27.3930 -27.3930 -10.3644 -10.3644 -10.3567 -10.3567 -10.3087 -10.3087 -10.2897 -10.2897 -9.3289 -9.3289 -9.3035 -9.3035 -9.2581 -9.2581 -9.2436 -9.2436 -9.2114 -9.2114 -9.1561 -9.1561 -9.1017 -9.1017 -9.0594 -9.0594 -7.9304 -7.9304 -4.6615 -4.6615 -4.5817 -4.5817 -4.5060 -4.5060 3.9739 3.9739 4.0491 4.0491 4.2215 4.2215 4.5312 4.5312 4.6334 4.6334 4.8676 4.8676 4.8990 4.8990 5.1253 5.1253 5.3114 5.3114 5.7262 5.7262 6.0365 6.0365 6.1008 6.1008 9.2795 9.2795 9.7925 9.7925 10.6491 10.6491 10.7275 10.7275 10.7449 10.7449 11.1064 11.1064 k = 0.1053 0.5000 0.1053 ( 7554 PWs) bands (ev): -27.4615 -27.4615 -27.4558 -27.4558 -27.4483 -27.4483 -27.3929 -27.3929 -10.3634 -10.3634 -10.3565 -10.3565 -10.3064 -10.3064 -10.2873 -10.2873 -9.3237 -9.3237 -9.2989 -9.2989 -9.2535 -9.2535 -9.2409 -9.2409 -9.2154 -9.2154 -9.1597 -9.1597 -9.1035 -9.1035 -9.0602 -9.0602 -7.9374 -7.9374 -4.6758 -4.6758 -4.5936 -4.5936 -4.5156 -4.5156 3.9844 3.9844 4.0786 4.0786 4.2509 4.2509 4.5527 4.5527 4.6356 4.6356 4.8794 4.8794 4.9055 4.9055 5.1743 5.1743 5.3389 5.3389 5.7212 5.7212 6.0579 6.0579 6.1139 6.1139 9.2172 9.2172 9.7515 9.7515 10.6309 10.6309 10.6922 10.6922 10.6994 10.6994 11.0837 11.0837 k = 0.0921 0.5000 0.0921 ( 7558 PWs) bands (ev): -27.4616 -27.4616 -27.4559 -27.4559 -27.4482 -27.4482 -27.3929 -27.3929 -10.3625 -10.3625 -10.3563 -10.3563 -10.3044 -10.3044 -10.2852 -10.2852 -9.3185 -9.3185 -9.2943 -9.2943 -9.2500 -9.2500 -9.2399 -9.2399 -9.2178 -9.2178 -9.1631 -9.1631 -9.1052 -9.1052 -9.0609 -9.0609 -7.9438 -7.9438 -4.6886 -4.6886 -4.6043 -4.6043 -4.5243 -4.5243 3.9935 3.9935 4.1050 4.1050 4.2778 4.2778 4.5707 4.5707 4.6380 4.6380 4.8901 4.8901 4.9110 4.9110 5.2214 5.2214 5.3647 5.3647 5.7154 5.7154 6.0780 6.0780 6.1261 6.1261 9.1605 9.1605 9.7138 9.7138 10.6135 10.6135 10.6516 10.6516 10.6693 10.6693 11.0634 11.0634 k = 0.0789 0.5000 0.0789 ( 7550 PWs) bands (ev): -27.4618 -27.4618 -27.4559 -27.4559 -27.4480 -27.4480 -27.3929 -27.3929 -10.3616 -10.3616 -10.3563 -10.3563 -10.3026 -10.3026 -10.2834 -10.2834 -9.3131 -9.3131 -9.2899 -9.2899 -9.2484 -9.2484 -9.2401 -9.2401 -9.2181 -9.2181 -9.1661 -9.1661 -9.1067 -9.1067 -9.0615 -9.0615 -7.9495 -7.9495 -4.6999 -4.6999 -4.6137 -4.6137 -4.5320 -4.5320 4.0012 4.0012 4.1280 4.1280 4.3020 4.3020 4.5853 4.5853 4.6409 4.6409 4.8995 4.8995 4.9155 4.9155 5.2651 5.2651 5.3887 5.3887 5.7091 5.7091 6.0963 6.0963 6.1372 6.1372 9.1098 9.1098 9.6799 9.6799 10.5931 10.5931 10.6193 10.6193 10.6449 10.6449 11.0456 11.0456 k = 0.0658 0.5000 0.0658 ( 7558 PWs) bands (ev): -27.4619 -27.4619 -27.4560 -27.4560 -27.4479 -27.4479 -27.3928 -27.3928 -10.3609 -10.3609 -10.3563 -10.3563 -10.3010 -10.3010 -10.2818 -10.2818 -9.3077 -9.3077 -9.2857 -9.2857 -9.2501 -9.2501 -9.2395 -9.2395 -9.2171 -9.2171 -9.1688 -9.1688 -9.1080 -9.1080 -9.0621 -9.0621 -7.9544 -7.9544 -4.7096 -4.7096 -4.6218 -4.6218 -4.5385 -4.5385 4.0076 4.0076 4.1477 4.1477 4.3231 4.3231 4.5967 4.5967 4.6444 4.6444 4.9075 4.9075 4.9190 4.9190 5.3040 5.3040 5.4110 5.4110 5.7023 5.7023 6.1121 6.1121 6.1475 6.1475 9.0656 9.0656 9.6501 9.6501 10.5664 10.5664 10.6004 10.6004 10.6248 10.6248 11.0302 11.0302 k = 0.0526 0.5000 0.0526 ( 7566 PWs) bands (ev): -27.4621 -27.4621 -27.4560 -27.4560 -27.4478 -27.4478 -27.3928 -27.3928 -10.3602 -10.3602 -10.3565 -10.3565 -10.2998 -10.2998 -10.2805 -10.2805 -9.3022 -9.3022 -9.2820 -9.2820 -9.2541 -9.2541 -9.2384 -9.2384 -9.2154 -9.2154 -9.1711 -9.1711 -9.1091 -9.1091 -9.0626 -9.0626 -7.9585 -7.9585 -4.7176 -4.7176 -4.6285 -4.6285 -4.5439 -4.5439 4.0128 4.0128 4.1639 4.1639 4.3408 4.3408 4.6050 4.6050 4.6483 4.6483 4.9141 4.9141 4.9218 4.9218 5.3367 5.3367 5.4315 5.4315 5.6952 5.6952 6.1251 6.1251 6.1567 6.1567 9.0286 9.0286 9.6251 9.6251 10.5403 10.5403 10.5885 10.5885 10.6088 10.6088 11.0173 11.0173 k = 0.0395 0.5000 0.0395 ( 7570 PWs) bands (ev): -27.4622 -27.4622 -27.4560 -27.4560 -27.4477 -27.4477 -27.3928 -27.3928 -10.3596 -10.3596 -10.3566 -10.3566 -10.2988 -10.2988 -10.2795 -10.2795 -9.2968 -9.2968 -9.2787 -9.2787 -9.2590 -9.2590 -9.2374 -9.2374 -9.2138 -9.2138 -9.1729 -9.1729 -9.1099 -9.1099 -9.0629 -9.0629 -7.9617 -7.9617 -4.7239 -4.7239 -4.6337 -4.6337 -4.5482 -4.5482 4.0168 4.0168 4.1766 4.1766 4.3549 4.3549 4.6107 4.6107 4.6523 4.6523 4.9191 4.9191 4.9240 4.9240 5.3621 5.3621 5.4501 5.4501 5.6882 5.6882 6.1350 6.1350 6.1646 6.1646 8.9991 8.9991 9.6052 9.6052 10.5189 10.5189 10.5796 10.5796 10.5970 10.5970 11.0067 11.0067 k = 0.0263 0.5000 0.0263 ( 7570 PWs) bands (ev): -27.4622 -27.4622 -27.4561 -27.4561 -27.4476 -27.4476 -27.3928 -27.3928 -10.3591 -10.3591 -10.3568 -10.3568 -10.2981 -10.2981 -10.2788 -10.2788 -9.2916 -9.2916 -9.2763 -9.2763 -9.2640 -9.2640 -9.2369 -9.2369 -9.2125 -9.2125 -9.1742 -9.1742 -9.1105 -9.1105 -9.0632 -9.0632 -7.9641 -7.9641 -4.7284 -4.7284 -4.6375 -4.6375 -4.5513 -4.5513 4.0196 4.0196 4.1856 4.1856 4.3652 4.3652 4.6141 4.6141 4.6557 4.6557 4.9224 4.9224 4.9258 4.9258 5.3799 5.3799 5.4654 5.4654 5.6821 5.6821 6.1418 6.1418 6.1709 6.1709 8.9778 8.9778 9.5906 9.5906 10.5033 10.5033 10.5730 10.5730 10.5892 10.5892 10.9988 10.9988 k = 0.0132 0.5000 0.0132 ( 7558 PWs) bands (ev): -27.4623 -27.4623 -27.4561 -27.4561 -27.4476 -27.4476 -27.3928 -27.3928 -10.3587 -10.3587 -10.3570 -10.3570 -10.2976 -10.2976 -10.2783 -10.2783 -9.2871 -9.2871 -9.2747 -9.2747 -9.2684 -9.2684 -9.2366 -9.2366 -9.2116 -9.2116 -9.1750 -9.1750 -9.1109 -9.1109 -9.0634 -9.0634 -7.9655 -7.9655 -4.7311 -4.7311 -4.6398 -4.6398 -4.5531 -4.5531 4.0213 4.0213 4.1910 4.1910 4.3714 4.3714 4.6160 4.6160 4.6579 4.6579 4.9240 4.9240 4.9272 4.9272 5.3902 5.3902 5.4758 5.4758 5.6778 5.6778 6.1458 6.1458 6.1749 6.1749 8.9648 8.9648 9.5818 9.5818 10.4938 10.4938 10.5688 10.5688 10.5847 10.5847 10.9938 10.9938 k = 0.0000 0.5000-0.0000 ( 7528 PWs) bands (ev): -27.4623 -27.4623 -27.4561 -27.4561 -27.4476 -27.4476 -27.3928 -27.3928 -10.3586 -10.3586 -10.3571 -10.3571 -10.2975 -10.2975 -10.2782 -10.2782 -9.2850 -9.2850 -9.2741 -9.2741 -9.2705 -9.2705 -9.2366 -9.2366 -9.2113 -9.2113 -9.1752 -9.1752 -9.1110 -9.1110 -9.0634 -9.0634 -7.9659 -7.9659 -4.7320 -4.7320 -4.6405 -4.6405 -4.5537 -4.5537 4.0218 4.0218 4.1928 4.1928 4.3735 4.3735 4.6166 4.6166 4.6587 4.6587 4.9244 4.9244 4.9278 4.9278 5.3936 5.3936 5.4796 5.4796 5.6763 5.6763 6.1471 6.1471 6.1763 6.1763 8.9604 8.9604 9.5789 9.5789 10.4906 10.4906 10.5674 10.5674 10.5833 10.5833 10.9920 10.9920 k = 0.5000 0.5000-0.0000 ( 7532 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3937 -27.3937 -10.3653 -10.3653 -10.3547 -10.3547 -10.3392 -10.3392 -10.3357 -10.3357 -9.3550 -9.3550 -9.3456 -9.3456 -9.3379 -9.3379 -9.2866 -9.2866 -9.1603 -9.1603 -9.1233 -9.1233 -9.0762 -9.0762 -9.0757 -9.0757 -7.8345 -7.8345 -4.4140 -4.4140 -4.4114 -4.4114 -4.4104 -4.4104 3.6081 3.6081 3.6300 3.6300 4.0153 4.0153 4.0514 4.0514 4.6737 4.6737 4.6782 4.6782 4.8586 4.8586 4.8838 4.8838 4.8839 4.8839 5.7222 5.7222 5.7344 5.7344 5.9789 5.9789 10.4705 10.4705 11.0654 11.0654 11.2557 11.2557 11.2650 11.2650 11.2902 11.2902 11.5512 11.5512 k = 0.5000 0.5000 0.0185 ( 7544 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3937 -27.3937 -10.3654 -10.3654 -10.3550 -10.3550 -10.3392 -10.3392 -10.3359 -10.3359 -9.3554 -9.3554 -9.3455 -9.3455 -9.3381 -9.3381 -9.2870 -9.2870 -9.1599 -9.1599 -9.1232 -9.1232 -9.0760 -9.0760 -9.0755 -9.0755 -7.8342 -7.8342 -4.4133 -4.4133 -4.4107 -4.4107 -4.4097 -4.4097 3.6075 3.6075 3.6283 3.6283 4.0134 4.0134 4.0495 4.0495 4.6734 4.6734 4.6779 4.6779 4.8574 4.8574 4.8823 4.8823 4.8824 4.8824 5.7223 5.7223 5.7346 5.7346 5.9780 5.9780 10.4708 10.4708 11.0632 11.0632 11.2518 11.2518 11.2613 11.2613 11.2928 11.2928 11.5582 11.5582 k = 0.5000 0.5000 0.0370 ( 7560 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3937 -27.3937 -10.3659 -10.3659 -10.3556 -10.3556 -10.3393 -10.3393 -10.3363 -10.3363 -9.3567 -9.3567 -9.3451 -9.3451 -9.3388 -9.3388 -9.2883 -9.2883 -9.1587 -9.1587 -9.1229 -9.1229 -9.0754 -9.0754 -9.0749 -9.0749 -7.8330 -7.8330 -4.4111 -4.4111 -4.4085 -4.4085 -4.4075 -4.4075 3.6057 3.6057 3.6232 3.6232 4.0080 4.0080 4.0438 4.0438 4.6726 4.6726 4.6771 4.6771 4.8541 4.8541 4.8779 4.8779 4.8782 4.8782 5.7227 5.7227 5.7350 5.7350 5.9753 5.9753 10.4719 10.4719 11.0571 11.0571 11.2416 11.2416 11.2513 11.2513 11.3011 11.3011 11.5774 11.5774 k = 0.5000 0.5000 0.0556 ( 7568 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3937 -27.3937 -10.3665 -10.3665 -10.3567 -10.3567 -10.3394 -10.3394 -10.3370 -10.3370 -9.3585 -9.3585 -9.3447 -9.3447 -9.3401 -9.3401 -9.2904 -9.2904 -9.1569 -9.1569 -9.1224 -9.1224 -9.0745 -9.0745 -9.0739 -9.0739 -7.8312 -7.8312 -4.4075 -4.4075 -4.4050 -4.4050 -4.4040 -4.4040 3.6027 3.6027 3.6147 3.6147 3.9991 3.9991 4.0342 4.0342 4.6712 4.6712 4.6758 4.6758 4.8487 4.8487 4.8706 4.8706 4.8714 4.8714 5.7234 5.7234 5.7358 5.7358 5.9710 5.9710 10.4738 10.4738 11.0485 11.0485 11.2283 11.2283 11.2380 11.2380 11.3152 11.3152 11.6051 11.6051 k = 0.5000 0.5000 0.0741 ( 7552 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3675 -10.3675 -10.3581 -10.3581 -10.3397 -10.3397 -10.3379 -10.3379 -9.3607 -9.3607 -9.3444 -9.3444 -9.3417 -9.3417 -9.2932 -9.2932 -9.1544 -9.1544 -9.1216 -9.1216 -9.0731 -9.0731 -9.0726 -9.0726 -7.8287 -7.8287 -4.4025 -4.4025 -4.4001 -4.4001 -4.3991 -4.3991 3.5986 3.5986 3.6031 3.6031 3.9866 3.9866 4.0210 4.0210 4.6693 4.6693 4.6739 4.6739 4.8413 4.8413 4.8608 4.8608 4.8622 4.8622 5.7242 5.7242 5.7367 5.7367 5.9650 5.9650 10.4768 10.4768 11.0391 11.0391 11.2150 11.2150 11.2246 11.2246 11.3345 11.3345 11.6371 11.6371 k = 0.5000 0.5000 0.0926 ( 7572 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3687 -10.3687 -10.3599 -10.3599 -10.3400 -10.3400 -10.3391 -10.3391 -9.3632 -9.3632 -9.3442 -9.3442 -9.3438 -9.3438 -9.2966 -9.2966 -9.1514 -9.1514 -9.1207 -9.1207 -9.0715 -9.0715 -9.0709 -9.0709 -7.8254 -7.8254 -4.3962 -4.3962 -4.3938 -4.3938 -4.3929 -4.3929 3.5883 3.5883 3.5934 3.5934 3.9707 3.9707 4.0042 4.0042 4.6669 4.6669 4.6716 4.6716 4.8319 4.8319 4.8489 4.8489 4.8510 4.8510 5.7252 5.7252 5.7377 5.7377 5.9575 5.9575 10.4812 10.4812 11.0306 11.0306 11.2039 11.2039 11.2135 11.2135 11.3583 11.3583 11.6702 11.6702 k = 0.5000 0.5000 0.1111 ( 7572 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3701 -10.3701 -10.3619 -10.3619 -10.3406 -10.3406 -10.3406 -10.3406 -9.3659 -9.3659 -9.3462 -9.3462 -9.3443 -9.3443 -9.3004 -9.3004 -9.1480 -9.1480 -9.1196 -9.1196 -9.0696 -9.0696 -9.0690 -9.0690 -7.8216 -7.8216 -4.3887 -4.3887 -4.3864 -4.3864 -4.3854 -4.3854 3.5705 3.5705 3.5872 3.5872 3.9515 3.9515 3.9840 3.9840 4.6640 4.6640 4.6688 4.6688 4.8209 4.8209 4.8352 4.8352 4.8381 4.8381 5.7262 5.7262 5.7388 5.7388 5.9485 5.9485 10.4872 10.4872 11.0246 11.0246 11.1963 11.1963 11.2060 11.2060 11.3860 11.3860 11.7021 11.7021 k = 0.5000 0.5000 0.1296 ( 7576 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3717 -10.3717 -10.3642 -10.3642 -10.3423 -10.3423 -10.3412 -10.3412 -9.3687 -9.3687 -9.3489 -9.3489 -9.3447 -9.3447 -9.3045 -9.3045 -9.1443 -9.1443 -9.1182 -9.1182 -9.0675 -9.0675 -9.0668 -9.0668 -7.8172 -7.8172 -4.3800 -4.3800 -4.3778 -4.3778 -4.3769 -4.3769 3.5501 3.5501 3.5800 3.5800 3.9292 3.9292 3.9605 3.9605 4.6607 4.6607 4.6656 4.6656 4.8082 4.8082 4.8203 4.8203 4.8239 4.8239 5.7272 5.7272 5.7398 5.7398 5.9382 5.9382 10.4951 10.4951 11.0222 11.0222 11.1931 11.1931 11.2030 11.2030 11.4168 11.4168 11.7312 11.7312 k = 0.5000 0.5000 0.1481 ( 7560 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3735 -10.3735 -10.3667 -10.3667 -10.3441 -10.3441 -10.3420 -10.3420 -9.3716 -9.3716 -9.3519 -9.3519 -9.3452 -9.3452 -9.3089 -9.3089 -9.1403 -9.1403 -9.1168 -9.1168 -9.0652 -9.0652 -9.0645 -9.0645 -7.8123 -7.8123 -4.3703 -4.3703 -4.3682 -4.3682 -4.3673 -4.3673 3.5271 3.5271 3.5721 3.5721 3.9040 3.9040 3.9341 3.9341 4.6570 4.6570 4.6620 4.6620 4.7941 4.7941 4.8048 4.8048 4.8087 4.8087 5.7280 5.7280 5.7408 5.7408 5.9268 5.9268 10.5051 10.5051 11.0243 11.0243 11.1947 11.1947 11.2047 11.2047 11.4500 11.4500 11.7568 11.7568 k = 0.5000 0.5000 0.1667 ( 7572 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3755 -10.3755 -10.3693 -10.3693 -10.3461 -10.3461 -10.3429 -10.3429 -9.3746 -9.3746 -9.3551 -9.3551 -9.3460 -9.3460 -9.3134 -9.3134 -9.1363 -9.1363 -9.1152 -9.1152 -9.0628 -9.0628 -9.0620 -9.0620 -7.8070 -7.8070 -4.3596 -4.3596 -4.3577 -4.3577 -4.3568 -4.3568 3.5020 3.5020 3.5635 3.5635 3.8762 3.8762 3.9049 3.9049 4.6530 4.6530 4.6581 4.6581 4.7787 4.7787 4.7890 4.7890 4.7930 4.7930 5.7287 5.7287 5.7416 5.7416 5.9144 5.9144 10.5174 10.5174 11.0313 11.0313 11.2012 11.2012 11.2114 11.2114 11.4849 11.4849 11.7787 11.7787 k = 0.5000 0.5000 0.1852 ( 7572 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3776 -10.3776 -10.3721 -10.3721 -10.3483 -10.3483 -10.3440 -10.3440 -9.3776 -9.3776 -9.3585 -9.3585 -9.3469 -9.3469 -9.3180 -9.3180 -9.1323 -9.1323 -9.1134 -9.1134 -9.0603 -9.0603 -9.0595 -9.0595 -7.8013 -7.8013 -4.3482 -4.3482 -4.3464 -4.3464 -4.3455 -4.3455 3.4751 3.4751 3.5542 3.5542 3.8462 3.8462 3.8736 3.8736 4.6487 4.6487 4.6539 4.6539 4.7624 4.7624 4.7733 4.7733 4.7770 4.7770 5.7293 5.7293 5.7422 5.7422 5.9011 5.9011 10.5319 10.5319 11.0436 11.0436 11.2124 11.2124 11.2230 11.2230 11.5208 11.5208 11.7970 11.7970 k = 0.5000 0.5000 0.2037 ( 7564 PWs) bands (ev): -27.4548 -27.4548 -27.4548 -27.4548 -27.4547 -27.4547 -27.3936 -27.3936 -10.3798 -10.3798 -10.3749 -10.3749 -10.3506 -10.3506 -10.3451 -10.3451 -9.3806 -9.3806 -9.3619 -9.3619 -9.3480 -9.3480 -9.3225 -9.3225 -9.1282 -9.1282 -9.1116 -9.1116 -9.0577 -9.0577 -9.0569 -9.0569 -7.7953 -7.7953 -4.3362 -4.3362 -4.3345 -4.3345 -4.3336 -4.3336 3.4466 3.4466 3.5445 3.5445 3.8143 3.8143 3.8403 3.8403 4.6442 4.6442 4.6495 4.6495 4.7456 4.7456 4.7577 4.7577 4.7611 4.7611 5.7296 5.7296 5.7425 5.7425 5.8873 5.8873 10.5487 10.5487 11.0613 11.0613 11.2282 11.2282 11.2392 11.2392 11.5570 11.5570 11.8123 11.8123 k = 0.5000 0.5000 0.2222 ( 7556 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3936 -27.3936 -10.3821 -10.3821 -10.3778 -10.3778 -10.3529 -10.3529 -10.3464 -10.3464 -9.3835 -9.3835 -9.3654 -9.3654 -9.3492 -9.3492 -9.3269 -9.3269 -9.1242 -9.1242 -9.1098 -9.1098 -9.0551 -9.0551 -9.0543 -9.0543 -7.7891 -7.7891 -4.3236 -4.3236 -4.3221 -4.3221 -4.3213 -4.3213 3.4170 3.4170 3.5345 3.5345 3.7809 3.7809 3.8056 3.8056 4.6395 4.6395 4.6448 4.6448 4.7289 4.7289 4.7424 4.7424 4.7455 4.7455 5.7297 5.7297 5.7427 5.7427 5.8730 5.8730 10.5676 10.5676 11.0842 11.0842 11.2483 11.2483 11.2596 11.2596 11.5931 11.5931 11.8250 11.8250 k = 0.5000 0.5000 0.2407 ( 7564 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3936 -27.3936 -10.3844 -10.3844 -10.3807 -10.3807 -10.3553 -10.3553 -10.3477 -10.3477 -9.3863 -9.3863 -9.3689 -9.3689 -9.3504 -9.3504 -9.3312 -9.3312 -9.1203 -9.1203 -9.1079 -9.1079 -9.0525 -9.0525 -9.0517 -9.0517 -7.7828 -7.7828 -4.3108 -4.3108 -4.3094 -4.3094 -4.3086 -4.3086 3.3866 3.3866 3.5243 3.5243 3.7466 3.7466 3.7700 3.7700 4.6347 4.6347 4.6400 4.6400 4.7124 4.7124 4.7274 4.7274 4.7304 4.7304 5.7295 5.7295 5.7426 5.7426 5.8585 5.8585 10.5885 10.5885 11.1123 11.1123 11.2723 11.2723 11.2840 11.2840 11.6284 11.6284 11.8356 11.8356 k = 0.5000 0.5000 0.2593 ( 7572 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3936 -27.3936 -10.3868 -10.3868 -10.3836 -10.3836 -10.3577 -10.3577 -10.3491 -10.3491 -9.3891 -9.3891 -9.3724 -9.3724 -9.3518 -9.3518 -9.3354 -9.3354 -9.1166 -9.1166 -9.1060 -9.1060 -9.0500 -9.0500 -9.0492 -9.0492 -7.7764 -7.7764 -4.2978 -4.2978 -4.2965 -4.2965 -4.2958 -4.2958 3.3560 3.3560 3.5141 3.5141 3.7118 3.7118 3.7341 3.7341 4.6299 4.6299 4.6350 4.6350 4.6966 4.6966 4.7129 4.7129 4.7160 4.7160 5.7292 5.7292 5.7423 5.7423 5.8440 5.8440 10.6110 10.6110 11.1451 11.1451 11.2996 11.2996 11.3118 11.3118 11.6625 11.6625 11.8444 11.8444 k = 0.5000 0.5000 0.2778 ( 7572 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3935 -27.3935 -10.3891 -10.3891 -10.3864 -10.3864 -10.3601 -10.3601 -10.3505 -10.3505 -9.3917 -9.3917 -9.3758 -9.3758 -9.3531 -9.3531 -9.3393 -9.3393 -9.1131 -9.1131 -9.1041 -9.1041 -9.0475 -9.0475 -9.0468 -9.0468 -7.7702 -7.7702 -4.2849 -4.2849 -4.2837 -4.2837 -4.2830 -4.2830 3.3254 3.3254 3.5039 3.5039 3.6770 3.6770 3.6982 3.6982 4.6250 4.6250 4.6300 4.6300 4.6815 4.6815 4.6992 4.6992 4.7024 4.7024 5.7286 5.7286 5.7418 5.7418 5.8297 5.8297 10.6350 10.6350 11.1824 11.1824 11.3298 11.3298 11.3424 11.3424 11.6950 11.6950 11.8519 11.8519 k = 0.5000 0.5000 0.2963 ( 7548 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3935 -27.3935 -10.3914 -10.3914 -10.3891 -10.3891 -10.3624 -10.3624 -10.3519 -10.3519 -9.3941 -9.3941 -9.3790 -9.3790 -9.3544 -9.3544 -9.3429 -9.3429 -9.1097 -9.1097 -9.1022 -9.1022 -9.0452 -9.0452 -9.0445 -9.0445 -7.7640 -7.7640 -4.2721 -4.2721 -4.2710 -4.2710 -4.2704 -4.2704 3.2954 3.2954 3.4939 3.4939 3.6428 3.6428 3.6631 3.6631 4.6203 4.6203 4.6249 4.6249 4.6674 4.6674 4.6863 4.6863 4.6897 4.6897 5.7279 5.7279 5.7412 5.7412 5.8158 5.8158 10.6599 10.6599 11.2236 11.2236 11.3623 11.3623 11.3753 11.3753 11.7255 11.7255 11.8582 11.8582 k = 0.5000 0.5000 0.3148 ( 7564 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3935 -27.3935 -10.3936 -10.3936 -10.3917 -10.3917 -10.3647 -10.3647 -10.3533 -10.3533 -9.3964 -9.3964 -9.3821 -9.3821 -9.3558 -9.3558 -9.3463 -9.3463 -9.1066 -9.1066 -9.1005 -9.1005 -9.0430 -9.0430 -9.0424 -9.0424 -7.7581 -7.7581 -4.2598 -4.2598 -4.2587 -4.2587 -4.2582 -4.2582 3.2664 3.2664 3.4843 3.4843 3.6096 3.6096 3.6290 3.6290 4.6156 4.6156 4.6198 4.6198 4.6541 4.6541 4.6745 4.6745 4.6780 4.6780 5.7271 5.7271 5.7405 5.7405 5.8025 5.8025 10.6854 10.6854 11.2681 11.2681 11.3963 11.3963 11.4097 11.4097 11.7538 11.7538 11.8637 11.8637 k = 0.5000 0.5000 0.3333 ( 7572 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3935 -27.3935 -10.3957 -10.3957 -10.3942 -10.3942 -10.3668 -10.3668 -10.3547 -10.3547 -9.3985 -9.3985 -9.3850 -9.3850 -9.3570 -9.3570 -9.3494 -9.3494 -9.1037 -9.1037 -9.0988 -9.0988 -9.0409 -9.0409 -9.0404 -9.0404 -7.7525 -7.7525 -4.2480 -4.2480 -4.2470 -4.2470 -4.2465 -4.2465 3.2387 3.2387 3.4751 3.4751 3.5780 3.5780 3.5967 3.5967 4.6111 4.6111 4.6147 4.6147 4.6420 4.6420 4.6638 4.6638 4.6673 4.6673 5.7261 5.7261 5.7397 5.7397 5.7899 5.7899 10.7109 10.7109 11.3152 11.3152 11.4312 11.4312 11.4449 11.4449 11.7796 11.7796 11.8683 11.8683 k = 0.5000 0.5000 0.3519 ( 7564 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3935 -27.3935 -10.3976 -10.3976 -10.3964 -10.3964 -10.3688 -10.3688 -10.3560 -10.3560 -9.4004 -9.4004 -9.3876 -9.3876 -9.3582 -9.3582 -9.3522 -9.3522 -9.1011 -9.1011 -9.0973 -9.0973 -9.0390 -9.0390 -9.0386 -9.0386 -7.7472 -7.7472 -4.2370 -4.2370 -4.2360 -4.2360 -4.2356 -4.2356 3.2127 3.2127 3.4664 3.4664 3.5483 3.5483 3.5665 3.5665 4.6069 4.6069 4.6096 4.6096 4.6309 4.6309 4.6544 4.6544 4.6578 4.6578 5.7250 5.7250 5.7388 5.7388 5.7783 5.7783 10.7359 10.7359 11.3640 11.3640 11.4661 11.4661 11.4800 11.4800 11.8027 11.8027 11.8723 11.8723 k = 0.5000 0.5000 0.3704 ( 7572 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.4547 -27.3935 -27.3935 -10.3994 -10.3994 -10.3985 -10.3985 -10.3706 -10.3706 -10.3571 -10.3571 -9.4021 -9.4021 -9.3900 -9.3900 -9.3593 -9.3593 -9.3547 -9.3547 -9.0988 -9.0988 -9.0959 -9.0959 -9.0373 -9.0373 -9.0370 -9.0370 -7.7424 -7.7424 -4.2268 -4.2268 -4.2258 -4.2258 -4.2255 -4.2255 3.1889 3.1889 3.4584 3.4584 3.5211 3.5211 3.5389 3.5389 4.6029 4.6029 4.6047 4.6047 4.6211 4.6211 4.6464 4.6464 4.6494 4.6494 5.7239 5.7239 5.7380 5.7380 5.7678 5.7678 10.7598 10.7598 11.4135 11.4135 11.5002 11.5002 11.5143 11.5143 11.8231 11.8231 11.8757 11.8757 k = 0.5000 0.5000 0.3889 ( 7568 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4546 -27.4546 -27.3935 -27.3935 -10.4010 -10.4010 -10.4004 -10.4004 -10.3723 -10.3723 -10.3582 -10.3582 -9.4036 -9.4036 -9.3922 -9.3922 -9.3602 -9.3602 -9.3569 -9.3569 -9.0968 -9.0968 -9.0947 -9.0947 -9.0358 -9.0358 -9.0356 -9.0356 -7.7381 -7.7381 -4.2177 -4.2177 -4.2167 -4.2167 -4.2164 -4.2164 3.1675 3.1675 3.4511 3.4511 3.4967 3.4967 3.5144 3.5144 4.5993 4.5993 4.6000 4.6000 4.6124 4.6124 4.6396 4.6396 4.6421 4.6421 5.7226 5.7226 5.7371 5.7371 5.7585 5.7585 10.7821 10.7821 11.4624 11.4624 11.5328 11.5328 11.5469 11.5469 11.8406 11.8406 11.8785 11.8785 k = 0.5000 0.5000 0.4074 ( 7568 PWs) bands (ev): -27.4547 -27.4547 -27.4547 -27.4547 -27.4546 -27.4546 -27.3935 -27.3935 -10.4024 -10.4024 -10.4020 -10.4020 -10.3737 -10.3737 -10.3591 -10.3591 -9.4049 -9.4049 -9.3940 -9.3940 -9.3611 -9.3611 -9.3588 -9.3588 -9.0951 -9.0951 -9.0936 -9.0936 -9.0346 -9.0346 -9.0344 -9.0344 -7.7344 -7.7344 -4.2097 -4.2097 -4.2087 -4.2087 -4.2085 -4.2085 3.1489 3.1489 3.4445 3.4445 3.4754 3.4754 3.4932 3.4932 4.5957 4.5957 4.5961 4.5961 4.6050 4.6050 4.6341 4.6341 4.6360 4.6360 5.7213 5.7213 5.7364 5.7364 5.7508 5.7508 10.8022 10.8022 11.5090 11.5090 11.5629 11.5629 11.5767 11.5767 11.8552 11.8552 11.8807 11.8807 k = 0.5000 0.5000 0.4259 ( 7584 PWs) bands (ev): -27.4547 -27.4547 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4036 -10.4036 -10.4033 -10.4033 -10.3749 -10.3749 -10.3599 -10.3599 -9.4060 -9.4060 -9.3955 -9.3955 -9.3618 -9.3618 -9.3603 -9.3603 -9.0936 -9.0936 -9.0927 -9.0927 -9.0335 -9.0335 -9.0334 -9.0334 -7.7312 -7.7312 -4.2030 -4.2030 -4.2020 -4.2020 -4.2019 -4.2019 3.1332 3.1332 3.4386 3.4386 3.4576 3.4576 3.4759 3.4759 4.5919 4.5919 4.5934 4.5934 4.5989 4.5989 4.6298 4.6298 4.6311 4.6311 5.7199 5.7199 5.7357 5.7357 5.7445 5.7445 10.8195 10.8195 11.5512 11.5512 11.5899 11.5899 11.6028 11.6028 11.8668 11.8668 11.8825 11.8825 k = 0.5000 0.5000 0.4444 ( 7600 PWs) bands (ev): -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4045 -10.4045 -10.4044 -10.4044 -10.3758 -10.3758 -10.3606 -10.3606 -9.4068 -9.4068 -9.3967 -9.3967 -9.3623 -9.3623 -9.3615 -9.3615 -9.0925 -9.0925 -9.0920 -9.0920 -9.0327 -9.0327 -9.0326 -9.0326 -7.7288 -7.7288 -4.1977 -4.1977 -4.1967 -4.1967 -4.1966 -4.1966 3.1209 3.1209 3.4334 3.4334 3.4435 3.4435 3.4627 3.4627 4.5888 4.5888 4.5912 4.5912 4.5942 4.5942 4.6265 4.6265 4.6273 4.6273 5.7185 5.7185 5.7352 5.7352 5.7399 5.7399 10.8336 10.8336 11.5863 11.5863 11.6135 11.6135 11.6243 11.6243 11.8755 11.8755 11.8838 11.8838 k = 0.5000 0.5000 0.4630 ( 7584 PWs) bands (ev): -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4052 -10.4052 -10.4051 -10.4051 -10.3765 -10.3765 -10.3610 -10.3610 -9.4074 -9.4074 -9.3976 -9.3976 -9.3627 -9.3627 -9.3623 -9.3623 -9.0917 -9.0917 -9.0915 -9.0915 -9.0321 -9.0321 -9.0320 -9.0320 -7.7270 -7.7270 -4.1939 -4.1939 -4.1928 -4.1928 -4.1928 -4.1928 3.1119 3.1119 3.4291 3.4291 3.4333 3.4333 3.4537 3.4537 4.5864 4.5864 4.5895 4.5895 4.5909 4.5909 4.6242 4.6242 4.6246 4.6246 5.7172 5.7172 5.7348 5.7348 5.7368 5.7368 10.8439 10.8439 11.6112 11.6112 11.6337 11.6337 11.6404 11.6404 11.8813 11.8813 11.8846 11.8846 k = 0.5000 0.5000 0.4815 ( 7568 PWs) bands (ev): -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4056 -10.4056 -10.4056 -10.4056 -10.3769 -10.3769 -10.3613 -10.3613 -9.4077 -9.4077 -9.3981 -9.3981 -9.3629 -9.3629 -9.3629 -9.3629 -9.0912 -9.0912 -9.0912 -9.0912 -9.0317 -9.0317 -9.0317 -9.0317 -7.7259 -7.7259 -4.1916 -4.1916 -4.1905 -4.1905 -4.1905 -4.1905 3.1065 3.1065 3.4261 3.4261 3.4271 3.4271 3.4487 3.4487 4.5849 4.5849 4.5885 4.5885 4.5889 4.5889 4.6229 4.6229 4.6230 4.6230 5.7163 5.7163 5.7345 5.7345 5.7350 5.7350 10.8503 10.8503 11.6251 11.6251 11.6483 11.6483 11.6503 11.6503 11.8844 11.8844 11.8851 11.8851 k = 0.5000 0.5000 0.5000 ( 7568 PWs) bands (ev): -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.4546 -27.3935 -27.3935 -10.4057 -10.4057 -10.4057 -10.4057 -10.3771 -10.3771 -10.3614 -10.3614 -9.4079 -9.4079 -9.3983 -9.3983 -9.3630 -9.3630 -9.3630 -9.3630 -9.0911 -9.0911 -9.0911 -9.0911 -9.0316 -9.0316 -9.0316 -9.0316 -7.7255 -7.7255 -4.1908 -4.1908 -4.1897 -4.1897 -4.1897 -4.1897 3.1047 3.1047 3.4250 3.4250 3.4250 3.4250 3.4471 3.4471 4.5844 4.5844 4.5882 4.5882 4.5882 4.5882 4.6224 4.6224 4.6224 4.6224 5.7160 5.7160 5.7345 5.7345 5.7345 5.7345 10.8524 10.8524 11.6294 11.6294 11.6537 11.6537 11.6537 11.6537 11.8853 11.8853 11.8853 11.8853 Writing output data file Sr4S3O.save init_run : 3.76s CPU 13.97s WALL ( 1 calls) electrons : 1788.44s CPU 1803.82s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.08s WALL ( 1 calls) potinit : 0.38s CPU 1.43s WALL ( 1 calls) Called by electrons: c_bands : 1788.41s CPU 1803.57s WALL ( 1 calls) v_of_rho : 0.16s CPU 0.86s WALL ( 1 calls) v_h : 0.00s CPU 0.01s WALL ( 1 calls) v_xc : 0.15s CPU 0.53s WALL ( 1 calls) newd : 0.79s CPU 0.97s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.14s WALL ( 210 calls) cegterg : 1717.05s CPU 1730.47s WALL ( 950 calls) Called by sum_band: Called by *egterg: h_psi : 673.46s CPU 684.84s WALL ( 18490 calls) s_psi : 88.12s CPU 88.49s WALL ( 18490 calls) g_psi : 1.34s CPU 1.36s WALL ( 17330 calls) cdiaghg : 729.15s CPU 725.67s WALL ( 17540 calls) cegterg:over : 120.70s CPU 116.10s WALL ( 17330 calls) cegterg:upda : 41.15s CPU 45.94s WALL ( 17330 calls) cegterg:last : 25.94s CPU 26.54s WALL ( 1804 calls) Called by h_psi: h_psi:vloc : 501.98s CPU 510.81s WALL ( 18490 calls) h_psi:vnl : 170.69s CPU 172.41s WALL ( 18490 calls) add_vuspsi : 68.60s CPU 74.17s WALL ( 18490 calls) General routines calbec : 101.99s CPU 98.03s WALL ( 18490 calls) fft : 0.35s CPU 1.27s WALL ( 19 calls) ffts : 0.03s CPU 0.04s WALL ( 4 calls) fftw : 478.21s CPU 481.54s WALL ( 1516780 calls) interpolate : 0.08s CPU 0.10s WALL ( 4 calls) davcio : 0.02s CPU 2.00s WALL ( 420 calls) Parallel routines fft_scatter : 277.43s CPU 277.95s WALL ( 1516803 calls) PWSCF : 30m57.40s CPU 33m14.92s WALL This run was terminated on: 6:52:55 28Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=