Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:36:20 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./ZrRu3C.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 41 41 12 1228 1187 185 Max 43 42 14 1234 1206 190 Sum 1513 1481 437 44299 43003 6763 bravais-lattice index = 14 lattice parameter (alat) = 7.6345 a.u. unit-cell volume = 444.9801 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.634493 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 Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Ru read from file: /users/gautes/Pseudo/Ru.rel-pbe-oncvpsp.UPF MD5 check sum: 58833c0d2965a9b0fe5de673113ce18e Pseudo is Norm-conserving, Zval = 16.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1584 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 PseudoPot. # 3 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Zr 4.00 91.22400 Zr( 1.00) Ru 16.00 101.07000 Ru( 1.00) C 4.00 12.01070 C( 1.00) 48 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cart. axis [1,0,1] cryst. s( 9) = ( 0 0 1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 10 180 deg rotation - cart. axis [-1,0,1] cryst. s(10) = ( 0 0 -1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(10) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 11 90 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 0 0 -1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(11) = ( -0.0000000 0.0000000 1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 12 90 deg rotation - cart. axis [0,-1,0] cryst. s(12) = ( 0 0 1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(12) = ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 13 180 deg rotation - cart. axis [0,1,1] cryst. s(13) = ( -1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 14 180 deg rotation - cart. axis [0,1,-1] cryst. s(14) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(14) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 15 90 deg rotation - cart. axis [-1,0,0] cryst. s(15) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 16 90 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( 1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(16) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 17 120 deg rotation - cart. axis [-1,-1,-1] cryst. s(17) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s(17) = ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 18 120 deg rotation - cart. axis [-1,1,1] cryst. s(18) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s(18) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 19 120 deg rotation - cart. axis [1,1,-1] cryst. s(19) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s(19) = ( -0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 20 120 deg rotation - cart. axis [1,-1,1] cryst. s(20) = ( 0 0 1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(20) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 21 120 deg rotation - cart. axis [1,1,1] cryst. s(21) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s(21) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 22 120 deg rotation - cart. axis [-1,1,-1] cryst. s(22) = ( 0 -1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(22) = ( -0.0000000 -0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 23 120 deg rotation - cart. axis [1,-1,-1] cryst. s(23) = ( 0 -1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(23) = ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 24 120 deg rotation - cart. axis [-1,-1,1] cryst. s(24) = ( 0 1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(24) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 25 inversion cryst. s(25) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(25) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 26 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(26) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(26) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 27 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(27) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(27) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 28 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(28) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(28) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 29 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(29) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(29) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 30 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(30) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(30) = ( 0.0000000 1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 31 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(31) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(31) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 32 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(32) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(32) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 33 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(33) = ( 0 0 -1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(33) = ( -0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 34 inv. 180 deg rotation - cart. axis [-1,0,1] cryst. s(34) = ( 0 0 1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(34) = ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 35 inv. 90 deg rotation - cart. axis [0,1,0] cryst. s(35) = ( 0 0 1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(35) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 36 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(36) = ( 0 0 -1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s(36) = ( -0.0000000 -0.0000000 1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 37 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(37) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(37) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 38 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(38) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(38) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 39 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(39) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(39) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 40 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(40) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(40) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 41 inv. 120 deg rotation - cart. axis [-1,-1,-1] cryst. s(41) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s(41) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 42 inv. 120 deg rotation - cart. axis [-1,1,1] cryst. s(42) = ( 0 0 1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s(42) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 43 inv. 120 deg rotation - cart. axis [1,1,-1] cryst. s(43) = ( 0 0 1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s(43) = ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 44 inv. 120 deg rotation - cart. axis [1,-1,1] cryst. s(44) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s(44) = ( -0.0000000 1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 45 inv. 120 deg rotation - cart. axis [1,1,1] cryst. s(45) = ( 0 -1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(45) = ( -0.0000000 -0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 46 inv. 120 deg rotation - cart. axis [-1,1,-1] cryst. s(46) = ( 0 1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(46) = ( 0.0000000 0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 47 inv. 120 deg rotation - cart. axis [1,-1,-1] cryst. s(47) = ( 0 1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(47) = ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 48 inv. 120 deg rotation - cart. axis [-1,-1,1] cryst. s(48) = ( 0 -1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s(48) = ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) double point group O_h (m-3m) there are 16 classes and 6 irreducible representations the character table: E -E 8C3 -8C3 3C2 6C4 -6C4 6C2' i -i 8S6 -8S6 -3C2 -6C2' G_6+ 2.00 -2.00 1.00 -1.00 0.00 1.41 -1.41 0.00 2.00 -2.00 1.00 -1.00 G_7+ 2.00 -2.00 1.00 -1.00 0.00 -1.41 1.41 0.00 2.00 -2.00 1.00 -1.00 G_8+ 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 4.00 -4.00 -1.00 1.00 G_6- 2.00 -2.00 1.00 -1.00 0.00 1.41 -1.41 0.00 -2.00 2.00 -1.00 1.00 G_7- 2.00 -2.00 1.00 -1.00 0.00 -1.41 1.41 0.00 -2.00 2.00 -1.00 1.00 G_8- 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 -4.00 4.00 1.00 -1.00 3s_h 6S4 -6S4 6s_d -3s_h -6s_d G_6+ 0.00 1.41 -1.41 0.00 G_7+ 0.00 -1.41 1.41 0.00 G_8+ 0.00 0.00 0.00 0.00 G_6- 0.00 -1.41 1.41 0.00 G_7- 0.00 1.41 -1.41 0.00 G_8- 0.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 8C3 17 19 20 18 24 21 22 23 120 deg rotation - cart. axis [-1,-1,-1] -8C3 -17 -19 -20 -18 -24 -21 -22 -23 120 deg rotation - cart. axis [-1,-1,-1] E 3C2 -3C2 2 -2 4 -4 3 -3 180 deg rotation - cart. axis [0,0,1] 6C4 7 8 15 16 12 11 90 deg rotation - cart. axis [0,0,-1] -6C4 -7 -8 -15 -16 -12 -11 90 deg rotation - cart. axis [0,0,-1] E 6C2'-6C2' 5 -5 6 -6 14 -13 -14 13 -10 -9 10 9 180 deg rotation - cart. axis [1,1,0] i 25 inversion -i -25 inversion E 8S6 41 43 44 42 48 45 46 47 inv. 120 deg rotation - cart. axis [-1,-1,-1] -8S6 -41 -43 -44 -42 -48 -45 -46 -47 inv. 120 deg rotation - cart. axis [-1,-1,-1] E 3s_h-3s_h 26 -26 28 -28 27 -27 inv. 180 deg rotation - cart. axis [0,0,1] 6S4 31 32 39 40 36 35 inv. 90 deg rotation - cart. axis [0,0,-1] -6S4 -31 -32 -39 -40 -36 -35 inv. 90 deg rotation - cart. axis [0,0,-1] E 6s_d-6s_d 29 -29 30 -30 38 -37 -38 37 -34 -33 34 33 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 301 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0128205 -0.0000000), wk = 0.0033223 k( 3) = ( 0.0000000 0.0256410 -0.0000000), wk = 0.0033223 k( 4) = ( 0.0000000 0.0384615 -0.0000000), wk = 0.0033223 k( 5) = ( 0.0000000 0.0512821 -0.0000000), wk = 0.0033223 k( 6) = ( 0.0000000 0.0641026 -0.0000000), wk = 0.0033223 k( 7) = ( 0.0000000 0.0769231 -0.0000000), wk = 0.0033223 k( 8) = ( 0.0000000 0.0897436 -0.0000000), wk = 0.0033223 k( 9) = ( 0.0000000 0.1025641 -0.0000000), wk = 0.0033223 k( 10) = ( 0.0000000 0.1153846 -0.0000000), wk = 0.0033223 k( 11) = ( 0.0000000 0.1282051 -0.0000000), wk = 0.0033223 k( 12) = ( 0.0000000 0.1410256 -0.0000000), wk = 0.0033223 k( 13) = ( 0.0000000 0.1538461 -0.0000000), wk = 0.0033223 k( 14) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0033223 k( 15) = ( 0.0000000 0.1794872 -0.0000000), wk = 0.0033223 k( 16) = ( 0.0000000 0.1923077 -0.0000000), wk = 0.0033223 k( 17) = ( 0.0000000 0.2051282 -0.0000000), wk = 0.0033223 k( 18) = ( 0.0000000 0.2179487 -0.0000000), wk = 0.0033223 k( 19) = ( 0.0000000 0.2307692 -0.0000000), wk = 0.0033223 k( 20) = ( 0.0000000 0.2435897 -0.0000000), wk = 0.0033223 k( 21) = ( 0.0000000 0.2564103 -0.0000000), wk = 0.0033223 k( 22) = ( 0.0000000 0.2692308 -0.0000000), wk = 0.0033223 k( 23) = ( 0.0000000 0.2820513 -0.0000000), wk = 0.0033223 k( 24) = ( 0.0000000 0.2948718 -0.0000000), wk = 0.0033223 k( 25) = ( 0.0000000 0.3076923 -0.0000000), wk = 0.0033223 k( 26) = ( 0.0000000 0.3205128 -0.0000000), wk = 0.0033223 k( 27) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0033223 k( 28) = ( 0.0000000 0.3461538 -0.0000000), wk = 0.0033223 k( 29) = ( 0.0000000 0.3589744 -0.0000000), wk = 0.0033223 k( 30) = ( 0.0000000 0.3717949 -0.0000000), wk = 0.0033223 k( 31) = ( 0.0000000 0.3846154 -0.0000000), wk = 0.0033223 k( 32) = ( 0.0000000 0.3974359 -0.0000000), wk = 0.0033223 k( 33) = ( 0.0000000 0.4102564 -0.0000000), wk = 0.0033223 k( 34) = ( 0.0000000 0.4230769 -0.0000000), wk = 0.0033223 k( 35) = ( 0.0000000 0.4358974 -0.0000000), wk = 0.0033223 k( 36) = ( 0.0000000 0.4487179 -0.0000000), wk = 0.0033223 k( 37) = ( 0.0000000 0.4615385 -0.0000000), wk = 0.0033223 k( 38) = ( 0.0000000 0.4743590 -0.0000000), wk = 0.0033223 k( 39) = ( 0.0000000 0.4871795 -0.0000000), wk = 0.0033223 k( 40) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 42) = ( 0.0128205 0.5000000 -0.0000000), wk = 0.0033223 k( 43) = ( 0.0256410 0.5000000 -0.0000000), wk = 0.0033223 k( 44) = ( 0.0384615 0.5000000 -0.0000000), wk = 0.0033223 k( 45) = ( 0.0512821 0.5000000 -0.0000000), wk = 0.0033223 k( 46) = ( 0.0641026 0.5000000 -0.0000000), wk = 0.0033223 k( 47) = ( 0.0769231 0.5000000 -0.0000000), wk = 0.0033223 k( 48) = ( 0.0897436 0.5000000 -0.0000000), wk = 0.0033223 k( 49) = ( 0.1025641 0.5000000 -0.0000000), wk = 0.0033223 k( 50) = ( 0.1153846 0.5000000 -0.0000000), wk = 0.0033223 k( 51) = ( 0.1282051 0.5000000 -0.0000000), wk = 0.0033223 k( 52) = ( 0.1410256 0.5000000 -0.0000000), wk = 0.0033223 k( 53) = ( 0.1538461 0.5000000 -0.0000000), wk = 0.0033223 k( 54) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0033223 k( 55) = ( 0.1794872 0.5000000 -0.0000000), wk = 0.0033223 k( 56) = ( 0.1923077 0.5000000 -0.0000000), wk = 0.0033223 k( 57) = ( 0.2051282 0.5000000 -0.0000000), wk = 0.0033223 k( 58) = ( 0.2179487 0.5000000 -0.0000000), wk = 0.0033223 k( 59) = ( 0.2307692 0.5000000 -0.0000000), wk = 0.0033223 k( 60) = ( 0.2435897 0.5000000 -0.0000000), wk = 0.0033223 k( 61) = ( 0.2564103 0.5000000 -0.0000000), wk = 0.0033223 k( 62) = ( 0.2692308 0.5000000 -0.0000000), wk = 0.0033223 k( 63) = ( 0.2820513 0.5000000 -0.0000000), wk = 0.0033223 k( 64) = ( 0.2948718 0.5000000 -0.0000000), wk = 0.0033223 k( 65) = ( 0.3076923 0.5000000 -0.0000000), wk = 0.0033223 k( 66) = ( 0.3205128 0.5000000 -0.0000000), wk = 0.0033223 k( 67) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0033223 k( 68) = ( 0.3461538 0.5000000 -0.0000000), wk = 0.0033223 k( 69) = ( 0.3589744 0.5000000 -0.0000000), wk = 0.0033223 k( 70) = ( 0.3717949 0.5000000 -0.0000000), wk = 0.0033223 k( 71) = ( 0.3846154 0.5000000 -0.0000000), wk = 0.0033223 k( 72) = ( 0.3974359 0.5000000 -0.0000000), wk = 0.0033223 k( 73) = ( 0.4102564 0.5000000 -0.0000000), wk = 0.0033223 k( 74) = ( 0.4230769 0.5000000 -0.0000000), wk = 0.0033223 k( 75) = ( 0.4358974 0.5000000 -0.0000000), wk = 0.0033223 k( 76) = ( 0.4487179 0.5000000 -0.0000000), wk = 0.0033223 k( 77) = ( 0.4615385 0.5000000 -0.0000000), wk = 0.0033223 k( 78) = ( 0.4743590 0.5000000 -0.0000000), wk = 0.0033223 k( 79) = ( 0.4871795 0.5000000 -0.0000000), wk = 0.0033223 k( 80) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033223 k( 81) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033223 k( 82) = ( 0.4909091 0.4909091 -0.0000000), wk = 0.0033223 k( 83) = ( 0.4818182 0.4818182 -0.0000000), wk = 0.0033223 k( 84) = ( 0.4727273 0.4727273 -0.0000000), wk = 0.0033223 k( 85) = ( 0.4636364 0.4636364 -0.0000000), wk = 0.0033223 k( 86) = ( 0.4545455 0.4545454 -0.0000000), wk = 0.0033223 k( 87) = ( 0.4454546 0.4454545 -0.0000000), wk = 0.0033223 k( 88) = ( 0.4363636 0.4363636 -0.0000000), wk = 0.0033223 k( 89) = ( 0.4272727 0.4272727 -0.0000000), wk = 0.0033223 k( 90) = ( 0.4181818 0.4181818 -0.0000000), wk = 0.0033223 k( 91) = ( 0.4090909 0.4090909 -0.0000000), wk = 0.0033223 k( 92) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0033223 k( 93) = ( 0.3909091 0.3909091 -0.0000000), wk = 0.0033223 k( 94) = ( 0.3818182 0.3818182 -0.0000000), wk = 0.0033223 k( 95) = ( 0.3727273 0.3727273 -0.0000000), wk = 0.0033223 k( 96) = ( 0.3636364 0.3636364 -0.0000000), wk = 0.0033223 k( 97) = ( 0.3545454 0.3545454 -0.0000000), wk = 0.0033223 k( 98) = ( 0.3454546 0.3454545 -0.0000000), wk = 0.0033223 k( 99) = ( 0.3363636 0.3363636 -0.0000000), wk = 0.0033223 k( 100) = ( 0.3272727 0.3272727 -0.0000000), wk = 0.0033223 k( 101) = ( 0.3181818 0.3181818 -0.0000000), wk = 0.0033223 k( 102) = ( 0.3090909 0.3090909 -0.0000000), wk = 0.0033223 k( 103) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0033223 k( 104) = ( 0.2909091 0.2909091 -0.0000000), wk = 0.0033223 k( 105) = ( 0.2818182 0.2818182 -0.0000000), wk = 0.0033223 k( 106) = ( 0.2727273 0.2727273 -0.0000000), wk = 0.0033223 k( 107) = ( 0.2636364 0.2636364 -0.0000000), wk = 0.0033223 k( 108) = ( 0.2545455 0.2545455 -0.0000000), wk = 0.0033223 k( 109) = ( 0.2454545 0.2454545 -0.0000000), wk = 0.0033223 k( 110) = ( 0.2363636 0.2363636 -0.0000000), wk = 0.0033223 k( 111) = ( 0.2272727 0.2272727 -0.0000000), wk = 0.0033223 k( 112) = ( 0.2181818 0.2181818 -0.0000000), wk = 0.0033223 k( 113) = ( 0.2090909 0.2090909 -0.0000000), wk = 0.0033223 k( 114) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0033223 k( 115) = ( 0.1909091 0.1909091 -0.0000000), wk = 0.0033223 k( 116) = ( 0.1818182 0.1818182 -0.0000000), wk = 0.0033223 k( 117) = ( 0.1727273 0.1727273 -0.0000000), wk = 0.0033223 k( 118) = ( 0.1636364 0.1636364 -0.0000000), wk = 0.0033223 k( 119) = ( 0.1545455 0.1545454 -0.0000000), wk = 0.0033223 k( 120) = ( 0.1454545 0.1454545 -0.0000000), wk = 0.0033223 k( 121) = ( 0.1363636 0.1363636 -0.0000000), wk = 0.0033223 k( 122) = ( 0.1272727 0.1272727 -0.0000000), wk = 0.0033223 k( 123) = ( 0.1181818 0.1181818 -0.0000000), wk = 0.0033223 k( 124) = ( 0.1090909 0.1090909 -0.0000000), wk = 0.0033223 k( 125) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0033223 k( 126) = ( 0.0909091 0.0909091 -0.0000000), wk = 0.0033223 k( 127) = ( 0.0818182 0.0818182 -0.0000000), wk = 0.0033223 k( 128) = ( 0.0727273 0.0727273 -0.0000000), wk = 0.0033223 k( 129) = ( 0.0636364 0.0636364 -0.0000000), wk = 0.0033223 k( 130) = ( 0.0545455 0.0545454 -0.0000000), wk = 0.0033223 k( 131) = ( 0.0454546 0.0454545 -0.0000000), wk = 0.0033223 k( 132) = ( 0.0363636 0.0363636 -0.0000000), wk = 0.0033223 k( 133) = ( 0.0272727 0.0272727 -0.0000000), wk = 0.0033223 k( 134) = ( 0.0181818 0.0181818 -0.0000000), wk = 0.0033223 k( 135) = ( 0.0090909 0.0090909 -0.0000000), wk = 0.0033223 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 138) = ( 0.0073529 0.0073529 0.0073529), wk = 0.0033223 k( 139) = ( 0.0147059 0.0147059 0.0147059), wk = 0.0033223 k( 140) = ( 0.0220588 0.0220588 0.0220588), wk = 0.0033223 k( 141) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0033223 k( 142) = ( 0.0367647 0.0367647 0.0367647), wk = 0.0033223 k( 143) = ( 0.0441177 0.0441176 0.0441176), wk = 0.0033223 k( 144) = ( 0.0514706 0.0514706 0.0514706), wk = 0.0033223 k( 145) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0033223 k( 146) = ( 0.0661765 0.0661765 0.0661765), wk = 0.0033223 k( 147) = ( 0.0735294 0.0735294 0.0735294), wk = 0.0033223 k( 148) = ( 0.0808824 0.0808823 0.0808823), wk = 0.0033223 k( 149) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0033223 k( 150) = ( 0.0955882 0.0955882 0.0955882), wk = 0.0033223 k( 151) = ( 0.1029412 0.1029412 0.1029412), wk = 0.0033223 k( 152) = ( 0.1102941 0.1102941 0.1102941), wk = 0.0033223 k( 153) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0033223 k( 154) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0033223 k( 155) = ( 0.1323529 0.1323529 0.1323529), wk = 0.0033223 k( 156) = ( 0.1397059 0.1397059 0.1397059), wk = 0.0033223 k( 157) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0033223 k( 158) = ( 0.1544118 0.1544118 0.1544118), wk = 0.0033223 k( 159) = ( 0.1617647 0.1617647 0.1617647), wk = 0.0033223 k( 160) = ( 0.1691177 0.1691176 0.1691176), wk = 0.0033223 k( 161) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0033223 k( 162) = ( 0.1838235 0.1838235 0.1838235), wk = 0.0033223 k( 163) = ( 0.1911765 0.1911765 0.1911765), wk = 0.0033223 k( 164) = ( 0.1985294 0.1985294 0.1985294), wk = 0.0033223 k( 165) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0033223 k( 166) = ( 0.2132353 0.2132353 0.2132353), wk = 0.0033223 k( 167) = ( 0.2205882 0.2205882 0.2205882), wk = 0.0033223 k( 168) = ( 0.2279412 0.2279412 0.2279412), wk = 0.0033223 k( 169) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0033223 k( 170) = ( 0.2426471 0.2426471 0.2426471), wk = 0.0033223 k( 171) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 k( 172) = ( 0.2573529 0.2573529 0.2573529), wk = 0.0033223 k( 173) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0033223 k( 174) = ( 0.2720588 0.2720588 0.2720588), wk = 0.0033223 k( 175) = ( 0.2794118 0.2794118 0.2794118), wk = 0.0033223 k( 176) = ( 0.2867647 0.2867647 0.2867647), wk = 0.0033223 k( 177) = ( 0.2941177 0.2941176 0.2941176), wk = 0.0033223 k( 178) = ( 0.3014706 0.3014706 0.3014706), wk = 0.0033223 k( 179) = ( 0.3088235 0.3088235 0.3088235), wk = 0.0033223 k( 180) = ( 0.3161765 0.3161765 0.3161765), wk = 0.0033223 k( 181) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0033223 k( 182) = ( 0.3308823 0.3308823 0.3308823), wk = 0.0033223 k( 183) = ( 0.3382353 0.3382353 0.3382353), wk = 0.0033223 k( 184) = ( 0.3455882 0.3455882 0.3455882), wk = 0.0033223 k( 185) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0033223 k( 186) = ( 0.3602941 0.3602941 0.3602941), wk = 0.0033223 k( 187) = ( 0.3676471 0.3676471 0.3676471), wk = 0.0033223 k( 188) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0033223 k( 189) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0033223 k( 190) = ( 0.3897059 0.3897059 0.3897059), wk = 0.0033223 k( 191) = ( 0.3970588 0.3970588 0.3970588), wk = 0.0033223 k( 192) = ( 0.4044118 0.4044118 0.4044118), wk = 0.0033223 k( 193) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0033223 k( 194) = ( 0.4191177 0.4191176 0.4191176), wk = 0.0033223 k( 195) = ( 0.4264706 0.4264706 0.4264706), wk = 0.0033223 k( 196) = ( 0.4338235 0.4338235 0.4338235), wk = 0.0033223 k( 197) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0033223 k( 198) = ( 0.4485294 0.4485294 0.4485294), wk = 0.0033223 k( 199) = ( 0.4558823 0.4558823 0.4558823), wk = 0.0033223 k( 200) = ( 0.4632353 0.4632353 0.4632353), wk = 0.0033223 k( 201) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0033223 k( 202) = ( 0.4779412 0.4779412 0.4779412), wk = 0.0033223 k( 203) = ( 0.4852941 0.4852941 0.4852941), wk = 0.0033223 k( 204) = ( 0.4926471 0.4926471 0.4926471), wk = 0.0033223 k( 205) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 206) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 207) = ( 0.4909091 0.5000000 0.4909091), wk = 0.0033223 k( 208) = ( 0.4818182 0.5000000 0.4818182), wk = 0.0033223 k( 209) = ( 0.4727273 0.5000000 0.4727273), wk = 0.0033223 k( 210) = ( 0.4636364 0.5000000 0.4636364), wk = 0.0033223 k( 211) = ( 0.4545455 0.5000000 0.4545454), wk = 0.0033223 k( 212) = ( 0.4454546 0.5000000 0.4454545), wk = 0.0033223 k( 213) = ( 0.4363636 0.5000000 0.4363636), wk = 0.0033223 k( 214) = ( 0.4272727 0.5000000 0.4272727), wk = 0.0033223 k( 215) = ( 0.4181818 0.5000000 0.4181818), wk = 0.0033223 k( 216) = ( 0.4090909 0.5000000 0.4090909), wk = 0.0033223 k( 217) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0033223 k( 218) = ( 0.3909091 0.5000000 0.3909091), wk = 0.0033223 k( 219) = ( 0.3818182 0.5000000 0.3818182), wk = 0.0033223 k( 220) = ( 0.3727273 0.5000000 0.3727273), wk = 0.0033223 k( 221) = ( 0.3636364 0.5000000 0.3636364), wk = 0.0033223 k( 222) = ( 0.3545454 0.5000000 0.3545454), wk = 0.0033223 k( 223) = ( 0.3454546 0.5000000 0.3454545), wk = 0.0033223 k( 224) = ( 0.3363636 0.5000000 0.3363636), wk = 0.0033223 k( 225) = ( 0.3272727 0.5000000 0.3272727), wk = 0.0033223 k( 226) = ( 0.3181818 0.5000000 0.3181818), wk = 0.0033223 k( 227) = ( 0.3090909 0.5000000 0.3090909), wk = 0.0033223 k( 228) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0033223 k( 229) = ( 0.2909091 0.5000000 0.2909091), wk = 0.0033223 k( 230) = ( 0.2818182 0.5000000 0.2818182), wk = 0.0033223 k( 231) = ( 0.2727273 0.5000000 0.2727273), wk = 0.0033223 k( 232) = ( 0.2636364 0.5000000 0.2636364), wk = 0.0033223 k( 233) = ( 0.2545455 0.5000000 0.2545454), wk = 0.0033223 k( 234) = ( 0.2454545 0.5000000 0.2454545), wk = 0.0033223 k( 235) = ( 0.2363636 0.5000000 0.2363636), wk = 0.0033223 k( 236) = ( 0.2272727 0.5000000 0.2272727), wk = 0.0033223 k( 237) = ( 0.2181818 0.5000000 0.2181818), wk = 0.0033223 k( 238) = ( 0.2090909 0.5000000 0.2090909), wk = 0.0033223 k( 239) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0033223 k( 240) = ( 0.1909091 0.5000000 0.1909091), wk = 0.0033223 k( 241) = ( 0.1818182 0.5000000 0.1818182), wk = 0.0033223 k( 242) = ( 0.1727273 0.5000000 0.1727273), wk = 0.0033223 k( 243) = ( 0.1636364 0.5000000 0.1636364), wk = 0.0033223 k( 244) = ( 0.1545455 0.5000000 0.1545454), wk = 0.0033223 k( 245) = ( 0.1454545 0.5000000 0.1454545), wk = 0.0033223 k( 246) = ( 0.1363636 0.5000000 0.1363636), wk = 0.0033223 k( 247) = ( 0.1272727 0.5000000 0.1272727), wk = 0.0033223 k( 248) = ( 0.1181818 0.5000000 0.1181818), wk = 0.0033223 k( 249) = ( 0.1090909 0.5000000 0.1090909), wk = 0.0033223 k( 250) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0033223 k( 251) = ( 0.0909091 0.5000000 0.0909091), wk = 0.0033223 k( 252) = ( 0.0818182 0.5000000 0.0818182), wk = 0.0033223 k( 253) = ( 0.0727273 0.5000000 0.0727273), wk = 0.0033223 k( 254) = ( 0.0636364 0.5000000 0.0636364), wk = 0.0033223 k( 255) = ( 0.0545455 0.5000000 0.0545454), wk = 0.0033223 k( 256) = ( 0.0454546 0.5000000 0.0454545), wk = 0.0033223 k( 257) = ( 0.0363636 0.5000000 0.0363636), wk = 0.0033223 k( 258) = ( 0.0272727 0.5000000 0.0272727), wk = 0.0033223 k( 259) = ( 0.0181818 0.5000000 0.0181818), wk = 0.0033223 k( 260) = ( 0.0090909 0.5000000 0.0090909), wk = 0.0033223 k( 261) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 262) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033223 k( 263) = ( 0.5000000 0.5000000 0.0128205), wk = 0.0033223 k( 264) = ( 0.5000000 0.5000000 0.0256410), wk = 0.0033223 k( 265) = ( 0.5000000 0.5000000 0.0384615), wk = 0.0033223 k( 266) = ( 0.5000000 0.5000000 0.0512820), wk = 0.0033223 k( 267) = ( 0.5000000 0.5000000 0.0641026), wk = 0.0033223 k( 268) = ( 0.5000000 0.5000000 0.0769231), wk = 0.0033223 k( 269) = ( 0.5000000 0.5000000 0.0897436), wk = 0.0033223 k( 270) = ( 0.5000000 0.5000000 0.1025641), wk = 0.0033223 k( 271) = ( 0.5000000 0.5000000 0.1153846), wk = 0.0033223 k( 272) = ( 0.5000000 0.5000000 0.1282051), wk = 0.0033223 k( 273) = ( 0.5000000 0.5000000 0.1410256), wk = 0.0033223 k( 274) = ( 0.5000000 0.5000000 0.1538461), wk = 0.0033223 k( 275) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0033223 k( 276) = ( 0.5000000 0.5000000 0.1794872), wk = 0.0033223 k( 277) = ( 0.5000000 0.5000000 0.1923077), wk = 0.0033223 k( 278) = ( 0.5000000 0.5000000 0.2051282), wk = 0.0033223 k( 279) = ( 0.5000000 0.5000000 0.2179487), wk = 0.0033223 k( 280) = ( 0.5000000 0.5000000 0.2307692), wk = 0.0033223 k( 281) = ( 0.5000000 0.5000000 0.2435897), wk = 0.0033223 k( 282) = ( 0.5000000 0.5000000 0.2564103), wk = 0.0033223 k( 283) = ( 0.5000000 0.5000000 0.2692308), wk = 0.0033223 k( 284) = ( 0.5000000 0.5000000 0.2820513), wk = 0.0033223 k( 285) = ( 0.5000000 0.5000000 0.2948718), wk = 0.0033223 k( 286) = ( 0.5000000 0.5000000 0.3076923), wk = 0.0033223 k( 287) = ( 0.5000000 0.5000000 0.3205128), wk = 0.0033223 k( 288) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0033223 k( 289) = ( 0.5000000 0.5000000 0.3461538), wk = 0.0033223 k( 290) = ( 0.5000000 0.5000000 0.3589744), wk = 0.0033223 k( 291) = ( 0.5000000 0.5000000 0.3717949), wk = 0.0033223 k( 292) = ( 0.5000000 0.5000000 0.3846154), wk = 0.0033223 k( 293) = ( 0.5000000 0.5000000 0.3974359), wk = 0.0033223 k( 294) = ( 0.5000000 0.5000000 0.4102564), wk = 0.0033223 k( 295) = ( 0.5000000 0.5000000 0.4230769), wk = 0.0033223 k( 296) = ( 0.5000000 0.5000000 0.4358974), wk = 0.0033223 k( 297) = ( 0.5000000 0.5000000 0.4487179), wk = 0.0033223 k( 298) = ( 0.5000000 0.5000000 0.4615385), wk = 0.0033223 k( 299) = ( 0.5000000 0.5000000 0.4743590), wk = 0.0033223 k( 300) = ( 0.5000000 0.5000000 0.4871795), wk = 0.0033223 k( 301) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0128205 0.0000000), wk = 0.0033223 k( 3) = ( 0.0000000 0.0256410 0.0000000), wk = 0.0033223 k( 4) = ( 0.0000000 0.0384615 0.0000000), wk = 0.0033223 k( 5) = ( 0.0000000 0.0512821 0.0000000), wk = 0.0033223 k( 6) = ( 0.0000000 0.0641026 0.0000000), wk = 0.0033223 k( 7) = ( 0.0000000 0.0769231 0.0000000), wk = 0.0033223 k( 8) = ( 0.0000000 0.0897436 0.0000000), wk = 0.0033223 k( 9) = ( 0.0000000 0.1025641 0.0000000), wk = 0.0033223 k( 10) = ( 0.0000000 0.1153846 0.0000000), wk = 0.0033223 k( 11) = ( 0.0000000 0.1282051 0.0000000), wk = 0.0033223 k( 12) = ( 0.0000000 0.1410256 0.0000000), wk = 0.0033223 k( 13) = ( 0.0000000 0.1538461 0.0000000), wk = 0.0033223 k( 14) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0033223 k( 15) = ( 0.0000000 0.1794872 0.0000000), wk = 0.0033223 k( 16) = ( 0.0000000 0.1923077 0.0000000), wk = 0.0033223 k( 17) = ( 0.0000000 0.2051282 0.0000000), wk = 0.0033223 k( 18) = ( 0.0000000 0.2179487 0.0000000), wk = 0.0033223 k( 19) = ( 0.0000000 0.2307692 0.0000000), wk = 0.0033223 k( 20) = ( 0.0000000 0.2435897 0.0000000), wk = 0.0033223 k( 21) = ( 0.0000000 0.2564103 0.0000000), wk = 0.0033223 k( 22) = ( 0.0000000 0.2692308 0.0000000), wk = 0.0033223 k( 23) = ( 0.0000000 0.2820513 0.0000000), wk = 0.0033223 k( 24) = ( 0.0000000 0.2948718 0.0000000), wk = 0.0033223 k( 25) = ( 0.0000000 0.3076923 0.0000000), wk = 0.0033223 k( 26) = ( 0.0000000 0.3205128 0.0000000), wk = 0.0033223 k( 27) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0033223 k( 28) = ( 0.0000000 0.3461538 0.0000000), wk = 0.0033223 k( 29) = ( 0.0000000 0.3589744 0.0000000), wk = 0.0033223 k( 30) = ( 0.0000000 0.3717949 0.0000000), wk = 0.0033223 k( 31) = ( 0.0000000 0.3846154 0.0000000), wk = 0.0033223 k( 32) = ( 0.0000000 0.3974359 0.0000000), wk = 0.0033223 k( 33) = ( 0.0000000 0.4102564 0.0000000), wk = 0.0033223 k( 34) = ( 0.0000000 0.4230769 0.0000000), wk = 0.0033223 k( 35) = ( 0.0000000 0.4358974 0.0000000), wk = 0.0033223 k( 36) = ( 0.0000000 0.4487179 0.0000000), wk = 0.0033223 k( 37) = ( 0.0000000 0.4615385 0.0000000), wk = 0.0033223 k( 38) = ( 0.0000000 0.4743590 0.0000000), wk = 0.0033223 k( 39) = ( 0.0000000 0.4871795 0.0000000), wk = 0.0033223 k( 40) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 41) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 42) = ( 0.0128205 0.5000000 0.0000000), wk = 0.0033223 k( 43) = ( 0.0256410 0.5000000 0.0000000), wk = 0.0033223 k( 44) = ( 0.0384615 0.5000000 0.0000000), wk = 0.0033223 k( 45) = ( 0.0512821 0.5000000 0.0000000), wk = 0.0033223 k( 46) = ( 0.0641026 0.5000000 0.0000000), wk = 0.0033223 k( 47) = ( 0.0769231 0.5000000 0.0000000), wk = 0.0033223 k( 48) = ( 0.0897436 0.5000000 0.0000000), wk = 0.0033223 k( 49) = ( 0.1025641 0.5000000 0.0000000), wk = 0.0033223 k( 50) = ( 0.1153846 0.5000000 0.0000000), wk = 0.0033223 k( 51) = ( 0.1282051 0.5000000 0.0000000), wk = 0.0033223 k( 52) = ( 0.1410256 0.5000000 0.0000000), wk = 0.0033223 k( 53) = ( 0.1538461 0.5000000 0.0000000), wk = 0.0033223 k( 54) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0033223 k( 55) = ( 0.1794872 0.5000000 0.0000000), wk = 0.0033223 k( 56) = ( 0.1923077 0.5000000 0.0000000), wk = 0.0033223 k( 57) = ( 0.2051282 0.5000000 0.0000000), wk = 0.0033223 k( 58) = ( 0.2179487 0.5000000 0.0000000), wk = 0.0033223 k( 59) = ( 0.2307692 0.5000000 0.0000000), wk = 0.0033223 k( 60) = ( 0.2435897 0.5000000 0.0000000), wk = 0.0033223 k( 61) = ( 0.2564103 0.5000000 0.0000000), wk = 0.0033223 k( 62) = ( 0.2692308 0.5000000 0.0000000), wk = 0.0033223 k( 63) = ( 0.2820513 0.5000000 0.0000000), wk = 0.0033223 k( 64) = ( 0.2948718 0.5000000 0.0000000), wk = 0.0033223 k( 65) = ( 0.3076923 0.5000000 0.0000000), wk = 0.0033223 k( 66) = ( 0.3205128 0.5000000 -0.0000000), wk = 0.0033223 k( 67) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0033223 k( 68) = ( 0.3461538 0.5000000 0.0000000), wk = 0.0033223 k( 69) = ( 0.3589744 0.5000000 0.0000000), wk = 0.0033223 k( 70) = ( 0.3717949 0.5000000 0.0000000), wk = 0.0033223 k( 71) = ( 0.3846154 0.5000000 0.0000000), wk = 0.0033223 k( 72) = ( 0.3974359 0.5000000 0.0000000), wk = 0.0033223 k( 73) = ( 0.4102564 0.5000000 0.0000000), wk = 0.0033223 k( 74) = ( 0.4230769 0.5000000 0.0000000), wk = 0.0033223 k( 75) = ( 0.4358974 0.5000000 0.0000000), wk = 0.0033223 k( 76) = ( 0.4487179 0.5000000 0.0000000), wk = 0.0033223 k( 77) = ( 0.4615385 0.5000000 0.0000000), wk = 0.0033223 k( 78) = ( 0.4743590 0.5000000 0.0000000), wk = 0.0033223 k( 79) = ( 0.4871795 0.5000000 0.0000000), wk = 0.0033223 k( 80) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0033223 k( 81) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0033223 k( 82) = ( 0.4909091 0.4909091 0.0000000), wk = 0.0033223 k( 83) = ( 0.4818182 0.4818182 0.0000000), wk = 0.0033223 k( 84) = ( 0.4727273 0.4727273 0.0000000), wk = 0.0033223 k( 85) = ( 0.4636364 0.4636364 0.0000000), wk = 0.0033223 k( 86) = ( 0.4545455 0.4545455 0.0000000), wk = 0.0033223 k( 87) = ( 0.4454546 0.4454546 0.0000000), wk = 0.0033223 k( 88) = ( 0.4363636 0.4363636 0.0000000), wk = 0.0033223 k( 89) = ( 0.4272727 0.4272727 0.0000000), wk = 0.0033223 k( 90) = ( 0.4181818 0.4181818 0.0000000), wk = 0.0033223 k( 91) = ( 0.4090909 0.4090909 0.0000000), wk = 0.0033223 k( 92) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0033223 k( 93) = ( 0.3909091 0.3909091 0.0000000), wk = 0.0033223 k( 94) = ( 0.3818182 0.3818182 0.0000000), wk = 0.0033223 k( 95) = ( 0.3727273 0.3727273 0.0000000), wk = 0.0033223 k( 96) = ( 0.3636364 0.3636364 0.0000000), wk = 0.0033223 k( 97) = ( 0.3545454 0.3545454 0.0000000), wk = 0.0033223 k( 98) = ( 0.3454546 0.3454546 0.0000000), wk = 0.0033223 k( 99) = ( 0.3363636 0.3363636 0.0000000), wk = 0.0033223 k( 100) = ( 0.3272727 0.3272727 0.0000000), wk = 0.0033223 k( 101) = ( 0.3181818 0.3181818 0.0000000), wk = 0.0033223 k( 102) = ( 0.3090909 0.3090909 0.0000000), wk = 0.0033223 k( 103) = ( 0.3000000 0.3000000 0.0000000), wk = 0.0033223 k( 104) = ( 0.2909091 0.2909091 0.0000000), wk = 0.0033223 k( 105) = ( 0.2818182 0.2818182 0.0000000), wk = 0.0033223 k( 106) = ( 0.2727273 0.2727273 0.0000000), wk = 0.0033223 k( 107) = ( 0.2636364 0.2636364 0.0000000), wk = 0.0033223 k( 108) = ( 0.2545455 0.2545455 0.0000000), wk = 0.0033223 k( 109) = ( 0.2454545 0.2454545 0.0000000), wk = 0.0033223 k( 110) = ( 0.2363636 0.2363636 0.0000000), wk = 0.0033223 k( 111) = ( 0.2272727 0.2272727 0.0000000), wk = 0.0033223 k( 112) = ( 0.2181818 0.2181818 0.0000000), wk = 0.0033223 k( 113) = ( 0.2090909 0.2090909 0.0000000), wk = 0.0033223 k( 114) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0033223 k( 115) = ( 0.1909091 0.1909091 0.0000000), wk = 0.0033223 k( 116) = ( 0.1818182 0.1818182 0.0000000), wk = 0.0033223 k( 117) = ( 0.1727273 0.1727273 0.0000000), wk = 0.0033223 k( 118) = ( 0.1636364 0.1636364 0.0000000), wk = 0.0033223 k( 119) = ( 0.1545455 0.1545455 0.0000000), wk = 0.0033223 k( 120) = ( 0.1454545 0.1454545 0.0000000), wk = 0.0033223 k( 121) = ( 0.1363636 0.1363636 0.0000000), wk = 0.0033223 k( 122) = ( 0.1272727 0.1272727 0.0000000), wk = 0.0033223 k( 123) = ( 0.1181818 0.1181818 0.0000000), wk = 0.0033223 k( 124) = ( 0.1090909 0.1090909 0.0000000), wk = 0.0033223 k( 125) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0033223 k( 126) = ( 0.0909091 0.0909091 0.0000000), wk = 0.0033223 k( 127) = ( 0.0818182 0.0818182 0.0000000), wk = 0.0033223 k( 128) = ( 0.0727273 0.0727273 0.0000000), wk = 0.0033223 k( 129) = ( 0.0636364 0.0636364 0.0000000), wk = 0.0033223 k( 130) = ( 0.0545455 0.0545455 0.0000000), wk = 0.0033223 k( 131) = ( 0.0454546 0.0454546 0.0000000), wk = 0.0033223 k( 132) = ( 0.0363636 0.0363636 0.0000000), wk = 0.0033223 k( 133) = ( 0.0272727 0.0272727 0.0000000), wk = 0.0033223 k( 134) = ( 0.0181818 0.0181818 0.0000000), wk = 0.0033223 k( 135) = ( 0.0090909 0.0090909 0.0000000), wk = 0.0033223 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 138) = ( 0.0073529 0.0073529 0.0073529), wk = 0.0033223 k( 139) = ( 0.0147059 0.0147059 0.0147059), wk = 0.0033223 k( 140) = ( 0.0220588 0.0220588 0.0220588), wk = 0.0033223 k( 141) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0033223 k( 142) = ( 0.0367647 0.0367647 0.0367647), wk = 0.0033223 k( 143) = ( 0.0441177 0.0441177 0.0441177), wk = 0.0033223 k( 144) = ( 0.0514706 0.0514706 0.0514706), wk = 0.0033223 k( 145) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0033223 k( 146) = ( 0.0661765 0.0661765 0.0661765), wk = 0.0033223 k( 147) = ( 0.0735294 0.0735294 0.0735294), wk = 0.0033223 k( 148) = ( 0.0808824 0.0808824 0.0808824), wk = 0.0033223 k( 149) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0033223 k( 150) = ( 0.0955882 0.0955882 0.0955882), wk = 0.0033223 k( 151) = ( 0.1029412 0.1029412 0.1029412), wk = 0.0033223 k( 152) = ( 0.1102941 0.1102941 0.1102941), wk = 0.0033223 k( 153) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0033223 k( 154) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0033223 k( 155) = ( 0.1323529 0.1323529 0.1323529), wk = 0.0033223 k( 156) = ( 0.1397059 0.1397059 0.1397059), wk = 0.0033223 k( 157) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0033223 k( 158) = ( 0.1544118 0.1544118 0.1544118), wk = 0.0033223 k( 159) = ( 0.1617647 0.1617647 0.1617647), wk = 0.0033223 k( 160) = ( 0.1691177 0.1691177 0.1691177), wk = 0.0033223 k( 161) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0033223 k( 162) = ( 0.1838235 0.1838235 0.1838235), wk = 0.0033223 k( 163) = ( 0.1911765 0.1911765 0.1911765), wk = 0.0033223 k( 164) = ( 0.1985294 0.1985294 0.1985294), wk = 0.0033223 k( 165) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0033223 k( 166) = ( 0.2132353 0.2132353 0.2132353), wk = 0.0033223 k( 167) = ( 0.2205882 0.2205882 0.2205882), wk = 0.0033223 k( 168) = ( 0.2279412 0.2279412 0.2279412), wk = 0.0033223 k( 169) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0033223 k( 170) = ( 0.2426471 0.2426471 0.2426471), wk = 0.0033223 k( 171) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 k( 172) = ( 0.2573529 0.2573529 0.2573529), wk = 0.0033223 k( 173) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0033223 k( 174) = ( 0.2720588 0.2720588 0.2720588), wk = 0.0033223 k( 175) = ( 0.2794118 0.2794118 0.2794118), wk = 0.0033223 k( 176) = ( 0.2867647 0.2867647 0.2867647), wk = 0.0033223 k( 177) = ( 0.2941177 0.2941177 0.2941177), wk = 0.0033223 k( 178) = ( 0.3014706 0.3014706 0.3014706), wk = 0.0033223 k( 179) = ( 0.3088235 0.3088235 0.3088235), wk = 0.0033223 k( 180) = ( 0.3161765 0.3161765 0.3161765), wk = 0.0033223 k( 181) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0033223 k( 182) = ( 0.3308823 0.3308823 0.3308823), wk = 0.0033223 k( 183) = ( 0.3382353 0.3382353 0.3382353), wk = 0.0033223 k( 184) = ( 0.3455882 0.3455882 0.3455882), wk = 0.0033223 k( 185) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0033223 k( 186) = ( 0.3602941 0.3602941 0.3602941), wk = 0.0033223 k( 187) = ( 0.3676471 0.3676471 0.3676471), wk = 0.0033223 k( 188) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0033223 k( 189) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0033223 k( 190) = ( 0.3897059 0.3897059 0.3897059), wk = 0.0033223 k( 191) = ( 0.3970588 0.3970588 0.3970588), wk = 0.0033223 k( 192) = ( 0.4044118 0.4044118 0.4044118), wk = 0.0033223 k( 193) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0033223 k( 194) = ( 0.4191177 0.4191177 0.4191177), wk = 0.0033223 k( 195) = ( 0.4264706 0.4264706 0.4264706), wk = 0.0033223 k( 196) = ( 0.4338235 0.4338235 0.4338235), wk = 0.0033223 k( 197) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0033223 k( 198) = ( 0.4485294 0.4485294 0.4485294), wk = 0.0033223 k( 199) = ( 0.4558823 0.4558823 0.4558823), wk = 0.0033223 k( 200) = ( 0.4632353 0.4632353 0.4632353), wk = 0.0033223 k( 201) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0033223 k( 202) = ( 0.4779412 0.4779412 0.4779412), wk = 0.0033223 k( 203) = ( 0.4852941 0.4852941 0.4852941), wk = 0.0033223 k( 204) = ( 0.4926471 0.4926471 0.4926471), wk = 0.0033223 k( 205) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 206) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 207) = ( 0.4909091 0.5000000 0.4909091), wk = 0.0033223 k( 208) = ( 0.4818182 0.5000000 0.4818182), wk = 0.0033223 k( 209) = ( 0.4727273 0.5000000 0.4727273), wk = 0.0033223 k( 210) = ( 0.4636364 0.5000000 0.4636364), wk = 0.0033223 k( 211) = ( 0.4545455 0.5000000 0.4545455), wk = 0.0033223 k( 212) = ( 0.4454546 0.5000000 0.4454546), wk = 0.0033223 k( 213) = ( 0.4363636 0.5000000 0.4363636), wk = 0.0033223 k( 214) = ( 0.4272727 0.5000000 0.4272727), wk = 0.0033223 k( 215) = ( 0.4181818 0.5000000 0.4181818), wk = 0.0033223 k( 216) = ( 0.4090909 0.5000000 0.4090909), wk = 0.0033223 k( 217) = ( 0.4000000 0.5000000 0.4000000), wk = 0.0033223 k( 218) = ( 0.3909091 0.5000000 0.3909091), wk = 0.0033223 k( 219) = ( 0.3818182 0.5000000 0.3818182), wk = 0.0033223 k( 220) = ( 0.3727273 0.5000000 0.3727273), wk = 0.0033223 k( 221) = ( 0.3636364 0.5000000 0.3636364), wk = 0.0033223 k( 222) = ( 0.3545454 0.5000000 0.3545454), wk = 0.0033223 k( 223) = ( 0.3454546 0.5000000 0.3454546), wk = 0.0033223 k( 224) = ( 0.3363636 0.5000000 0.3363636), wk = 0.0033223 k( 225) = ( 0.3272727 0.5000000 0.3272727), wk = 0.0033223 k( 226) = ( 0.3181818 0.5000000 0.3181818), wk = 0.0033223 k( 227) = ( 0.3090909 0.5000000 0.3090909), wk = 0.0033223 k( 228) = ( 0.3000000 0.5000000 0.3000000), wk = 0.0033223 k( 229) = ( 0.2909091 0.5000000 0.2909091), wk = 0.0033223 k( 230) = ( 0.2818182 0.5000000 0.2818182), wk = 0.0033223 k( 231) = ( 0.2727273 0.5000000 0.2727273), wk = 0.0033223 k( 232) = ( 0.2636364 0.5000000 0.2636364), wk = 0.0033223 k( 233) = ( 0.2545455 0.5000000 0.2545455), wk = 0.0033223 k( 234) = ( 0.2454545 0.5000000 0.2454545), wk = 0.0033223 k( 235) = ( 0.2363636 0.5000000 0.2363636), wk = 0.0033223 k( 236) = ( 0.2272727 0.5000000 0.2272727), wk = 0.0033223 k( 237) = ( 0.2181818 0.5000000 0.2181818), wk = 0.0033223 k( 238) = ( 0.2090909 0.5000000 0.2090909), wk = 0.0033223 k( 239) = ( 0.2000000 0.5000000 0.2000000), wk = 0.0033223 k( 240) = ( 0.1909091 0.5000000 0.1909091), wk = 0.0033223 k( 241) = ( 0.1818182 0.5000000 0.1818182), wk = 0.0033223 k( 242) = ( 0.1727273 0.5000000 0.1727273), wk = 0.0033223 k( 243) = ( 0.1636364 0.5000000 0.1636364), wk = 0.0033223 k( 244) = ( 0.1545455 0.5000000 0.1545455), wk = 0.0033223 k( 245) = ( 0.1454545 0.5000000 0.1454545), wk = 0.0033223 k( 246) = ( 0.1363636 0.5000000 0.1363636), wk = 0.0033223 k( 247) = ( 0.1272727 0.5000000 0.1272727), wk = 0.0033223 k( 248) = ( 0.1181818 0.5000000 0.1181818), wk = 0.0033223 k( 249) = ( 0.1090909 0.5000000 0.1090909), wk = 0.0033223 k( 250) = ( 0.1000000 0.5000000 0.1000000), wk = 0.0033223 k( 251) = ( 0.0909091 0.5000000 0.0909091), wk = 0.0033223 k( 252) = ( 0.0818182 0.5000000 0.0818182), wk = 0.0033223 k( 253) = ( 0.0727273 0.5000000 0.0727273), wk = 0.0033223 k( 254) = ( 0.0636364 0.5000000 0.0636364), wk = 0.0033223 k( 255) = ( 0.0545455 0.5000000 0.0545455), wk = 0.0033223 k( 256) = ( 0.0454546 0.5000000 0.0454546), wk = 0.0033223 k( 257) = ( 0.0363636 0.5000000 0.0363636), wk = 0.0033223 k( 258) = ( 0.0272727 0.5000000 0.0272727), wk = 0.0033223 k( 259) = ( 0.0181818 0.5000000 0.0181818), wk = 0.0033223 k( 260) = ( 0.0090909 0.5000000 0.0090909), wk = 0.0033223 k( 261) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 262) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0033223 k( 263) = ( 0.5000000 0.5000000 0.0128205), wk = 0.0033223 k( 264) = ( 0.5000000 0.5000000 0.0256410), wk = 0.0033223 k( 265) = ( 0.5000000 0.5000000 0.0384615), wk = 0.0033223 k( 266) = ( 0.5000000 0.5000000 0.0512821), wk = 0.0033223 k( 267) = ( 0.5000000 0.5000000 0.0641026), wk = 0.0033223 k( 268) = ( 0.5000000 0.5000000 0.0769231), wk = 0.0033223 k( 269) = ( 0.5000000 0.5000000 0.0897436), wk = 0.0033223 k( 270) = ( 0.5000000 0.5000000 0.1025641), wk = 0.0033223 k( 271) = ( 0.5000000 0.5000000 0.1153846), wk = 0.0033223 k( 272) = ( 0.5000000 0.5000000 0.1282051), wk = 0.0033223 k( 273) = ( 0.5000000 0.5000000 0.1410256), wk = 0.0033223 k( 274) = ( 0.5000000 0.5000000 0.1538461), wk = 0.0033223 k( 275) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0033223 k( 276) = ( 0.5000000 0.5000000 0.1794872), wk = 0.0033223 k( 277) = ( 0.5000000 0.5000000 0.1923077), wk = 0.0033223 k( 278) = ( 0.5000000 0.5000000 0.2051282), wk = 0.0033223 k( 279) = ( 0.5000000 0.5000000 0.2179487), wk = 0.0033223 k( 280) = ( 0.5000000 0.5000000 0.2307692), wk = 0.0033223 k( 281) = ( 0.5000000 0.5000000 0.2435897), wk = 0.0033223 k( 282) = ( 0.5000000 0.5000000 0.2564103), wk = 0.0033223 k( 283) = ( 0.5000000 0.5000000 0.2692308), wk = 0.0033223 k( 284) = ( 0.5000000 0.5000000 0.2820513), wk = 0.0033223 k( 285) = ( 0.5000000 0.5000000 0.2948718), wk = 0.0033223 k( 286) = ( 0.5000000 0.5000000 0.3076923), wk = 0.0033223 k( 287) = ( 0.5000000 0.5000000 0.3205128), wk = 0.0033223 k( 288) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0033223 k( 289) = ( 0.5000000 0.5000000 0.3461538), wk = 0.0033223 k( 290) = ( 0.5000000 0.5000000 0.3589744), wk = 0.0033223 k( 291) = ( 0.5000000 0.5000000 0.3717949), wk = 0.0033223 k( 292) = ( 0.5000000 0.5000000 0.3846154), wk = 0.0033223 k( 293) = ( 0.5000000 0.5000000 0.3974359), wk = 0.0033223 k( 294) = ( 0.5000000 0.5000000 0.4102564), wk = 0.0033223 k( 295) = ( 0.5000000 0.5000000 0.4230769), wk = 0.0033223 k( 296) = ( 0.5000000 0.5000000 0.4358974), wk = 0.0033223 k( 297) = ( 0.5000000 0.5000000 0.4487179), wk = 0.0033223 k( 298) = ( 0.5000000 0.5000000 0.4615385), wk = 0.0033223 k( 299) = ( 0.5000000 0.5000000 0.4743590), wk = 0.0033223 k( 300) = ( 0.5000000 0.5000000 0.4871795), wk = 0.0033223 k( 301) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 Dense grid: 44299 G-vectors FFT dimensions: ( 45, 45, 45) Smooth grid: 43003 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.32 Mb ( 304, 68) NL pseudopotentials 0.31 Mb ( 152, 132) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 1229) G-vector shells 0.00 Mb ( 295) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.26 Mb ( 304, 272) Each subspace H/S matrix 0.07 Mb ( 68, 68) Each matrix 0.27 Mb ( 132, 2, 68) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./ZrRu3C.save/charge-density.dat Starting wfc are 86 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.3 secs Computing kpt #: 2 total cpu time spent up to now is 3.9 secs Computing kpt #: 3 total cpu time spent up to now is 5.3 secs Computing kpt #: 4 total cpu time spent up to now is 6.7 secs Computing kpt #: 5 total cpu time spent up to now is 8.0 secs Computing kpt #: 6 total cpu time spent up to now is 9.3 secs Computing kpt #: 7 total cpu time spent up to now is 10.4 secs Computing kpt #: 8 total cpu time spent up to now is 11.2 secs Computing kpt #: 9 total cpu time spent up to now is 12.1 secs Computing kpt #: 10 total cpu time spent up to now is 12.9 secs Computing kpt #: 11 total cpu time spent up to now is 13.7 secs Computing kpt #: 12 total cpu time spent up to now is 14.4 secs Computing kpt #: 13 total cpu time spent up to now is 15.1 secs Computing kpt #: 14 total cpu time spent up to now is 15.8 secs Computing kpt #: 15 total cpu time spent up to now is 16.5 secs Computing kpt #: 16 total cpu time spent up to now is 17.3 secs Computing kpt #: 17 total cpu time spent up to now is 18.0 secs Computing kpt #: 18 total cpu time spent up to now is 18.7 secs Computing kpt #: 19 total cpu time spent up to now is 19.3 secs Computing kpt #: 20 total cpu time spent up to now is 20.0 secs Computing kpt #: 21 total cpu time spent up to now is 20.6 secs Computing kpt #: 22 total cpu time spent up to now is 21.3 secs Computing kpt #: 23 total cpu time spent up to now is 21.9 secs Computing kpt #: 24 total cpu time spent up to now is 22.5 secs Computing kpt #: 25 total cpu time spent up to now is 23.2 secs Computing kpt #: 26 total cpu time spent up to now is 23.9 secs Computing kpt #: 27 total cpu time spent up to now is 24.5 secs Computing kpt #: 28 total cpu time spent up to now is 25.3 secs Computing kpt #: 29 total cpu time spent up to now is 26.1 secs Computing kpt #: 30 total cpu time spent up to now is 26.9 secs Computing kpt #: 31 total cpu time spent up to now is 27.6 secs Computing kpt #: 32 total cpu time spent up to now is 28.3 secs Computing kpt #: 33 total cpu time spent up to now is 29.0 secs Computing kpt #: 34 total cpu time spent up to now is 29.6 secs Computing kpt #: 35 total cpu time spent up to now is 30.3 secs Computing kpt #: 36 total cpu time spent up to now is 31.0 secs Computing kpt #: 37 total cpu time spent up to now is 31.6 secs Computing kpt #: 38 total cpu time spent up to now is 32.3 secs Computing kpt #: 39 total cpu time spent up to now is 32.9 secs Computing kpt #: 40 total cpu time spent up to now is 33.5 secs Computing kpt #: 41 total cpu time spent up to now is 34.2 secs Computing kpt #: 42 total cpu time spent up to now is 34.8 secs Computing kpt #: 43 total cpu time spent up to now is 35.4 secs Computing kpt #: 44 total cpu time spent up to now is 36.1 secs Computing kpt #: 45 total cpu time spent up to now is 36.7 secs Computing kpt #: 46 total cpu time spent up to now is 37.4 secs Computing kpt #: 47 total cpu time spent up to now is 38.1 secs Computing kpt #: 48 total cpu time spent up to now is 38.8 secs Computing kpt #: 49 total cpu time spent up to now is 39.5 secs Computing kpt #: 50 total cpu time spent up to now is 40.2 secs Computing kpt #: 51 total cpu time spent up to now is 40.9 secs Computing kpt #: 52 total cpu time spent up to now is 41.6 secs Computing kpt #: 53 total cpu time spent up to now is 42.3 secs Computing kpt #: 54 total cpu time spent up to now is 42.9 secs Computing kpt #: 55 total cpu time spent up to now is 43.6 secs Computing kpt #: 56 total cpu time spent up to now is 44.2 secs Computing kpt #: 57 total cpu time spent up to now is 44.8 secs Computing kpt #: 58 total cpu time spent up to now is 45.5 secs Computing kpt #: 59 total cpu time spent up to now is 46.1 secs Computing kpt #: 60 total cpu time spent up to now is 46.8 secs Computing kpt #: 61 total cpu time spent up to now is 47.4 secs Computing kpt #: 62 total cpu time spent up to now is 48.1 secs Computing kpt #: 63 total cpu time spent up to now is 48.8 secs Computing kpt #: 64 total cpu time spent up to now is 49.6 secs Computing kpt #: 65 total cpu time spent up to now is 50.3 secs Computing kpt #: 66 total cpu time spent up to now is 51.0 secs Computing kpt #: 67 total cpu time spent up to now is 51.7 secs Computing kpt #: 68 total cpu time spent up to now is 52.4 secs Computing kpt #: 69 total cpu time spent up to now is 53.1 secs Computing kpt #: 70 total cpu time spent up to now is 53.8 secs Computing kpt #: 71 total cpu time spent up to now is 54.5 secs Computing kpt #: 72 total cpu time spent up to now is 55.2 secs Computing kpt #: 73 total cpu time spent up to now is 56.0 secs Computing kpt #: 74 total cpu time spent up to now is 56.7 secs Computing kpt #: 75 total cpu time spent up to now is 57.4 secs Computing kpt #: 76 total cpu time spent up to now is 58.1 secs Computing kpt #: 77 total cpu time spent up to now is 58.8 secs Computing kpt #: 78 total cpu time spent up to now is 59.4 secs Computing kpt #: 79 total cpu time spent up to now is 60.1 secs Computing kpt #: 80 total cpu time spent up to now is 60.7 secs Computing kpt #: 81 total cpu time spent up to now is 61.4 secs Computing kpt #: 82 total cpu time spent up to now is 62.1 secs Computing kpt #: 83 total cpu time spent up to now is 62.7 secs Computing kpt #: 84 total cpu time spent up to now is 63.4 secs Computing kpt #: 85 total cpu time spent up to now is 64.1 secs Computing kpt #: 86 total cpu time spent up to now is 64.8 secs Computing kpt #: 87 total cpu time spent up to now is 65.5 secs Computing kpt #: 88 total cpu time spent up to now is 66.2 secs Computing kpt #: 89 total cpu time spent up to now is 66.9 secs Computing kpt #: 90 total cpu time spent up to now is 67.7 secs Computing kpt #: 91 total cpu time spent up to now is 68.3 secs Computing kpt #: 92 total cpu time spent up to now is 69.0 secs Computing kpt #: 93 total cpu time spent up to now is 69.7 secs Computing kpt #: 94 total cpu time spent up to now is 70.4 secs Computing kpt #: 95 total cpu time spent up to now is 71.1 secs Computing kpt #: 96 total cpu time spent up to now is 71.8 secs Computing kpt #: 97 total cpu time spent up to now is 72.5 secs Computing kpt #: 98 total cpu time spent up to now is 73.2 secs Computing kpt #: 99 total cpu time spent up to now is 73.9 secs Computing kpt #: 100 total cpu time spent up to now is 74.6 secs Computing kpt #: 101 total cpu time spent up to now is 75.3 secs Computing kpt #: 102 total cpu time spent up to now is 76.1 secs Computing kpt #: 103 total cpu time spent up to now is 76.8 secs Computing kpt #: 104 total cpu time spent up to now is 77.6 secs Computing kpt #: 105 total cpu time spent up to now is 78.3 secs Computing kpt #: 106 total cpu time spent up to now is 79.0 secs Computing kpt #: 107 total cpu time spent up to now is 79.7 secs Computing kpt #: 108 total cpu time spent up to now is 80.3 secs Computing kpt #: 109 total cpu time spent up to now is 81.0 secs Computing kpt #: 110 total cpu time spent up to now is 81.7 secs Computing kpt #: 111 total cpu time spent up to now is 82.3 secs Computing kpt #: 112 total cpu time spent up to now is 83.0 secs Computing kpt #: 113 total cpu time spent up to now is 83.7 secs Computing kpt #: 114 total cpu time spent up to now is 84.3 secs Computing kpt #: 115 total cpu time spent up to now is 85.0 secs Computing kpt #: 116 total cpu time spent up to now is 85.7 secs Computing kpt #: 117 total cpu time spent up to now is 86.4 secs Computing kpt #: 118 total cpu time spent up to now is 87.2 secs Computing kpt #: 119 total cpu time spent up to now is 87.9 secs Computing kpt #: 120 total cpu time spent up to now is 88.6 secs Computing kpt #: 121 total cpu time spent up to now is 89.3 secs Computing kpt #: 122 total cpu time spent up to now is 90.0 secs Computing kpt #: 123 total cpu time spent up to now is 90.7 secs Computing kpt #: 124 total cpu time spent up to now is 91.3 secs Computing kpt #: 125 total cpu time spent up to now is 92.0 secs Computing kpt #: 126 total cpu time spent up to now is 92.7 secs Computing kpt #: 127 total cpu time spent up to now is 93.5 secs Computing kpt #: 128 total cpu time spent up to now is 94.3 secs Computing kpt #: 129 total cpu time spent up to now is 95.0 secs Computing kpt #: 130 total cpu time spent up to now is 96.1 secs Computing kpt #: 131 total cpu time spent up to now is 97.2 secs Computing kpt #: 132 total cpu time spent up to now is 98.4 secs Computing kpt #: 133 total cpu time spent up to now is 99.7 secs Computing kpt #: 134 total cpu time spent up to now is 101.3 secs Computing kpt #: 135 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 103.3 secs Computing kpt #: 136 total cpu time spent up to now is 104.0 secs Computing kpt #: 137 total cpu time spent up to now is 104.7 secs Computing kpt #: 138 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 106.7 secs Computing kpt #: 139 total cpu time spent up to now is 107.9 secs Computing kpt #: 140 total cpu time spent up to now is 109.0 secs Computing kpt #: 141 total cpu time spent up to now is 109.9 secs Computing kpt #: 142 total cpu time spent up to now is 110.8 secs Computing kpt #: 143 total cpu time spent up to now is 111.5 secs Computing kpt #: 144 total cpu time spent up to now is 112.2 secs Computing kpt #: 145 total cpu time spent up to now is 112.9 secs Computing kpt #: 146 total cpu time spent up to now is 113.5 secs Computing kpt #: 147 total cpu time spent up to now is 114.2 secs Computing kpt #: 148 total cpu time spent up to now is 114.8 secs Computing kpt #: 149 total cpu time spent up to now is 115.4 secs Computing kpt #: 150 total cpu time spent up to now is 116.1 secs Computing kpt #: 151 total cpu time spent up to now is 116.7 secs Computing kpt #: 152 total cpu time spent up to now is 117.3 secs Computing kpt #: 153 total cpu time spent up to now is 117.9 secs Computing kpt #: 154 total cpu time spent up to now is 118.5 secs Computing kpt #: 155 total cpu time spent up to now is 119.1 secs Computing kpt #: 156 total cpu time spent up to now is 119.7 secs Computing kpt #: 157 total cpu time spent up to now is 120.4 secs Computing kpt #: 158 total cpu time spent up to now is 121.0 secs Computing kpt #: 159 total cpu time spent up to now is 121.6 secs Computing kpt #: 160 total cpu time spent up to now is 122.2 secs Computing kpt #: 161 total cpu time spent up to now is 122.9 secs Computing kpt #: 162 total cpu time spent up to now is 123.5 secs Computing kpt #: 163 total cpu time spent up to now is 124.2 secs Computing kpt #: 164 total cpu time spent up to now is 124.8 secs Computing kpt #: 165 total cpu time spent up to now is 125.5 secs Computing kpt #: 166 total cpu time spent up to now is 126.1 secs Computing kpt #: 167 total cpu time spent up to now is 126.8 secs Computing kpt #: 168 total cpu time spent up to now is 127.4 secs Computing kpt #: 169 total cpu time spent up to now is 128.0 secs Computing kpt #: 170 total cpu time spent up to now is 128.7 secs Computing kpt #: 171 total cpu time spent up to now is 129.3 secs Computing kpt #: 172 total cpu time spent up to now is 129.9 secs Computing kpt #: 173 total cpu time spent up to now is 130.6 secs Computing kpt #: 174 total cpu time spent up to now is 131.2 secs Computing kpt #: 175 total cpu time spent up to now is 131.8 secs Computing kpt #: 176 total cpu time spent up to now is 132.4 secs Computing kpt #: 177 total cpu time spent up to now is 133.0 secs Computing kpt #: 178 total cpu time spent up to now is 133.7 secs Computing kpt #: 179 total cpu time spent up to now is 134.3 secs Computing kpt #: 180 total cpu time spent up to now is 134.9 secs Computing kpt #: 181 total cpu time spent up to now is 135.6 secs Computing kpt #: 182 total cpu time spent up to now is 136.2 secs Computing kpt #: 183 total cpu time spent up to now is 136.8 secs Computing kpt #: 184 total cpu time spent up to now is 137.4 secs Computing kpt #: 185 total cpu time spent up to now is 138.1 secs Computing kpt #: 186 total cpu time spent up to now is 138.7 secs Computing kpt #: 187 total cpu time spent up to now is 139.3 secs Computing kpt #: 188 total cpu time spent up to now is 140.0 secs Computing kpt #: 189 total cpu time spent up to now is 140.6 secs Computing kpt #: 190 total cpu time spent up to now is 141.3 secs Computing kpt #: 191 total cpu time spent up to now is 141.9 secs Computing kpt #: 192 total cpu time spent up to now is 142.6 secs Computing kpt #: 193 total cpu time spent up to now is 143.2 secs Computing kpt #: 194 total cpu time spent up to now is 143.9 secs Computing kpt #: 195 total cpu time spent up to now is 144.5 secs Computing kpt #: 196 total cpu time spent up to now is 145.2 secs Computing kpt #: 197 total cpu time spent up to now is 145.8 secs Computing kpt #: 198 total cpu time spent up to now is 146.5 secs Computing kpt #: 199 total cpu time spent up to now is 147.2 secs Computing kpt #: 200 total cpu time spent up to now is 147.8 secs Computing kpt #: 201 total cpu time spent up to now is 148.5 secs Computing kpt #: 202 total cpu time spent up to now is 149.1 secs Computing kpt #: 203 total cpu time spent up to now is 149.8 secs Computing kpt #: 204 total cpu time spent up to now is 150.4 secs Computing kpt #: 205 total cpu time spent up to now is 151.0 secs Computing kpt #: 206 total cpu time spent up to now is 151.5 secs Computing kpt #: 207 total cpu time spent up to now is 152.1 secs Computing kpt #: 208 total cpu time spent up to now is 152.8 secs Computing kpt #: 209 total cpu time spent up to now is 153.4 secs Computing kpt #: 210 total cpu time spent up to now is 154.1 secs Computing kpt #: 211 total cpu time spent up to now is 154.7 secs Computing kpt #: 212 total cpu time spent up to now is 155.4 secs Computing kpt #: 213 total cpu time spent up to now is 156.1 secs Computing kpt #: 214 total cpu time spent up to now is 156.7 secs Computing kpt #: 215 total cpu time spent up to now is 157.3 secs Computing kpt #: 216 total cpu time spent up to now is 158.0 secs Computing kpt #: 217 total cpu time spent up to now is 158.6 secs Computing kpt #: 218 total cpu time spent up to now is 159.2 secs Computing kpt #: 219 total cpu time spent up to now is 159.8 secs Computing kpt #: 220 total cpu time spent up to now is 160.5 secs Computing kpt #: 221 total cpu time spent up to now is 161.1 secs Computing kpt #: 222 total cpu time spent up to now is 161.7 secs Computing kpt #: 223 total cpu time spent up to now is 162.3 secs Computing kpt #: 224 total cpu time spent up to now is 163.0 secs Computing kpt #: 225 total cpu time spent up to now is 163.6 secs Computing kpt #: 226 total cpu time spent up to now is 164.2 secs Computing kpt #: 227 total cpu time spent up to now is 164.8 secs Computing kpt #: 228 total cpu time spent up to now is 165.4 secs Computing kpt #: 229 total cpu time spent up to now is 166.0 secs Computing kpt #: 230 total cpu time spent up to now is 166.6 secs Computing kpt #: 231 total cpu time spent up to now is 167.2 secs Computing kpt #: 232 total cpu time spent up to now is 167.8 secs Computing kpt #: 233 total cpu time spent up to now is 168.4 secs Computing kpt #: 234 total cpu time spent up to now is 169.0 secs Computing kpt #: 235 total cpu time spent up to now is 169.6 secs Computing kpt #: 236 total cpu time spent up to now is 170.2 secs Computing kpt #: 237 total cpu time spent up to now is 170.9 secs Computing kpt #: 238 total cpu time spent up to now is 171.5 secs Computing kpt #: 239 total cpu time spent up to now is 172.1 secs Computing kpt #: 240 total cpu time spent up to now is 172.7 secs Computing kpt #: 241 total cpu time spent up to now is 173.3 secs Computing kpt #: 242 total cpu time spent up to now is 174.0 secs Computing kpt #: 243 total cpu time spent up to now is 174.6 secs Computing kpt #: 244 total cpu time spent up to now is 175.3 secs Computing kpt #: 245 total cpu time spent up to now is 175.9 secs Computing kpt #: 246 total cpu time spent up to now is 176.6 secs Computing kpt #: 247 total cpu time spent up to now is 177.4 secs Computing kpt #: 248 total cpu time spent up to now is 178.1 secs Computing kpt #: 249 total cpu time spent up to now is 178.8 secs Computing kpt #: 250 total cpu time spent up to now is 179.5 secs Computing kpt #: 251 total cpu time spent up to now is 180.3 secs Computing kpt #: 252 total cpu time spent up to now is 181.2 secs Computing kpt #: 253 total cpu time spent up to now is 181.9 secs Computing kpt #: 254 total cpu time spent up to now is 182.6 secs Computing kpt #: 255 total cpu time spent up to now is 183.2 secs Computing kpt #: 256 total cpu time spent up to now is 183.9 secs Computing kpt #: 257 total cpu time spent up to now is 184.5 secs Computing kpt #: 258 total cpu time spent up to now is 185.2 secs Computing kpt #: 259 total cpu time spent up to now is 185.8 secs Computing kpt #: 260 total cpu time spent up to now is 186.5 secs Computing kpt #: 261 total cpu time spent up to now is 187.1 secs Computing kpt #: 262 total cpu time spent up to now is 187.8 secs Computing kpt #: 263 total cpu time spent up to now is 188.4 secs Computing kpt #: 264 total cpu time spent up to now is 189.1 secs Computing kpt #: 265 total cpu time spent up to now is 189.8 secs Computing kpt #: 266 total cpu time spent up to now is 190.6 secs Computing kpt #: 267 total cpu time spent up to now is 191.3 secs Computing kpt #: 268 total cpu time spent up to now is 192.0 secs Computing kpt #: 269 total cpu time spent up to now is 192.7 secs Computing kpt #: 270 total cpu time spent up to now is 193.4 secs Computing kpt #: 271 total cpu time spent up to now is 194.1 secs Computing kpt #: 272 total cpu time spent up to now is 194.8 secs Computing kpt #: 273 total cpu time spent up to now is 195.4 secs Computing kpt #: 274 total cpu time spent up to now is 196.1 secs Computing kpt #: 275 total cpu time spent up to now is 196.7 secs Computing kpt #: 276 total cpu time spent up to now is 197.3 secs Computing kpt #: 277 total cpu time spent up to now is 198.0 secs Computing kpt #: 278 total cpu time spent up to now is 198.6 secs Computing kpt #: 279 total cpu time spent up to now is 199.2 secs Computing kpt #: 280 total cpu time spent up to now is 199.9 secs Computing kpt #: 281 total cpu time spent up to now is 200.5 secs Computing kpt #: 282 total cpu time spent up to now is 201.1 secs Computing kpt #: 283 total cpu time spent up to now is 201.8 secs Computing kpt #: 284 total cpu time spent up to now is 202.4 secs Computing kpt #: 285 total cpu time spent up to now is 203.0 secs Computing kpt #: 286 total cpu time spent up to now is 203.8 secs Computing kpt #: 287 total cpu time spent up to now is 204.4 secs Computing kpt #: 288 total cpu time spent up to now is 205.0 secs Computing kpt #: 289 total cpu time spent up to now is 205.7 secs Computing kpt #: 290 total cpu time spent up to now is 206.3 secs Computing kpt #: 291 total cpu time spent up to now is 207.0 secs Computing kpt #: 292 total cpu time spent up to now is 207.6 secs Computing kpt #: 293 total cpu time spent up to now is 208.2 secs Computing kpt #: 294 total cpu time spent up to now is 208.9 secs Computing kpt #: 295 total cpu time spent up to now is 209.5 secs Computing kpt #: 296 total cpu time spent up to now is 210.1 secs Computing kpt #: 297 total cpu time spent up to now is 210.8 secs Computing kpt #: 298 total cpu time spent up to now is 211.4 secs Computing kpt #: 299 total cpu time spent up to now is 212.1 secs Computing kpt #: 300 total cpu time spent up to now is 212.7 secs Computing kpt #: 301 total cpu time spent up to now is 213.2 secs ethr = 1.79E-08, avg # of iterations = 19.0 total cpu time spent up to now is 213.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5449 PWs) bands (ev): -52.6329 -52.6329 -52.5367 -52.5367 -52.5367 -52.5367 -25.3145 -25.3145 -25.3145 -25.3145 -25.0495 -25.0495 -22.4596 -22.4596 -22.1472 -22.1472 -22.1472 -22.1472 -21.8001 -21.8001 -21.7823 -21.7823 -21.7823 -21.7823 4.7889 4.7889 12.6515 12.6515 13.8006 13.8006 13.8006 13.8006 13.8020 13.8020 13.8506 13.8506 13.8506 13.8506 16.2772 16.2772 16.2772 16.2772 16.4558 16.4558 16.9533 16.9533 16.9533 16.9533 17.1100 17.1100 18.1150 18.1150 18.1150 18.1150 20.0984 20.0984 20.1204 20.1204 20.2278 20.2278 20.2278 20.2278 22.4189 22.4189 22.4189 22.4189 23.9131 23.9131 k = 0.0000 0.0128-0.0000 ( 5429 PWs) bands (ev): -52.6328 -52.6328 -52.5368 -52.5368 -52.5367 -52.5367 -25.3145 -25.3145 -25.3143 -25.3143 -25.0496 -25.0496 -22.4594 -22.4594 -22.1472 -22.1472 -22.1471 -22.1471 -21.8000 -21.8000 -21.7824 -21.7824 -21.7824 -21.7824 4.7903 4.7903 12.6533 12.6533 13.8014 13.8014 13.8016 13.8016 13.8026 13.8026 13.8516 13.8516 13.8519 13.8519 16.2667 16.2667 16.2756 16.2756 16.4496 16.4496 16.9531 16.9531 16.9557 16.9557 17.1109 17.1109 18.1152 18.1152 18.1243 18.1243 20.0987 20.0987 20.1187 20.1187 20.2278 20.2278 20.2280 20.2280 22.4176 22.4176 22.4190 22.4190 23.8956 23.8957 k = 0.0000 0.0256-0.0000 ( 5421 PWs) bands (ev): -52.6327 -52.6327 -52.5369 -52.5369 -52.5367 -52.5367 -25.3144 -25.3144 -25.3140 -25.3140 -25.0499 -25.0499 -22.4590 -22.4590 -22.1474 -22.1474 -22.1469 -22.1469 -21.8001 -21.8001 -21.7827 -21.7827 -21.7825 -21.7825 4.7944 4.7944 12.6589 12.6589 13.8038 13.8038 13.8038 13.8038 13.8051 13.8051 13.8548 13.8548 13.8560 13.8560 16.2340 16.2340 16.2708 16.2708 16.4334 16.4334 16.9523 16.9523 16.9627 16.9627 17.1137 17.1137 18.1158 18.1158 18.1511 18.1511 20.0996 20.0996 20.1135 20.1135 20.2281 20.2281 20.2289 20.2289 22.4137 22.4137 22.4191 22.4191 23.8460 23.8460 k = 0.0000 0.0385-0.0000 ( 5421 PWs) bands (ev): -52.6325 -52.6325 -52.5370 -52.5370 -52.5367 -52.5367 -25.3144 -25.3144 -25.3136 -25.3136 -25.0504 -25.0504 -22.4584 -22.4584 -22.1477 -22.1477 -22.1466 -22.1466 -21.8002 -21.8002 -21.7832 -21.7832 -21.7827 -21.7827 4.8012 4.8012 12.6681 12.6681 13.8066 13.8066 13.8077 13.8077 13.8100 13.8100 13.8601 13.8601 13.8630 13.8630 16.1772 16.1772 16.2631 16.2631 16.4124 16.4124 16.9502 16.9502 16.9741 16.9741 17.1189 17.1189 18.1168 18.1168 18.1924 18.1924 20.1011 20.1011 20.1049 20.1049 20.2284 20.2284 20.2303 20.2303 22.4073 22.4073 22.4193 22.4193 23.7705 23.7705 k = 0.0000 0.0513-0.0000 ( 5421 PWs) bands (ev): -52.6323 -52.6323 -52.5373 -52.5373 -52.5367 -52.5367 -25.3144 -25.3144 -25.3129 -25.3129 -25.0510 -25.0510 -22.4575 -22.4575 -22.1482 -22.1482 -22.1462 -22.1462 -21.8004 -21.8004 -21.7840 -21.7840 -21.7831 -21.7831 4.8107 4.8107 12.6810 12.6810 13.8102 13.8102 13.8128 13.8128 13.8168 13.8168 13.8677 13.8677 13.8729 13.8729 16.0970 16.0970 16.2526 16.2526 16.3903 16.3903 16.9462 16.9462 16.9893 16.9893 17.1270 17.1270 18.1183 18.1183 18.2441 18.2441 20.0929 20.0929 20.1032 20.1032 20.2290 20.2290 20.2323 20.2323 22.3984 22.3984 22.4196 22.4196 23.6760 23.6760 k = 0.0000 0.0641-0.0000 ( 5401 PWs) bands (ev): -52.6320 -52.6320 -52.5376 -52.5376 -52.5367 -52.5367 -25.3144 -25.3144 -25.3120 -25.3120 -25.0519 -25.0519 -22.4563 -22.4563 -22.1487 -22.1487 -22.1457 -22.1457 -21.8006 -21.8006 -21.7849 -21.7849 -21.7835 -21.7835 4.8228 4.8228 12.6976 12.6976 13.8146 13.8146 13.8191 13.8191 13.8252 13.8252 13.8777 13.8777 13.8859 13.8859 15.9972 15.9972 16.2397 16.2397 16.3681 16.3681 16.9395 16.9395 17.0078 17.0078 17.1384 17.1384 18.1201 18.1201 18.3019 18.3019 20.0774 20.0774 20.1059 20.1059 20.2298 20.2298 20.2349 20.2349 22.3870 22.3870 22.4200 22.4200 23.5683 23.5683 k = 0.0000 0.0769-0.0000 ( 5393 PWs) bands (ev): -52.6316 -52.6316 -52.5380 -52.5380 -52.5367 -52.5367 -25.3143 -25.3143 -25.3110 -25.3110 -25.0530 -25.0530 -22.4550 -22.4550 -22.1494 -22.1494 -22.1451 -22.1451 -21.8009 -21.8009 -21.7860 -21.7860 -21.7840 -21.7840 4.8376 4.8376 12.7177 12.7177 13.8200 13.8200 13.8263 13.8263 13.8353 13.8353 13.8902 13.8902 13.9022 13.9022 15.8819 15.8819 16.2247 16.2247 16.3456 16.3456 16.9296 16.9296 17.0292 17.0292 17.1533 17.1533 18.1223 18.1223 18.3622 18.3622 20.0585 20.0585 20.1091 20.1091 20.2307 20.2307 20.2381 20.2381 22.3733 22.3733 22.4204 22.4204 23.4514 23.4514 k = 0.0000 0.0897-0.0000 ( 5385 PWs) bands (ev): -52.6311 -52.6311 -52.5384 -52.5384 -52.5367 -52.5367 -25.3143 -25.3143 -25.3097 -25.3097 -25.0542 -25.0542 -22.4533 -22.4533 -22.1503 -22.1503 -22.1444 -22.1444 -21.8013 -21.8013 -21.7873 -21.7873 -21.7846 -21.7846 4.8550 4.8550 12.7413 12.7413 13.8261 13.8261 13.8344 13.8344 13.8468 13.8468 13.9053 13.9053 13.9218 13.9218 15.7549 15.7549 16.2080 16.2080 16.3228 16.3228 16.9164 16.9164 17.0529 17.0529 17.1717 17.1717 18.1249 18.1249 18.4217 18.4217 20.0362 20.0362 20.1127 20.1127 20.2320 20.2320 20.2418 20.2418 22.3573 22.3573 22.4207 22.4207 23.3284 23.3284 k = 0.0000 0.1026-0.0000 ( 5389 PWs) bands (ev): -52.6306 -52.6306 -52.5389 -52.5389 -52.5367 -52.5367 -25.3143 -25.3143 -25.3083 -25.3083 -25.0557 -25.0557 -22.4515 -22.4515 -22.1513 -22.1513 -22.1436 -22.1436 -21.8018 -21.8018 -21.7888 -21.7888 -21.7852 -21.7852 4.8748 4.8748 12.7683 12.7683 13.8331 13.8331 13.8431 13.8431 13.8597 13.8597 13.9228 13.9228 13.9447 13.9447 15.6192 15.6192 16.1900 16.1900 16.2994 16.2994 16.8999 16.8999 17.0787 17.0787 17.1932 17.1932 18.1278 18.1278 18.4779 18.4779 20.0105 20.0105 20.1169 20.1169 20.2335 20.2335 20.2462 20.2462 22.3392 22.3392 22.4206 22.4206 23.2012 23.2012 k = 0.0000 0.1154-0.0000 ( 5385 PWs) bands (ev): -52.6300 -52.6300 -52.5395 -52.5395 -52.5367 -52.5367 -25.3143 -25.3143 -25.3067 -25.3067 -25.0573 -25.0573 -22.4494 -22.4494 -22.1524 -22.1524 -22.1428 -22.1428 -21.8023 -21.8023 -21.7905 -21.7905 -21.7859 -21.7859 4.8972 4.8972 12.7987 12.7987 13.8407 13.8407 13.8526 13.8526 13.8740 13.8740 13.9429 13.9429 13.9707 13.9707 15.4772 15.4772 16.1708 16.1708 16.2755 16.2755 16.8803 16.8803 17.1061 17.1061 17.2174 17.2174 18.1310 18.1310 18.5287 18.5287 19.9814 19.9814 20.1214 20.1214 20.2353 20.2353 20.2511 20.2511 22.3192 22.3192 22.4199 22.4199 23.0713 23.0713 k = 0.0000 0.1282-0.0000 ( 5385 PWs) bands (ev): -52.6294 -52.6294 -52.5401 -52.5401 -52.5367 -52.5367 -25.3143 -25.3143 -25.3050 -25.3050 -25.0591 -25.0591 -22.4471 -22.4471 -22.1536 -22.1536 -22.1418 -22.1418 -21.8029 -21.8029 -21.7923 -21.7923 -21.7867 -21.7867 4.9219 4.9219 12.8324 12.8324 13.8490 13.8490 13.8627 13.8627 13.8897 13.8897 13.9652 13.9652 13.9999 13.9999 15.3308 15.3308 16.1508 16.1508 16.2513 16.2513 16.8577 16.8577 17.1349 17.1349 17.2439 17.2439 18.1344 18.1344 18.5727 18.5727 19.9489 19.9489 20.1262 20.1262 20.2376 20.2376 20.2566 20.2566 22.2974 22.2974 22.4180 22.4180 22.9399 22.9399 k = 0.0000 0.1410-0.0000 ( 5370 PWs) bands (ev): -52.6287 -52.6287 -52.5408 -52.5408 -52.5367 -52.5367 -25.3142 -25.3142 -25.3031 -25.3031 -25.0611 -25.0611 -22.4446 -22.4446 -22.1549 -22.1549 -22.1407 -22.1407 -21.8036 -21.8036 -21.7942 -21.7942 -21.7874 -21.7874 4.9488 4.9488 12.8691 12.8691 13.8580 13.8580 13.8734 13.8734 13.9069 13.9069 13.9896 13.9896 14.0320 14.0320 15.1814 15.1814 16.1303 16.1303 16.2269 16.2269 16.8325 16.8325 17.1648 17.1648 17.2725 17.2725 18.1381 18.1381 18.6087 18.6087 19.9132 19.9132 20.1313 20.1313 20.2403 20.2403 20.2628 20.2628 22.2739 22.2739 22.4143 22.4143 22.8077 22.8077 k = 0.0000 0.1538-0.0000 ( 5370 PWs) bands (ev): -52.6279 -52.6279 -52.5416 -52.5416 -52.5367 -52.5367 -25.3142 -25.3142 -25.3010 -25.3010 -25.0632 -25.0632 -22.4419 -22.4419 -22.1564 -22.1564 -22.1396 -22.1396 -21.8044 -21.8044 -21.7963 -21.7963 -21.7882 -21.7882 4.9780 4.9780 12.9088 12.9088 13.8675 13.8675 13.8846 13.8846 13.9253 13.9253 14.0160 14.0160 14.0671 14.0671 15.0305 15.0305 16.1095 16.1095 16.2023 16.2023 16.8047 16.8047 17.1958 17.1958 17.3028 17.3028 18.1420 18.1420 18.6359 18.6359 19.8742 19.8742 20.1365 20.1365 20.2436 20.2436 20.2695 20.2695 22.2490 22.2490 22.4078 22.4078 22.6758 22.6758 k = 0.0000 0.1667-0.0000 ( 5378 PWs) bands (ev): -52.6271 -52.6271 -52.5424 -52.5424 -52.5367 -52.5367 -25.3142 -25.3142 -25.2988 -25.2988 -25.0655 -25.0655 -22.4390 -22.4390 -22.1581 -22.1581 -22.1384 -22.1384 -21.8053 -21.8053 -21.7986 -21.7986 -21.7890 -21.7890 5.0093 5.0093 12.9511 12.9511 13.8776 13.8776 13.8963 13.8963 13.9452 13.9452 14.0439 14.0439 14.1050 14.1050 14.8792 14.8792 16.0885 16.0885 16.1778 16.1778 16.7746 16.7746 17.2276 17.2276 17.3346 17.3346 18.1460 18.1460 18.6539 18.6539 19.8321 19.8321 20.1417 20.1417 20.2475 20.2475 20.2767 20.2767 22.2229 22.2229 22.3965 22.3965 22.5460 22.5460 k = 0.0000 0.1795-0.0000 ( 5366 PWs) bands (ev): -52.6262 -52.6262 -52.5432 -52.5432 -52.5367 -52.5367 -25.3142 -25.3142 -25.2964 -25.2964 -25.0679 -25.0679 -22.4359 -22.4359 -22.1598 -22.1598 -22.1371 -22.1371 -21.8064 -21.8064 -21.8009 -21.8009 -21.7897 -21.7897 5.0425 5.0425 12.9959 12.9959 13.8881 13.8881 13.9084 13.9084 13.9663 13.9663 14.0731 14.0731 14.1456 14.1456 14.7291 14.7291 16.0675 16.0675 16.1534 16.1534 16.7424 16.7424 17.2601 17.2601 17.3677 17.3677 18.1501 18.1501 18.6625 18.6625 19.7870 19.7870 20.1469 20.1469 20.2521 20.2521 20.2846 20.2846 22.1956 22.1956 22.3672 22.3672 22.4310 22.4310 k = 0.0000 0.1923-0.0000 ( 5366 PWs) bands (ev): -52.6252 -52.6252 -52.5442 -52.5442 -52.5367 -52.5367 -25.3142 -25.3142 -25.2938 -25.2938 -25.0706 -25.0706 -22.4326 -22.4326 -22.1617 -22.1617 -22.1358 -22.1358 -21.8075 -21.8075 -21.8033 -21.8033 -21.7904 -21.7904 5.0775 5.0775 13.0427 13.0427 13.8991 13.8991 13.9206 13.9206 13.9887 13.9887 14.1024 14.1024 14.1887 14.1887 14.5818 14.5818 16.0466 16.0466 16.1293 16.1293 16.7083 16.7083 17.2933 17.2933 17.4018 17.4018 18.1542 18.1542 18.6618 18.6618 19.7391 19.7391 20.1518 20.1518 20.2576 20.2576 20.2929 20.2929 22.1675 22.1675 22.2667 22.2667 22.3750 22.3750 k = 0.0000 0.2051-0.0000 ( 5366 PWs) bands (ev): -52.6242 -52.6242 -52.5451 -52.5451 -52.5367 -52.5367 -25.3142 -25.3142 -25.2911 -25.2911 -25.0733 -25.0733 -22.4292 -22.4292 -22.1637 -22.1637 -22.1344 -22.1344 -21.8087 -21.8087 -21.8059 -21.8059 -21.7911 -21.7911 5.1141 5.1141 13.0909 13.0909 13.9104 13.9104 13.9327 13.9327 14.0124 14.0124 14.1296 14.1296 14.2343 14.2343 14.4411 14.4411 16.0260 16.0260 16.1055 16.1055 16.6724 16.6724 17.3270 17.3270 17.4369 17.4369 18.1583 18.1583 18.6519 18.6519 19.6884 19.6884 20.1564 20.1564 20.2638 20.2638 20.3017 20.3017 22.1384 22.1384 22.1410 22.1410 22.2454 22.2454 k = 0.0000 0.2179-0.0000 ( 5370 PWs) bands (ev): -52.6232 -52.6232 -52.5462 -52.5462 -52.5367 -52.5367 -25.3142 -25.3142 -25.2883 -25.2883 -25.0763 -25.0763 -22.4256 -22.4256 -22.1658 -22.1658 -22.1330 -22.1330 -21.8101 -21.8101 -21.8085 -21.8085 -21.7918 -21.7918 5.1523 5.1523 13.1396 13.1396 13.9220 13.9220 13.9439 13.9439 14.0372 14.0372 14.1439 14.1439 14.2820 14.2820 14.3195 14.3195 16.0058 16.0058 16.0820 16.0820 16.6349 16.6349 17.3612 17.3612 17.4729 17.4729 18.1622 18.1622 18.6333 18.6333 19.6352 19.6352 20.1607 20.1607 20.2709 20.2709 20.3110 20.3110 22.0139 22.0139 22.1023 22.1023 22.1238 22.1238 k = 0.0000 0.2308-0.0000 ( 5382 PWs) bands (ev): -52.6221 -52.6221 -52.5472 -52.5472 -52.5366 -52.5366 -25.3142 -25.3142 -25.2854 -25.2854 -25.0794 -25.0794 -22.4218 -22.4218 -22.1681 -22.1681 -22.1315 -22.1315 -21.8115 -21.8115 -21.8112 -21.8112 -21.7925 -21.7925 5.1917 5.1917 13.1874 13.1874 13.9338 13.9338 13.9509 13.9509 14.0631 14.0631 14.1026 14.1026 14.2644 14.2644 14.3319 14.3319 15.9860 15.9860 16.0591 16.0591 16.5961 16.5961 17.3958 17.3958 17.5095 17.5095 18.1658 18.1658 18.6066 18.6066 19.5798 19.5798 20.1645 20.1645 20.2788 20.2788 20.3206 20.3206 21.8878 21.8878 21.9873 21.9873 22.0825 22.0825 k = 0.0000 0.2436-0.0000 ( 5390 PWs) bands (ev): -52.6210 -52.6210 -52.5483 -52.5483 -52.5366 -52.5366 -25.3142 -25.3142 -25.2823 -25.2823 -25.0826 -25.0826 -22.4179 -22.4179 -22.1705 -22.1705 -22.1300 -22.1300 -21.8139 -21.8139 -21.8130 -21.8130 -21.7931 -21.7931 5.2323 5.2323 13.2316 13.2316 13.9332 13.9332 13.9457 13.9457 14.0276 14.0276 14.0900 14.0900 14.2773 14.2773 14.3836 14.3836 15.9668 15.9668 16.0367 16.0367 16.5560 16.5560 17.4307 17.4307 17.5469 17.5469 18.1691 18.1691 18.5725 18.5725 19.5224 19.5224 20.1679 20.1679 20.2874 20.2874 20.3306 20.3306 21.7636 21.7636 21.8627 21.8627 22.0528 22.0528 k = 0.0000 0.2564-0.0000 ( 5382 PWs) bands (ev): -52.6198 -52.6198 -52.5495 -52.5495 -52.5366 -52.5366 -25.3143 -25.3143 -25.2791 -25.2791 -25.0858 -25.0858 -22.4140 -22.4140 -22.1729 -22.1729 -22.1285 -22.1285 -21.8165 -21.8165 -21.8146 -21.8146 -21.7936 -21.7936 5.2738 5.2738 13.2667 13.2667 13.8551 13.8551 13.9577 13.9577 14.0106 14.0106 14.1178 14.1178 14.3074 14.3074 14.4369 14.4369 15.9482 15.9482 16.0148 16.0148 16.5150 16.5150 17.4657 17.4657 17.5847 17.5847 18.1720 18.1720 18.5317 18.5317 19.4634 19.4634 20.1709 20.1709 20.2967 20.2967 20.3409 20.3409 21.6415 21.6415 21.7399 21.7399 22.0238 22.0238 k = 0.0000 0.2692-0.0000 ( 5374 PWs) bands (ev): -52.6186 -52.6186 -52.5507 -52.5507 -52.5366 -52.5366 -25.3142 -25.3142 -25.2758 -25.2758 -25.0892 -25.0892 -22.4098 -22.4098 -22.1754 -22.1754 -22.1269 -22.1269 -21.8192 -21.8192 -21.8162 -21.8162 -21.7941 -21.7941 5.3160 5.3160 13.2827 13.2827 13.7731 13.7731 13.9697 13.9697 14.0182 14.0182 14.1464 14.1464 14.3417 14.3417 14.4917 14.4917 15.9302 15.9302 15.9937 15.9937 16.4732 16.4732 17.5009 17.5009 17.6230 17.6230 18.1742 18.1742 18.4852 18.4852 19.4033 19.4033 20.1735 20.1735 20.3065 20.3065 20.3514 20.3514 21.5220 21.5220 21.6194 21.6194 21.9952 21.9952 k = 0.0000 0.2821-0.0000 ( 5370 PWs) bands (ev): -52.6173 -52.6173 -52.5519 -52.5519 -52.5366 -52.5366 -25.3142 -25.3142 -25.2724 -25.2724 -25.0927 -25.0927 -22.4056 -22.4056 -22.1780 -22.1780 -22.1254 -22.1254 -21.8219 -21.8219 -21.8178 -21.8178 -21.7946 -21.7946 5.3586 5.3586 13.2651 13.2651 13.7246 13.7246 13.9816 13.9816 14.0300 14.0300 14.1758 14.1758 14.3776 14.3776 14.5476 14.5476 15.9130 15.9130 15.9733 15.9733 16.4308 16.4308 17.5358 17.5358 17.6616 17.6616 18.1757 18.1757 18.4338 18.4338 19.3424 19.3424 20.1758 20.1758 20.3168 20.3168 20.3620 20.3620 21.4053 21.4053 21.5016 21.5016 21.9673 21.9673 k = 0.0000 0.2949-0.0000 ( 5362 PWs) bands (ev): -52.6161 -52.6161 -52.5532 -52.5532 -52.5366 -52.5366 -25.3142 -25.3142 -25.2689 -25.2689 -25.0962 -25.0962 -22.4014 -22.4014 -22.1807 -22.1807 -22.1238 -22.1238 -21.8245 -21.8245 -21.8195 -21.8195 -21.7950 -21.7950 5.4013 5.4013 13.2081 13.2081 13.7193 13.7193 13.9933 13.9933 14.0429 14.0429 14.2057 14.2057 14.4137 14.4137 14.6044 14.6044 15.8965 15.8965 15.9536 15.9536 16.3880 16.3880 17.5704 17.5704 17.7005 17.7005 18.1764 18.1764 18.3787 18.3787 19.2813 19.2813 20.1778 20.1778 20.3273 20.3273 20.3726 20.3726 21.2918 21.2918 21.3868 21.3868 21.9402 21.9402 k = 0.0000 0.3077-0.0000 ( 5354 PWs) bands (ev): -52.6148 -52.6148 -52.5544 -52.5544 -52.5366 -52.5366 -25.3142 -25.3142 -25.2653 -25.2653 -25.0998 -25.0998 -22.3971 -22.3971 -22.1835 -22.1835 -22.1222 -22.1222 -21.8271 -21.8271 -21.8211 -21.8211 -21.7954 -21.7954 5.4439 5.4439 13.1234 13.1234 13.7467 13.7467 14.0048 14.0048 14.0562 14.0562 14.2361 14.2361 14.4494 14.4494 14.6618 14.6618 15.8809 15.8809 15.9348 15.9348 16.3452 16.3452 17.6042 17.6042 17.7394 17.7394 18.1760 18.1760 18.3209 18.3209 19.2205 19.2205 20.1795 20.1795 20.3379 20.3379 20.3833 20.3833 21.1817 21.1817 21.2754 21.2754 21.9140 21.9140 k = 0.0000 0.3205-0.0000 ( 5354 PWs) bands (ev): -52.6135 -52.6135 -52.5557 -52.5557 -52.5366 -52.5366 -25.3141 -25.3141 -25.2618 -25.2618 -25.1035 -25.1035 -22.3928 -22.3928 -22.1863 -22.1863 -22.1207 -22.1207 -21.8296 -21.8296 -21.8228 -21.8228 -21.7958 -21.7958 5.4861 5.4861 13.0259 13.0259 13.7926 13.7926 14.0159 14.0159 14.0695 14.0695 14.2666 14.2666 14.4843 14.4843 14.7193 14.7193 15.8660 15.8660 15.9168 15.9168 16.3025 16.3025 17.6366 17.6366 17.7782 17.7782 18.1743 18.1743 18.2619 18.2619 19.1607 19.1607 20.1811 20.1811 20.3485 20.3485 20.3938 20.3938 21.0754 21.0754 21.1676 21.1676 21.8889 21.8889 k = 0.0000 0.3333-0.0000 ( 5354 PWs) bands (ev): -52.6122 -52.6122 -52.5570 -52.5570 -52.5366 -52.5366 -25.3141 -25.3141 -25.2582 -25.2582 -25.1071 -25.1071 -22.3886 -22.3886 -22.1891 -22.1891 -22.1193 -22.1193 -21.8320 -21.8320 -21.8244 -21.8244 -21.7961 -21.7961 5.5276 5.5276 12.9245 12.9245 13.8481 13.8481 14.0267 14.0267 14.0826 14.0826 14.2973 14.2973 14.5177 14.5177 14.7766 14.7766 15.8521 15.8521 15.8998 15.8998 16.2603 16.2603 17.6669 17.6669 17.8166 17.8166 18.1713 18.1713 18.2031 18.2031 19.1025 19.1025 20.1824 20.1824 20.3588 20.3588 20.4041 20.4041 20.9732 20.9732 21.0637 21.0637 21.8650 21.8650 k = 0.0000 0.3462-0.0000 ( 5354 PWs) bands (ev): -52.6108 -52.6108 -52.5583 -52.5583 -52.5366 -52.5366 -25.3141 -25.3141 -25.2545 -25.2545 -25.1108 -25.1108 -22.3843 -22.3843 -22.1920 -22.1920 -22.1178 -22.1178 -21.8344 -21.8344 -21.8260 -21.8260 -21.7964 -21.7964 5.5679 5.5679 12.8241 12.8241 13.9087 13.9087 14.0370 14.0370 14.0954 14.0954 14.3278 14.3278 14.5494 14.5494 14.8333 14.8333 15.8390 15.8390 15.8837 15.8837 16.2188 16.2188 17.6936 17.6936 17.8544 17.8544 18.1468 18.1468 18.1669 18.1669 19.0467 19.0467 20.1835 20.1835 20.3687 20.3687 20.4140 20.4140 20.8757 20.8757 20.9642 20.9642 21.8171 21.8171 k = 0.0000 0.3590-0.0000 ( 5370 PWs) bands (ev): -52.6095 -52.6095 -52.5596 -52.5596 -52.5366 -52.5366 -25.3142 -25.3142 -25.2509 -25.2509 -25.1146 -25.1146 -22.3802 -22.3802 -22.1949 -22.1949 -22.1165 -22.1165 -21.8366 -21.8366 -21.8275 -21.8275 -21.7968 -21.7968 5.6069 5.6069 12.7273 12.7273 13.9715 13.9715 14.0467 14.0467 14.1079 14.1079 14.3578 14.3578 14.5788 14.5788 14.8888 14.8888 15.8269 15.8269 15.8687 15.8687 16.1784 16.1784 17.7146 17.7146 17.8911 17.8911 18.0959 18.0959 18.1610 18.1610 18.9940 18.9940 20.1845 20.1845 20.3779 20.3779 20.4236 20.4236 20.7834 20.7834 20.8695 20.8695 21.7584 21.7584 k = 0.0000 0.3718-0.0000 ( 5378 PWs) bands (ev): -52.6082 -52.6082 -52.5609 -52.5609 -52.5366 -52.5366 -25.3142 -25.3142 -25.2474 -25.2474 -25.1182 -25.1182 -22.3762 -22.3762 -22.1977 -22.1977 -22.1153 -22.1153 -21.8386 -21.8386 -21.8290 -21.8290 -21.7971 -21.7971 5.6440 5.6440 12.6356 12.6356 14.0346 14.0346 14.0559 14.0559 14.1205 14.1205 14.3872 14.3872 14.6054 14.6054 14.9426 14.9426 15.8157 15.8157 15.8548 15.8548 16.1394 16.1394 17.7266 17.7266 17.9263 17.9263 18.0542 18.0542 18.1537 18.1537 18.9450 18.9450 20.1854 20.1854 20.3861 20.3861 20.4326 20.4326 20.6969 20.6969 20.7801 20.7801 21.7018 21.7018 k = 0.0000 0.3846-0.0000 ( 5378 PWs) bands (ev): -52.6070 -52.6070 -52.5621 -52.5621 -52.5366 -52.5366 -25.3142 -25.3142 -25.2439 -25.2439 -25.1218 -25.1218 -22.3724 -22.3724 -22.2004 -22.2004 -22.1141 -22.1141 -21.8406 -21.8406 -21.8303 -21.8303 -21.7973 -21.7973 5.6791 5.6791 12.5501 12.5501 14.0644 14.0644 14.0939 14.0939 14.1360 14.1360 14.4155 14.4155 14.6288 14.6288 14.9941 14.9941 15.8055 15.8055 15.8420 15.8420 16.1022 16.1022 17.7258 17.7258 17.9592 17.9592 18.0261 18.0261 18.1455 18.1455 18.9004 18.9004 20.1862 20.1862 20.3925 20.3925 20.4410 20.4410 20.6173 20.6173 20.6965 20.6965 21.6481 21.6481 k = 0.0000 0.3974-0.0000 ( 5370 PWs) bands (ev): -52.6058 -52.6058 -52.5633 -52.5633 -52.5366 -52.5366 -25.3141 -25.3141 -25.2405 -25.2405 -25.1252 -25.1252 -22.3687 -22.3687 -22.2030 -22.2030 -22.1130 -22.1130 -21.8423 -21.8423 -21.8316 -21.8316 -21.7975 -21.7975 5.7116 5.7116 12.4718 12.4718 14.0721 14.0721 14.1293 14.1293 14.1732 14.1732 14.4425 14.4425 14.6487 14.6487 15.0427 15.0427 15.7963 15.7963 15.8304 15.8304 16.0672 16.0672 17.7108 17.7108 17.9886 17.9886 18.0137 18.0137 18.1373 18.1373 18.8607 18.8607 20.1869 20.1869 20.3955 20.3955 20.4486 20.4486 20.5467 20.5467 20.6193 20.6193 21.5980 21.5980 k = 0.0000 0.4103-0.0000 ( 5378 PWs) bands (ev): -52.6046 -52.6046 -52.5644 -52.5644 -52.5366 -52.5366 -25.3142 -25.3142 -25.2373 -25.2373 -25.1285 -25.1285 -22.3653 -22.3653 -22.2055 -22.2055 -22.1120 -22.1120 -21.8439 -21.8439 -21.8327 -21.8327 -21.7977 -21.7977 5.7413 5.7413 12.4011 12.4011 14.0791 14.0791 14.1426 14.1426 14.2296 14.2296 14.4678 14.4678 14.6646 14.6646 15.0878 15.0878 15.7881 15.7881 15.8201 15.8201 16.0349 16.0349 17.6844 17.6844 18.0128 18.0128 18.0147 18.0147 18.1309 18.1309 18.8262 18.8262 20.1875 20.1875 20.3900 20.3900 20.4549 20.4549 20.4908 20.4908 20.5495 20.5495 21.5522 21.5522 k = 0.0000 0.4231-0.0000 ( 5378 PWs) bands (ev): -52.6036 -52.6036 -52.5655 -52.5655 -52.5365 -52.5365 -25.3142 -25.3142 -25.2344 -25.2344 -25.1315 -25.1315 -22.3622 -22.3622 -22.2078 -22.2078 -22.1111 -22.1111 -21.8452 -21.8452 -21.8338 -21.8338 -21.7979 -21.7979 5.7678 5.7678 12.3388 12.3388 14.0853 14.0853 14.1516 14.1516 14.2862 14.2862 14.4909 14.4909 14.6762 14.6762 15.1287 15.1287 15.7809 15.7809 15.8110 15.8110 16.0056 16.0056 17.6522 17.6522 18.0240 18.0240 18.0289 18.0289 18.1291 18.1291 18.7970 18.7970 20.1880 20.1880 20.3659 20.3659 20.4567 20.4567 20.4599 20.4599 20.4909 20.4909 21.5112 21.5112 k = 0.0000 0.4359-0.0000 ( 5378 PWs) bands (ev): -52.6026 -52.6026 -52.5665 -52.5665 -52.5365 -52.5365 -25.3142 -25.3142 -25.2316 -25.2316 -25.1342 -25.1342 -22.3595 -22.3595 -22.2098 -22.2098 -22.1103 -22.1103 -21.8464 -21.8464 -21.8346 -21.8346 -21.7980 -21.7980 5.7909 5.7909 12.2853 12.2853 14.0905 14.0905 14.1588 14.1588 14.3395 14.3395 14.5114 14.5114 14.6835 14.6835 15.1647 15.1647 15.7748 15.7748 15.8033 15.8033 15.9799 15.9799 17.6191 17.6191 18.0352 18.0352 18.0370 18.0370 18.1340 18.1340 18.7731 18.7731 20.1884 20.1884 20.3270 20.3270 20.4251 20.4251 20.4510 20.4510 20.4729 20.4729 21.4756 21.4756 k = 0.0000 0.4487-0.0000 ( 5374 PWs) bands (ev): -52.6017 -52.6017 -52.5673 -52.5673 -52.5365 -52.5365 -25.3141 -25.3141 -25.2293 -25.2293 -25.1366 -25.1366 -22.3572 -22.3572 -22.2115 -22.2115 -22.1097 -22.1097 -21.8474 -21.8474 -21.8354 -21.8354 -21.7981 -21.7981 5.8102 5.8102 12.2409 12.2409 14.0949 14.0949 14.1646 14.1646 14.3878 14.3878 14.5290 14.5290 14.6865 14.6865 15.1952 15.1952 15.7698 15.7698 15.7969 15.7969 15.9581 15.9581 17.5886 17.5886 18.0336 18.0336 18.0507 18.0507 18.1439 18.1439 18.7542 18.7542 20.1888 20.1888 20.2878 20.2878 20.3811 20.3811 20.4502 20.4502 20.4754 20.4754 21.4458 21.4458 k = 0.0000 0.4615-0.0000 ( 5374 PWs) bands (ev): -52.6011 -52.6011 -52.5680 -52.5680 -52.5365 -52.5365 -25.3142 -25.3142 -25.2273 -25.2273 -25.1386 -25.1386 -22.3554 -22.3554 -22.2130 -22.2130 -22.1092 -22.1092 -21.8482 -21.8482 -21.8359 -21.8359 -21.7982 -21.7982 5.8254 5.8254 12.2061 12.2061 14.0983 14.0983 14.1692 14.1692 14.4295 14.4295 14.5431 14.5431 14.6858 14.6858 15.2196 15.2196 15.7659 15.7659 15.7918 15.7918 15.9407 15.9407 17.5629 17.5629 18.0284 18.0284 18.0631 18.0631 18.1550 18.1550 18.7401 18.7401 20.1892 20.1892 20.2548 20.2548 20.3450 20.3450 20.4513 20.4513 20.4784 20.4784 21.4222 21.4222 k = 0.0000 0.4744-0.0000 ( 5374 PWs) bands (ev): -52.6005 -52.6005 -52.5685 -52.5685 -52.5365 -52.5365 -25.3142 -25.3142 -25.2259 -25.2259 -25.1401 -25.1401 -22.3540 -22.3540 -22.2140 -22.2140 -22.1088 -22.1088 -21.8487 -21.8487 -21.8364 -21.8364 -21.7983 -21.7983 5.8365 5.8365 12.1810 12.1810 14.1008 14.1008 14.1724 14.1724 14.4627 14.4627 14.5535 14.5535 14.6825 14.6825 15.2374 15.2374 15.7631 15.7631 15.7882 15.7882 15.9281 15.9281 17.5436 17.5436 18.0228 18.0228 18.0727 18.0727 18.1644 18.1644 18.7303 18.7303 20.1896 20.1896 20.2300 20.2300 20.3185 20.3185 20.4527 20.4527 20.4808 20.4808 21.4052 21.4052 k = 0.0000 0.4872-0.0000 ( 5362 PWs) bands (ev): -52.6002 -52.6002 -52.5688 -52.5688 -52.5365 -52.5365 -25.3142 -25.3142 -25.2250 -25.2250 -25.1409 -25.1409 -22.3532 -22.3532 -22.2146 -22.2146 -22.1085 -22.1085 -21.8490 -21.8490 -21.8366 -21.8366 -21.7983 -21.7983 5.8432 5.8432 12.1659 12.1659 14.1023 14.1023 14.1744 14.1744 14.4846 14.4846 14.5599 14.5599 14.6788 14.6788 15.2482 15.2482 15.7614 15.7614 15.7861 15.7861 15.9203 15.9203 17.5317 17.5317 18.0189 18.0189 18.0788 18.0788 18.1706 18.1706 18.7246 18.7246 20.1901 20.1901 20.2147 20.2147 20.3024 20.3024 20.4537 20.4537 20.4823 20.4823 21.3949 21.3949 k = 0.0000 0.5000-0.0000 ( 5358 PWs) bands (ev): -52.6001 -52.6001 -52.5689 -52.5689 -52.5365 -52.5365 -25.3142 -25.3142 -25.2246 -25.2246 -25.1412 -25.1412 -22.3529 -22.3529 -22.2148 -22.2148 -22.1085 -22.1085 -21.8491 -21.8491 -21.8367 -21.8367 -21.7983 -21.7983 5.8454 5.8454 12.1608 12.1608 14.1028 14.1028 14.1750 14.1750 14.4924 14.4924 14.5620 14.5620 14.6771 14.6771 15.2519 15.2519 15.7608 15.7608 15.7854 15.7854 15.9178 15.9178 17.5276 17.5276 18.0174 18.0174 18.0808 18.0808 18.1727 18.1727 18.7227 18.7227 20.1904 20.1904 20.2094 20.2094 20.2970 20.2970 20.4541 20.4541 20.4827 20.4827 21.3914 21.3914 k = 0.0000 0.5000-0.0000 ( 5358 PWs) bands (ev): -52.6001 -52.6001 -52.5689 -52.5689 -52.5365 -52.5365 -25.3142 -25.3142 -25.2246 -25.2246 -25.1412 -25.1412 -22.3529 -22.3529 -22.2148 -22.2148 -22.1085 -22.1085 -21.8491 -21.8491 -21.8367 -21.8367 -21.7983 -21.7983 5.8454 5.8454 12.1608 12.1608 14.1028 14.1028 14.1750 14.1750 14.4924 14.4924 14.5620 14.5620 14.6771 14.6771 15.2519 15.2519 15.7608 15.7608 15.7854 15.7854 15.9178 15.9178 17.5276 17.5276 18.0174 18.0174 18.0808 18.0808 18.1727 18.1727 18.7227 18.7227 20.1904 20.1904 20.2094 20.2094 20.2970 20.2970 20.4541 20.4541 20.4827 20.4827 21.3914 21.3914 k = 0.0128 0.5000-0.0000 ( 5370 PWs) bands (ev): -52.6001 -52.6001 -52.5689 -52.5689 -52.5366 -52.5366 -25.3141 -25.3141 -25.2247 -25.2247 -25.1413 -25.1413 -22.3528 -22.3528 -22.2148 -22.2148 -22.1085 -22.1085 -21.8499 -21.8499 -21.8361 -21.8361 -21.7983 -21.7983 5.8468 5.8468 12.1594 12.1594 14.0984 14.0984 14.1705 14.1705 14.4940 14.4940 14.5675 14.5675 14.6785 14.6785 15.2530 15.2530 15.7617 15.7617 15.7862 15.7862 15.9185 15.9185 17.5258 17.5258 18.0116 18.0116 18.0803 18.0803 18.1721 18.1721 18.7220 18.7220 20.1686 20.1686 20.2177 20.2177 20.3022 20.3022 20.4617 20.4617 20.4920 20.4920 21.3934 21.3934 k = 0.0256 0.5000-0.0000 ( 5378 PWs) bands (ev): -52.6000 -52.6000 -52.5689 -52.5689 -52.5366 -52.5366 -25.3140 -25.3140 -25.2247 -25.2247 -25.1415 -25.1415 -22.3527 -22.3527 -22.2148 -22.2148 -22.1086 -22.1086 -21.8518 -21.8518 -21.8345 -21.8345 -21.7980 -21.7980 5.8511 5.8511 12.1554 12.1554 14.0854 14.0854 14.1575 14.1575 14.4987 14.4987 14.5834 14.5834 14.6827 14.6827 15.2563 15.2563 15.7642 15.7642 15.7890 15.7890 15.9205 15.9205 17.5204 17.5204 17.9940 17.9940 18.0787 18.0787 18.1705 18.1705 18.7200 18.7200 20.1236 20.1236 20.2313 20.2313 20.3142 20.3142 20.4759 20.4759 20.5227 20.5227 21.3991 21.3991 k = 0.0385 0.5000-0.0000 ( 5382 PWs) bands (ev): -52.5999 -52.5999 -52.5689 -52.5689 -52.5368 -52.5368 -25.3137 -25.3137 -25.2248 -25.2248 -25.1419 -25.1419 -22.3524 -22.3524 -22.2147 -22.2147 -22.1088 -22.1088 -21.8543 -21.8543 -21.8326 -21.8326 -21.7975 -21.7975 5.8582 5.8582 12.1487 12.1487 14.0647 14.0647 14.1367 14.1367 14.5068 14.5068 14.6077 14.6077 14.6898 14.6898 15.2619 15.2619 15.7675 15.7675 15.7944 15.7944 15.9240 15.9240 17.5113 17.5113 17.9654 17.9654 18.0759 18.0759 18.1682 18.1682 18.7168 18.7168 20.0675 20.0675 20.2479 20.2479 20.3313 20.3313 20.4933 20.4933 20.5690 20.5690 21.4085 21.4085 k = 0.0513 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5997 -52.5997 -52.5689 -52.5689 -52.5370 -52.5370 -25.3133 -25.3133 -25.2249 -25.2249 -25.1423 -25.1423 -22.3521 -22.3521 -22.2146 -22.2146 -22.1090 -22.1090 -21.8571 -21.8571 -21.8307 -21.8307 -21.7968 -21.7968 5.8681 5.8681 12.1394 12.1394 14.0374 14.0374 14.1094 14.1094 14.5182 14.5182 14.6385 14.6385 14.6996 14.6996 15.2698 15.2698 15.7707 15.7707 15.8031 15.8031 15.9288 15.9288 17.4988 17.4988 17.9266 17.9266 18.0719 18.0719 18.1659 18.1659 18.7127 18.7127 20.0055 20.0055 20.2651 20.2651 20.3544 20.3544 20.5172 20.5172 20.6223 20.6223 21.4209 21.4209 k = 0.0641 0.5000-0.0000 ( 5378 PWs) bands (ev): -52.5995 -52.5995 -52.5689 -52.5689 -52.5372 -52.5372 -25.3129 -25.3129 -25.2250 -25.2250 -25.1429 -25.1429 -22.3517 -22.3517 -22.2145 -22.2145 -22.1093 -22.1093 -21.8600 -21.8600 -21.8288 -21.8288 -21.7959 -21.7959 5.8809 5.8809 12.1277 12.1277 14.0042 14.0042 14.0766 14.0766 14.5329 14.5329 14.6740 14.6740 14.7123 14.7123 15.2801 15.2801 15.7736 15.7736 15.8151 15.8151 15.9348 15.9348 17.4829 17.4829 17.8790 17.8790 18.0665 18.0665 18.1638 18.1638 18.7077 18.7077 19.9402 19.9402 20.2813 20.2813 20.3827 20.3827 20.5497 20.5497 20.6784 20.6784 21.4359 21.4359 k = 0.0769 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5992 -52.5992 -52.5689 -52.5689 -52.5375 -52.5375 -25.3123 -25.3123 -25.2251 -25.2251 -25.1436 -25.1436 -22.3512 -22.3512 -22.2144 -22.2144 -22.1096 -22.1096 -21.8630 -21.8630 -21.8272 -21.8272 -21.7947 -21.7947 5.8964 5.8964 12.1136 12.1136 13.9654 13.9654 14.0395 14.0395 14.5509 14.5509 14.7129 14.7129 14.7278 14.7278 15.2927 15.2927 15.7763 15.7763 15.8301 15.8301 15.9421 15.9421 17.4637 17.4637 17.8241 17.8241 18.0597 18.0597 18.1625 18.1625 18.7020 18.7020 19.8729 19.8729 20.2965 20.2965 20.4136 20.4136 20.5922 20.5922 20.7355 20.7355 21.4523 21.4523 k = 0.0897 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5989 -52.5989 -52.5689 -52.5689 -52.5378 -52.5378 -25.3116 -25.3116 -25.2253 -25.2253 -25.1444 -25.1444 -22.3506 -22.3506 -22.2142 -22.2142 -22.1100 -22.1100 -21.8661 -21.8661 -21.8259 -21.8259 -21.7932 -21.7932 5.9146 5.9146 12.0973 12.0973 13.9203 13.9203 13.9999 13.9999 14.5720 14.5720 14.7453 14.7453 14.7551 14.7551 15.3076 15.3076 15.7790 15.7790 15.8474 15.8474 15.9505 15.9505 17.4413 17.4413 17.7637 17.7637 18.0516 18.0516 18.1621 18.1621 18.6955 18.6955 19.8042 19.8042 20.3116 20.3116 20.4447 20.4447 20.6443 20.6443 20.7926 20.7926 21.4688 21.4688 k = 0.1026 0.5000-0.0000 ( 5370 PWs) bands (ev): -52.5985 -52.5985 -52.5688 -52.5688 -52.5382 -52.5382 -25.3109 -25.3109 -25.2254 -25.2254 -25.1453 -25.1453 -22.3499 -22.3499 -22.2140 -22.2140 -22.1104 -22.1104 -21.8691 -21.8691 -21.8249 -21.8249 -21.7914 -21.7914 5.9355 5.9355 12.0791 12.0791 13.8681 13.8681 13.9597 13.9597 14.5963 14.5963 14.7664 14.7664 14.7983 14.7983 15.3250 15.3250 15.7819 15.7819 15.8667 15.8667 15.9601 15.9601 17.4160 17.4160 17.6992 17.6992 18.0422 18.0422 18.1628 18.1628 18.6880 18.6880 19.7346 19.7346 20.3271 20.3271 20.4754 20.4754 20.7044 20.7044 20.8492 20.8492 21.4833 21.4833 k = 0.1154 0.5000-0.0000 ( 5376 PWs) bands (ev): -52.5981 -52.5981 -52.5688 -52.5688 -52.5386 -52.5386 -25.3100 -25.3100 -25.2256 -25.2256 -25.1463 -25.1463 -22.3491 -22.3491 -22.2138 -22.2138 -22.1109 -22.1109 -21.8722 -21.8722 -21.8242 -21.8242 -21.7894 -21.7894 5.9590 5.9590 12.0590 12.0590 13.8084 13.8084 13.9202 13.9202 14.6236 14.6236 14.7899 14.7899 14.8432 14.8432 15.3448 15.3448 15.7851 15.7851 15.8873 15.8873 15.9707 15.9707 17.3877 17.3877 17.6321 17.6321 18.0319 18.0319 18.1648 18.1648 18.6793 18.6793 19.6645 19.6645 20.3435 20.3435 20.5060 20.5060 20.7704 20.7704 20.9050 20.9050 21.4933 21.4933 k = 0.1282 0.5000-0.0000 ( 5380 PWs) bands (ev): -52.5976 -52.5976 -52.5688 -52.5688 -52.5391 -52.5391 -25.3091 -25.3091 -25.2259 -25.2259 -25.1475 -25.1475 -22.3483 -22.3483 -22.2136 -22.2136 -22.1114 -22.1114 -21.8752 -21.8752 -21.8239 -21.8239 -21.7872 -21.7872 5.9851 5.9851 12.0373 12.0373 13.7412 13.7412 13.8818 13.8818 14.6538 14.6538 14.8160 14.8160 14.8892 14.8892 15.3670 15.3670 15.7886 15.7886 15.9088 15.9088 15.9822 15.9822 17.3567 17.3567 17.5639 17.5639 18.0208 18.0208 18.1680 18.1680 18.6691 18.6691 19.5942 19.5942 20.3609 20.3609 20.5367 20.5367 20.8399 20.8399 20.9597 20.9597 21.4970 21.4970 k = 0.1410 0.5000-0.0000 ( 5378 PWs) bands (ev): -52.5971 -52.5971 -52.5688 -52.5688 -52.5396 -52.5396 -25.3080 -25.3080 -25.2261 -25.2261 -25.1488 -25.1488 -22.3473 -22.3473 -22.2134 -22.2134 -22.1120 -22.1120 -21.8781 -21.8781 -21.8237 -21.8237 -21.7848 -21.7848 6.0136 6.0136 12.0142 12.0142 13.6673 13.6673 13.8446 13.8446 14.6870 14.6870 14.8446 14.8446 14.9359 14.9359 15.3915 15.3915 15.7925 15.7925 15.9307 15.9307 15.9948 15.9948 17.3228 17.3228 17.4958 17.4958 18.0093 18.0093 18.1725 18.1725 18.6573 18.6573 19.5237 19.5237 20.3795 20.3795 20.5682 20.5682 20.9111 20.9111 21.0135 21.0135 21.4938 21.4938 k = 0.1538 0.5000-0.0000 ( 5376 PWs) bands (ev): -52.5965 -52.5965 -52.5688 -52.5688 -52.5402 -52.5402 -25.3069 -25.3069 -25.2263 -25.2263 -25.1501 -25.1501 -22.3463 -22.3463 -22.2131 -22.2131 -22.1126 -22.1126 -21.8810 -21.8810 -21.8238 -21.8238 -21.7822 -21.7822 6.0446 6.0446 11.9900 11.9900 13.5874 13.5874 13.8086 13.8086 14.7228 14.7228 14.8758 14.8758 14.9833 14.9833 15.4185 15.4185 15.7967 15.7967 15.9526 15.9526 16.0084 16.0084 17.2858 17.2858 17.4293 17.4293 17.9977 17.9977 18.1783 18.1783 18.6435 18.6435 19.4533 19.4533 20.3991 20.3991 20.6004 20.6004 20.9823 20.9823 21.0667 21.0667 21.4845 21.4845 k = 0.1667 0.5000-0.0000 ( 5380 PWs) bands (ev): -52.5959 -52.5959 -52.5688 -52.5688 -52.5408 -52.5408 -25.3057 -25.3057 -25.2265 -25.2265 -25.1516 -25.1516 -22.3453 -22.3453 -22.2129 -22.2129 -22.1132 -22.1132 -21.8838 -21.8838 -21.8241 -21.8241 -21.7796 -21.7796 6.0779 6.0779 11.9647 11.9647 13.5022 13.5022 13.7737 13.7737 14.7612 14.7612 14.9094 14.9094 15.0310 15.0310 15.4477 15.4477 15.8013 15.8013 15.9739 15.9739 16.0229 16.0229 17.2452 17.2452 17.3656 17.3656 17.9861 17.9861 18.1853 18.1853 18.6276 18.6276 19.3831 19.3831 20.4198 20.4198 20.6335 20.6335 21.0513 21.0513 21.1200 21.1200 21.4706 21.4706 k = 0.1795 0.5000-0.0000 ( 5372 PWs) bands (ev): -52.5952 -52.5952 -52.5687 -52.5687 -52.5415 -52.5415 -25.3043 -25.3043 -25.2268 -25.2268 -25.1532 -25.1532 -22.3441 -22.3441 -22.2127 -22.2127 -22.1139 -22.1139 -21.8866 -21.8866 -21.8246 -21.8246 -21.7769 -21.7769 6.1133 6.1133 11.9387 11.9387 13.4123 13.4123 13.7398 13.7398 14.8020 14.8020 14.9454 14.9454 15.0790 15.0790 15.4792 15.4792 15.8063 15.8063 15.9943 15.9943 16.0383 16.0383 17.2004 17.2004 17.3065 17.3065 17.9747 17.9747 18.1937 18.1937 18.6093 18.6093 19.3133 19.3133 20.4416 20.4416 20.6675 20.6675 21.1156 21.1156 21.1752 21.1752 21.4534 21.4534 k = 0.1923 0.5000-0.0000 ( 5372 PWs) bands (ev): -52.5945 -52.5945 -52.5687 -52.5687 -52.5422 -52.5422 -25.3030 -25.3030 -25.2270 -25.2270 -25.1548 -25.1548 -22.3429 -22.3429 -22.2125 -22.2125 -22.1146 -22.1146 -21.8892 -21.8892 -21.8252 -21.8252 -21.7741 -21.7741 6.1509 6.1509 11.9121 11.9121 13.3185 13.3185 13.7070 13.7070 14.8451 14.8451 14.9837 14.9837 15.1271 15.1271 15.5128 15.5128 15.8117 15.8117 16.0134 16.0134 16.0546 16.0546 17.1510 17.1510 17.2527 17.2527 17.9636 17.9636 18.2033 18.2033 18.5887 18.5887 19.2440 19.2440 20.4643 20.4643 20.7023 20.7023 21.1727 21.1727 21.2339 21.2339 21.4340 21.4340 k = 0.2051 0.5000-0.0000 ( 5370 PWs) bands (ev): -52.5938 -52.5938 -52.5687 -52.5687 -52.5430 -52.5430 -25.3015 -25.3015 -25.2272 -25.2272 -25.1566 -25.1566 -22.3417 -22.3417 -22.2123 -22.2123 -22.1153 -22.1153 -21.8918 -21.8918 -21.8259 -21.8259 -21.7713 -21.7713 6.1903 6.1903 11.8851 11.8851 13.2213 13.2213 13.6753 13.6753 14.8902 14.8902 15.0242 15.0242 15.1751 15.1751 15.5484 15.5484 15.8175 15.8175 16.0312 16.0312 16.0715 16.0715 17.0979 17.0979 17.2042 17.2042 17.9530 17.9530 18.2142 18.2142 18.5654 18.5654 19.1754 19.1754 20.4878 20.4878 20.7378 20.7378 21.2223 21.2223 21.2957 21.2957 21.4135 21.4135 k = 0.2179 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5930 -52.5930 -52.5687 -52.5687 -52.5438 -52.5438 -25.3000 -25.3000 -25.2275 -25.2275 -25.1584 -25.1584 -22.3404 -22.3404 -22.2121 -22.2121 -22.1160 -22.1160 -21.8942 -21.8942 -21.8267 -21.8267 -21.7686 -21.7686 6.2316 6.2316 11.8579 11.8579 13.1214 13.1214 13.6446 13.6446 14.9371 14.9371 15.0669 15.0669 15.2231 15.2231 15.5858 15.5858 15.8237 15.8237 16.0478 16.0478 16.0885 16.0885 17.0428 17.0428 17.1596 17.1596 17.9427 17.9427 18.2264 18.2264 18.5396 18.5396 19.1076 19.1076 20.5121 20.5121 20.7739 20.7739 21.2657 21.2657 21.3572 21.3572 21.3938 21.3938 k = 0.2308 0.5000-0.0000 ( 5376 PWs) bands (ev): -52.5922 -52.5922 -52.5687 -52.5687 -52.5446 -52.5446 -25.2985 -25.2985 -25.2277 -25.2277 -25.1603 -25.1603 -22.3391 -22.3391 -22.2119 -22.2119 -22.1167 -22.1167 -21.8966 -21.8966 -21.8275 -21.8275 -21.7659 -21.7659 6.2745 6.2745 11.8308 11.8308 13.0194 13.0194 13.6151 13.6151 14.9857 14.9857 15.1115 15.1115 15.2707 15.2707 15.6249 15.6249 15.8303 15.8303 16.0634 16.0634 16.1054 16.1054 16.9874 16.9874 17.1177 17.1177 17.9327 17.9327 18.2398 18.2398 18.5114 18.5114 19.0407 19.0407 20.5370 20.5370 20.8103 20.8103 21.3026 21.3026 21.3720 21.3720 21.4222 21.4222 k = 0.2436 0.5000-0.0000 ( 5370 PWs) bands (ev): -52.5913 -52.5913 -52.5686 -52.5686 -52.5455 -52.5455 -25.2969 -25.2969 -25.2279 -25.2279 -25.1623 -25.1623 -22.3377 -22.3377 -22.2118 -22.2118 -22.1174 -22.1174 -21.8989 -21.8989 -21.8285 -21.8285 -21.7632 -21.7632 6.3188 6.3188 11.8038 11.8038 12.9158 12.9158 13.5867 13.5867 15.0355 15.0355 15.1581 15.1581 15.3180 15.3180 15.6655 15.6655 15.8374 15.8374 16.0781 16.0781 16.1217 16.1217 16.9330 16.9330 17.0775 17.0775 17.9229 17.9229 18.2543 18.2543 18.4808 18.4808 18.9748 18.9748 20.5623 20.5623 20.8468 20.8468 21.3215 21.3215 21.3691 21.3691 21.4812 21.4812 k = 0.2564 0.5000-0.0000 ( 5370 PWs) bands (ev): -52.5904 -52.5904 -52.5686 -52.5686 -52.5464 -52.5464 -25.2952 -25.2952 -25.2281 -25.2281 -25.1644 -25.1644 -22.3363 -22.3363 -22.2117 -22.2117 -22.1181 -22.1181 -21.9010 -21.9010 -21.8294 -21.8294 -21.7606 -21.7606 6.3644 6.3644 11.7772 11.7772 12.8114 12.8114 13.5596 13.5596 15.0864 15.0864 15.2064 15.2064 15.3648 15.3648 15.7071 15.7071 15.8451 15.8451 16.0919 16.0919 16.1372 16.1372 16.8802 16.8802 17.0388 17.0388 17.9131 17.9131 18.2695 18.2695 18.4483 18.4483 18.9102 18.9102 20.5880 20.5880 20.8832 20.8832 21.3112 21.3112 21.3927 21.3927 21.5381 21.5381 k = 0.2692 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5895 -52.5895 -52.5686 -52.5686 -52.5473 -52.5473 -25.2935 -25.2935 -25.2283 -25.2283 -25.1665 -25.1665 -22.3349 -22.3349 -22.2116 -22.2116 -22.1188 -22.1188 -21.9031 -21.9031 -21.8304 -21.8304 -21.7581 -21.7581 6.4110 6.4110 11.7510 11.7510 12.7068 12.7068 13.5336 13.5336 15.1380 15.1380 15.2562 15.2562 15.4109 15.4109 15.7490 15.7490 15.8538 15.8538 16.1050 16.1050 16.1521 16.1521 16.8295 16.8295 17.0012 17.0012 17.9030 17.9030 18.2846 18.2846 18.4149 18.4149 18.8470 18.8470 20.6139 20.6139 20.9192 20.9192 21.2929 21.2929 21.4227 21.4227 21.5921 21.5921 k = 0.2821 0.5000-0.0000 ( 5368 PWs) bands (ev): -52.5885 -52.5885 -52.5686 -52.5686 -52.5483 -52.5483 -25.2918 -25.2918 -25.2284 -25.2284 -25.1686 -25.1686 -22.3335 -22.3335 -22.2115 -22.2115 -22.1195 -22.1195 -21.9050 -21.9050 -21.8314 -21.8314 -21.7557 -21.7557 6.4584 6.4584 11.7255 11.7255 12.6025 12.6025 13.5089 13.5089 15.1900 15.1900 15.3075 15.3075 15.4563 15.4563 15.7899 15.7899 15.8646 15.8646 16.1172 16.1172 16.1663 16.1663 16.7811 16.7811 16.9648 16.9648 17.8923 17.8923 18.2968 18.2968 18.3837 18.3837 18.7852 18.7852 20.6399 20.6399 20.9544 20.9544 21.2744 21.2744 21.4521 21.4521 21.6429 21.6429 k = 0.2949 0.5000-0.0000 ( 5376 PWs) bands (ev): -52.5875 -52.5875 -52.5685 -52.5685 -52.5493 -52.5493 -25.2901 -25.2901 -25.2285 -25.2285 -25.1709 -25.1709 -22.3322 -22.3322 -22.2115 -22.2115 -22.1202 -22.1202 -21.9069 -21.9069 -21.8324 -21.8324 -21.7534 -21.7534 6.5062 6.5062 11.7008 11.7008 12.4992 12.4992 13.4855 13.4855 15.2419 15.2419 15.3600 15.3600 15.5009 15.5009 15.8259 15.8259 15.8810 15.8810 16.1287 16.1287 16.1801 16.1801 16.7352 16.7352 16.9294 16.9294 17.8807 17.8807 18.2952 18.2952 18.3655 18.3655 18.7252 18.7252 20.6657 20.6657 20.9884 20.9884 21.2575 21.2575 21.4796 21.4796 21.6900 21.6900 k = 0.3077 0.5000-0.0000 ( 5376 PWs) bands (ev): -52.5865 -52.5865 -52.5685 -52.5685 -52.5504 -52.5504 -25.2884 -25.2884 -25.2286 -25.2286 -25.1731 -25.1731 -22.3308 -22.3308 -22.2115 -22.2115 -22.1208 -22.1208 -21.9086 -21.9086 -21.8335 -21.8335 -21.7512 -21.7512 6.5542 6.5542 11.6770 11.6770 12.3976 12.3976 13.4634 13.4634 15.2934 15.2934 15.4135 15.4135 15.5444 15.5444 15.8504 15.8504 15.9089 15.9089 16.1395 16.1395 16.1939 16.1939 16.6919 16.6919 16.8953 16.8953 17.8679 17.8679 18.2697 18.2697 18.3708 18.3708 18.6671 18.6671 20.6912 20.6912 21.0205 21.0205 21.2434 21.2434 21.5049 21.5049 21.7330 21.7330 k = 0.3205 0.5000-0.0000 ( 5372 PWs) bands (ev): -52.5854 -52.5854 -52.5685 -52.5685 -52.5515 -52.5515 -25.2866 -25.2866 -25.2286 -25.2286 -25.1753 -25.1753 -22.3294 -22.3294 -22.2115 -22.2115 -22.1214 -22.1214 -21.9102 -21.9102 -21.8344 -21.8344 -21.7491 -21.7491 6.6021 6.6021 11.6541 11.6541 12.2982 12.2982 13.4426 13.4426 15.3440 15.3440 15.4676 15.4676 15.5869 15.5869 15.8650 15.8650 15.9460 15.9460 16.1496 16.1496 16.2081 16.2081 16.6512 16.6512 16.8624 16.8624 17.8537 17.8537 18.2321 18.2321 18.3881 18.3881 18.6110 18.6110 20.7162 20.7162 21.0502 21.0502 21.2330 21.2330 21.5273 21.5273 21.7126 21.7126 k = 0.3333 0.5000-0.0000 ( 5376 PWs) bands (ev): -52.5844 -52.5844 -52.5685 -52.5685 -52.5526 -52.5526 -25.2849 -25.2849 -25.2286 -25.2286 -25.1776 -25.1776 -22.3281 -22.3281 -22.2115 -22.2115 -22.1220 -22.1220 -21.9117 -21.9117 -21.8354 -21.8354 -21.7471 -21.7471 6.6495 6.6495 11.6324 11.6324 12.2017 12.2017 13.4232 13.4232 15.3933 15.3933 15.5220 15.5220 15.6283 15.6283 15.8754 15.8754 15.9854 15.9854 16.1592 16.1592 16.2233 16.2233 16.6130 16.6130 16.8308 16.8308 17.8378 17.8378 18.1904 18.1904 18.4093 18.4093 18.5572 18.5572 20.7406 20.7406 21.0762 21.0762 21.2275 21.2275 21.5435 21.5435 21.6255 21.6255 k = 0.3462 0.5000-0.0000 ( 5364 PWs) bands (ev): -52.5832 -52.5832 -52.5685 -52.5685 -52.5537 -52.5537 -25.2832 -25.2832 -25.2285 -25.2285 -25.1798 -25.1798 -22.3268 -22.3268 -22.2116 -22.2116 -22.1225 -22.1225 -21.9131 -21.9131 -21.8363 -21.8363 -21.7452 -21.7452 6.6961 6.6961 11.6119 11.6119 12.1088 12.1088 13.4051 13.4051 15.4409 15.4409 15.5760 15.5760 15.6687 15.6687 15.8845 15.8845 16.0230 16.0230 16.1685 16.1685 16.2407 16.2407 16.5775 16.5775 16.8007 16.8007 17.8200 17.8200 18.1472 18.1472 18.4324 18.4324 18.5059 18.5059 20.7642 20.7642 21.0974 21.0974 21.2283 21.2283 21.5148 21.5148 21.5843 21.5843 k = 0.3590 0.5000-0.0000 ( 5364 PWs) bands (ev): -52.5821 -52.5821 -52.5684 -52.5684 -52.5548 -52.5548 -25.2816 -25.2816 -25.2283 -25.2283 -25.1821 -25.1821 -22.3255 -22.3255 -22.2117 -22.2117 -22.1230 -22.1230 -21.9144 -21.9144 -21.8372 -21.8372 -21.7434 -21.7434 6.7413 6.7413 11.5927 11.5927 12.0201 12.0201 13.3884 13.3884 15.4863 15.4863 15.6288 15.6288 15.7084 15.7084 15.8929 15.8929 16.0564 16.0564 16.1777 16.1777 16.2611 16.2611 16.5446 16.5446 16.7721 16.7721 17.8002 17.8002 18.1036 18.1036 18.4563 18.4563 18.4574 18.4574 20.7867 20.7867 21.1136 21.1136 21.2355 21.2355 21.4366 21.4366 21.5948 21.5948 k = 0.3718 0.5000-0.0000 ( 5368 PWs) bands (ev): -52.5809 -52.5809 -52.5684 -52.5684 -52.5560 -52.5560 -25.2800 -25.2800 -25.2281 -25.2281 -25.1843 -25.1843 -22.3244 -22.3244 -22.2118 -22.2118 -22.1235 -22.1235 -21.9155 -21.9155 -21.8381 -21.8381 -21.7419 -21.7419 6.7849 6.7849 11.5748 11.5748 11.9363 11.9363 13.3731 13.3731 15.5290 15.5290 15.6788 15.6788 15.7484 15.7484 15.9013 15.9013 16.0837 16.0837 16.1868 16.1868 16.2855 16.2855 16.5145 16.5145 16.7453 16.7453 17.7785 17.7785 18.0604 18.0604 18.4117 18.4117 18.4808 18.4808 20.8081 20.8081 21.1256 21.1256 21.2480 21.2480 21.3579 21.3579 21.6089 21.6089 k = 0.3846 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5798 -52.5798 -52.5684 -52.5684 -52.5572 -52.5572 -25.2786 -25.2786 -25.2279 -25.2279 -25.1865 -25.1865 -22.3233 -22.3233 -22.2119 -22.2119 -22.1239 -22.1239 -21.9166 -21.9166 -21.8389 -21.8389 -21.7404 -21.7404 6.8263 6.8263 11.5583 11.5583 11.8580 11.8580 13.3592 13.3592 15.5686 15.5686 15.7238 15.7238 15.7902 15.7902 15.9096 15.9096 16.1045 16.1045 16.1956 16.1956 16.3130 16.3130 16.4876 16.4876 16.7206 16.7206 17.7550 17.7550 18.0183 18.0183 18.3694 18.3694 18.5050 18.5050 20.8281 20.8281 21.1357 21.1357 21.2576 21.2576 21.2897 21.2897 21.6221 21.6221 k = 0.3974 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5786 -52.5786 -52.5684 -52.5684 -52.5584 -52.5584 -25.2772 -25.2772 -25.2276 -25.2276 -25.1885 -25.1885 -22.3223 -22.3223 -22.2121 -22.2121 -22.1243 -22.1243 -21.9176 -21.9176 -21.8396 -21.8396 -21.7391 -21.7391 6.8651 6.8651 11.5432 11.5432 11.7859 11.7859 13.3468 13.3468 15.6048 15.6048 15.7616 15.7616 15.8351 15.8351 15.9184 15.9184 16.1196 16.1196 16.2037 16.2037 16.3408 16.3408 16.4653 16.4653 16.6984 16.6984 17.7301 17.7301 17.9779 17.9779 18.3304 18.3304 18.5287 18.5287 20.8466 20.8466 21.1458 21.1458 21.2078 21.2078 21.2877 21.2877 21.6336 21.6336 k = 0.4103 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5773 -52.5773 -52.5684 -52.5684 -52.5596 -52.5596 -25.2759 -25.2759 -25.2272 -25.2272 -25.1905 -25.1905 -22.3213 -22.3213 -22.2122 -22.2122 -22.1246 -22.1246 -21.9184 -21.9184 -21.8403 -21.8403 -21.7379 -21.7379 6.9007 6.9007 11.5295 11.5295 11.7208 11.7208 13.3358 13.3358 15.6372 15.6372 15.7921 15.7921 15.8820 15.8820 15.9281 15.9281 16.1304 16.1304 16.2108 16.2108 16.3616 16.3616 16.4523 16.4523 16.6792 16.6792 17.7044 17.7044 17.9400 17.9400 18.2953 18.2953 18.5513 18.5513 20.8634 20.8634 21.1453 21.1453 21.1573 21.1573 21.3044 21.3044 21.6418 21.6418 k = 0.4231 0.5000-0.0000 ( 5374 PWs) bands (ev): -52.5761 -52.5761 -52.5684 -52.5684 -52.5609 -52.5609 -25.2748 -25.2748 -25.2268 -25.2268 -25.1924 -25.1924 -22.3205 -22.3205 -22.2123 -22.2123 -22.1249 -22.1249 -21.9191 -21.9191 -21.8409 -21.8409 -21.7369 -21.7369 6.9328 6.9328 11.5172 11.5172 11.6633 11.6633 13.3262 13.3262 15.6655 15.6655 15.8163 15.8163 15.9240 15.9240 15.9441 15.9441 16.1383 16.1383 16.2168 16.2168 16.3646 16.3646 16.4559 16.4559 16.6641 16.6641 17.6786 17.6786 17.9052 17.9052 18.2641 18.2641 18.5723 18.5723 20.8783 20.8783 21.0887 21.0887 21.1709 21.1709 21.3210 21.3210 21.6266 21.6266 k = 0.4359 0.5000-0.0000 ( 5376 PWs) bands (ev): -52.5749 -52.5749 -52.5684 -52.5684 -52.5621 -52.5621 -25.2738 -25.2738 -25.2263 -25.2263 -25.1940 -25.1940 -22.3198 -22.3198 -22.2125 -22.2125 -22.1252 -22.1252 -21.9197 -21.9197 -21.8414 -21.8414 -21.7360 -21.7360 6.9609 6.9609 11.5059 11.5059 11.6142 11.6142 13.3181 13.3181 15.6896 15.6896 15.8350 15.8350 15.9414 15.9414 15.9841 15.9841 16.1441 16.1441 16.2218 16.2218 16.3515 16.3515 16.4715 16.4715 16.6544 16.6544 17.6535 17.6535 17.8743 17.8743 18.2373 18.2373 18.5913 18.5913 20.8912 20.8912 21.0392 21.0392 21.1868 21.1868 21.3362 21.3362 21.5869 21.5869 k = 0.4487 0.5000-0.0000 ( 5368 PWs) bands (ev): -52.5736 -52.5736 -52.5684 -52.5684 -52.5634 -52.5634 -25.2729 -25.2729 -25.2259 -25.2259 -25.1955 -25.1955 -22.3192 -22.3192 -22.2125 -22.2125 -22.1254 -22.1254 -21.9202 -21.9202 -21.8418 -21.8418 -21.7353 -21.7353 6.9845 6.9845 11.4955 11.4955 11.5745 11.5745 13.3114 13.3114 15.7094 15.7094 15.8492 15.8492 15.9513 15.9513 16.0293 16.0293 16.1486 16.1486 16.2258 16.2258 16.3311 16.3311 16.4869 16.4869 16.6510 16.6510 17.6305 17.6305 17.8478 17.8478 18.2149 18.2149 18.6077 18.6077 20.9020 20.9020 20.9978 20.9978 21.2045 21.2045 21.3497 21.3497 21.5464 21.5464 k = 0.4615 0.5000-0.0000 ( 5372 PWs) bands (ev): -52.5723 -52.5723 -52.5684 -52.5684 -52.5647 -52.5647 -25.2723 -25.2723 -25.2255 -25.2255 -25.1967 -25.1967 -22.3187 -22.3187 -22.2126 -22.2126 -22.1255 -22.1255 -21.9206 -21.9206 -21.8421 -21.8421 -21.7348 -21.7348 7.0033 7.0033 11.4854 11.4854 11.5450 11.5450 13.3063 13.3063 15.7247 15.7247 15.8593 15.8593 15.9596 15.9596 16.0721 16.0721 16.1526 16.1526 16.2288 16.2288 16.3077 16.3077 16.4970 16.4970 16.6535 16.6535 17.6106 17.6106 17.8264 17.8264 18.1973 18.1973 18.6210 18.6210 20.9105 20.9105 20.9649 20.9649 21.2233 21.2233 21.3615 21.3615 21.5080 21.5080 k = 0.4744 0.5000-0.0000 ( 5372 PWs) bands (ev): -52.5711 -52.5711 -52.5684 -52.5684 -52.5659 -52.5659 -25.2718 -25.2718 -25.2252 -25.2252 -25.1976 -25.1976 -22.3184 -22.3184 -22.2127 -22.2127 -22.1257 -22.1257 -21.9208 -21.9208 -21.8423 -21.8423 -21.7343 -21.7343 7.0169 7.0169 11.4759 11.4759 11.5260 11.5260 13.3026 13.3026 15.7357 15.7357 15.8661 15.8661 15.9660 15.9660 16.1092 16.1092 16.1573 16.1573 16.2309 16.2309 16.2828 16.2828 16.5017 16.5017 16.6591 16.6591 17.5953 17.5953 17.8107 17.8107 18.1845 18.1845 18.6309 18.6309 20.9167 20.9167 20.9410 20.9410 21.2411 21.2411 21.3718 21.3718 21.4739 21.4739 k = 0.4872 0.5000-0.0000 ( 5360 PWs) bands (ev): -52.5698 -52.5698 -52.5683 -52.5683 -52.5672 -52.5672 -25.2715 -25.2715 -25.2249 -25.2249 -25.1982 -25.1982 -22.3182 -22.3182 -22.2127 -22.2127 -22.1257 -22.1257 -21.9210 -21.9210 -21.8424 -21.8424 -21.7341 -21.7341 7.0253 7.0253 11.4686 11.4686 11.5161 11.5161 13.3004 13.3004 15.7423 15.7423 15.8700 15.8700 15.9700 15.9700 16.1334 16.1334 16.1670 16.1670 16.2323 16.2323 16.2593 16.2593 16.5033 16.5033 16.6643 16.6643 17.5855 17.5855 17.8011 17.8011 18.1768 18.1768 18.6369 18.6369 20.9204 20.9204 20.9266 20.9266 21.2548 21.2548 21.3809 21.3809 21.4475 21.4475 k = 0.5000 0.5000-0.0000 ( 5360 PWs) bands (ev): -52.5687 -52.5687 -52.5684 -52.5684 -52.5683 -52.5683 -25.2714 -25.2714 -25.2249 -25.2249 -25.1984 -25.1984 -22.3181 -22.3181 -22.2127 -22.2127 -22.1257 -22.1257 -21.9210 -21.9210 -21.8425 -21.8425 -21.7340 -21.7340 7.0280 7.0280 11.4658 11.4658 11.5131 11.5131 13.2996 13.2996 15.7444 15.7444 15.8713 15.8713 15.9714 15.9714 16.1399 16.1399 16.1760 16.1760 16.2328 16.2328 16.2472 16.2472 16.5036 16.5036 16.6664 16.6664 17.5822 17.5822 17.7978 17.7978 18.1742 18.1742 18.6390 18.6390 20.9215 20.9215 20.9219 20.9219 21.2601 21.2601 21.3856 21.3856 21.4363 21.4363 k = 0.5000 0.5000-0.0000 ( 5360 PWs) bands (ev): -52.5687 -52.5687 -52.5684 -52.5684 -52.5683 -52.5683 -25.2714 -25.2714 -25.2249 -25.2249 -25.1984 -25.1984 -22.3181 -22.3181 -22.2127 -22.2127 -22.1257 -22.1257 -21.9210 -21.9210 -21.8425 -21.8425 -21.7340 -21.7340 7.0280 7.0280 11.4658 11.4658 11.5131 11.5131 13.2996 13.2996 15.7444 15.7444 15.8713 15.8713 15.9714 15.9714 16.1399 16.1399 16.1760 16.1760 16.2328 16.2328 16.2472 16.2472 16.5036 16.5036 16.6664 16.6664 17.5822 17.5822 17.7978 17.7978 18.1742 18.1742 18.6390 18.6390 20.9215 20.9215 20.9219 20.9219 21.2601 21.2601 21.3856 21.3856 21.4363 21.4363 k = 0.4909 0.4909-0.0000 ( 5360 PWs) bands (ev): -52.5698 -52.5698 -52.5683 -52.5683 -52.5672 -52.5672 -25.2715 -25.2715 -25.2250 -25.2250 -25.1982 -25.1982 -22.3182 -22.3182 -22.2127 -22.2127 -22.1257 -22.1257 -21.9210 -21.9210 -21.8424 -21.8424 -21.7341 -21.7341 7.0252 7.0252 11.4686 11.4686 11.5161 11.5161 13.3004 13.3004 15.7422 15.7422 15.8700 15.8700 15.9700 15.9700 16.1339 16.1339 16.1666 16.1666 16.2323 16.2323 16.2591 16.2591 16.5035 16.5035 16.6643 16.6643 17.5855 17.5855 17.8011 17.8011 18.1768 18.1768 18.6369 18.6369 20.9219 20.9219 20.9251 20.9251 21.2547 21.2547 21.3811 21.3811 21.4475 21.4475 k = 0.4818 0.4818-0.0000 ( 5372 PWs) bands (ev): -52.5711 -52.5711 -52.5682 -52.5682 -52.5660 -52.5660 -25.2718 -25.2718 -25.2252 -25.2252 -25.1976 -25.1976 -22.3184 -22.3184 -22.2127 -22.2127 -22.1257 -22.1257 -21.9208 -21.9208 -21.8423 -21.8423 -21.7343 -21.7343 7.0169 7.0169 11.4772 11.4772 11.5249 11.5249 13.3026 13.3026 15.7348 15.7348 15.8660 15.8660 15.9661 15.9661 16.1154 16.1154 16.1532 16.1532 16.2311 16.2311 16.2794 16.2794 16.5040 16.5040 16.6586 16.6586 17.5954 17.5954 17.8107 17.8107 18.1845 18.1845 18.6309 18.6309 20.9226 20.9226 20.9352 20.9352 21.2401 21.2401 21.3738 21.3738 21.4730 21.4730 k = 0.4727 0.4727-0.0000 ( 5368 PWs) bands (ev): -52.5725 -52.5725 -52.5681 -52.5681 -52.5648 -52.5648 -25.2723 -25.2723 -25.2256 -25.2256 -25.1966 -25.1966 -22.3188 -22.3188 -22.2126 -22.2126 -22.1255 -22.1255 -21.9205 -21.9205 -21.8421 -21.8421 -21.7347 -21.7347 7.0030 7.0030 11.4911 11.4911 11.5398 11.5398 13.3063 13.3063 15.7205 15.7205 15.8587 15.8587 15.9607 15.9607 16.0921 16.0921 16.1410 16.1410 16.2293 16.2293 16.2935 16.2935 16.5083 16.5083 16.6508 16.6508 17.6109 17.6109 17.8265 17.8265 18.1968 18.1968 18.6212 18.6212 20.9238 20.9238 20.9519 20.9519 21.2197 21.2197 21.3680 21.3680 21.5053 21.5053 k = 0.4636 0.4636-0.0000 ( 5368 PWs) bands (ev): -52.5738 -52.5738 -52.5679 -52.5679 -52.5636 -52.5636 -25.2729 -25.2729 -25.2261 -25.2261 -25.1953 -25.1953 -22.3193 -22.3193 -22.2125 -22.2125 -22.1254 -22.1254 -21.9202 -21.9202 -21.8417 -21.8417 -21.7353 -21.7353 6.9839 6.9839 11.5101 11.5101 11.5609 11.5609 13.3114 13.3114 15.6971 15.6971 15.8468 15.8468 15.9551 15.9551 16.0728 16.0728 16.1262 16.1262 16.2267 16.2267 16.2944 16.2944 16.5193 16.5193 16.6434 16.6434 17.6312 17.6312 17.8480 17.8480 18.2132 18.2132 18.6084 18.6084 20.9256 20.9256 20.9749 20.9749 21.1965 21.1965 21.3635 21.3635 21.5414 21.5414 k = 0.4545 0.4545-0.0000 ( 5356 PWs) bands (ev): -52.5752 -52.5752 -52.5677 -52.5677 -52.5624 -52.5624 -25.2737 -25.2737 -25.2267 -25.2267 -25.1937 -25.1937 -22.3199 -22.3199 -22.2123 -22.2123 -22.1252 -22.1252 -21.9196 -21.9196 -21.8413 -21.8413 -21.7360 -21.7360 6.9596 6.9596 11.5340 11.5340 11.5883 11.5883 13.3181 13.3181 15.6635 15.6635 15.8288 15.8288 15.9515 15.9515 16.0612 16.0612 16.1069 16.1069 16.2230 16.2230 16.2803 16.2803 16.5378 16.5378 16.6390 16.6390 17.6549 17.6549 17.8746 17.8746 18.2327 18.2327 18.5935 18.5935 20.9279 20.9279 21.0039 21.0039 21.1725 21.1725 21.3595 21.3595 21.5797 21.5797 k = 0.4455 0.4455-0.0000 ( 5358 PWs) bands (ev): -52.5766 -52.5766 -52.5674 -52.5674 -52.5613 -52.5613 -25.2746 -25.2746 -25.2274 -25.2274 -25.1917 -25.1917 -22.3207 -22.3207 -22.2121 -22.2121 -22.1250 -22.1250 -21.9190 -21.9190 -21.8408 -21.8408 -21.7368 -21.7368 6.9305 6.9305 11.5623 11.5623 11.6219 11.6219 13.3261 13.3261 15.6198 15.6198 15.8033 15.8033 15.9518 15.9518 16.0571 16.0571 16.0825 16.0825 16.2167 16.2167 16.2548 16.2548 16.5610 16.5610 16.6405 16.6405 17.6809 17.6809 17.9058 17.9058 18.2537 18.2537 18.5778 18.5778 20.9308 20.9308 21.0383 21.0383 21.1488 21.1488 21.3556 21.3556 21.6183 21.6183 k = 0.4364 0.4364-0.0000 ( 5360 PWs) bands (ev): -52.5781 -52.5781 -52.5671 -52.5671 -52.5602 -52.5602 -25.2757 -25.2757 -25.2283 -25.2283 -25.1895 -25.1895 -22.3217 -22.3217 -22.2118 -22.2118 -22.1248 -22.1248 -21.9183 -21.9183 -21.8402 -21.8402 -21.7378 -21.7378 6.8968 6.8968 11.5951 11.5951 11.6616 11.6616 13.3354 13.3354 15.5675 15.5675 15.7707 15.7707 15.9560 15.9560 16.0481 16.0481 16.0638 16.0638 16.1975 16.1975 16.2312 16.2312 16.5852 16.5852 16.6507 16.6507 17.7082 17.7082 17.9409 17.9409 18.2741 18.2741 18.5638 18.5638 20.9345 20.9345 21.0766 21.0766 21.1271 21.1271 21.3514 21.3514 21.6412 21.6412 k = 0.4273 0.4273-0.0000 ( 5368 PWs) bands (ev): -52.5795 -52.5795 -52.5667 -52.5667 -52.5591 -52.5591 -25.2768 -25.2768 -25.2294 -25.2294 -25.1871 -25.1871 -22.3229 -22.3229 -22.2114 -22.2114 -22.1246 -22.1246 -21.9174 -21.9174 -21.8395 -21.8395 -21.7390 -21.7390 6.8588 6.8588 11.6322 11.6322 11.7070 11.7070 13.3461 13.3461 15.5081 15.5081 15.7322 15.7322 15.9626 15.9626 16.0140 16.0140 16.0696 16.0696 16.1558 16.1558 16.2221 16.2221 16.6078 16.6078 16.6711 16.6711 17.7357 17.7357 17.9795 17.9795 18.2901 18.2901 18.5548 18.5548 20.9390 20.9390 21.0961 21.0961 21.1302 21.1302 21.3464 21.3464 21.6355 21.6355 k = 0.4182 0.4182-0.0000 ( 5362 PWs) bands (ev): -52.5810 -52.5810 -52.5663 -52.5663 -52.5581 -52.5581 -25.2780 -25.2780 -25.2305 -25.2305 -25.1844 -25.1844 -22.3243 -22.3243 -22.2108 -22.2108 -22.1243 -22.1243 -21.9164 -21.9164 -21.8387 -21.8387 -21.7402 -21.7402 6.8170 6.8170 11.6737 11.6737 11.7577 11.7577 13.3581 13.3581 15.4432 15.4432 15.6889 15.6889 15.9615 15.9615 15.9824 15.9824 16.0796 16.0796 16.1039 16.1039 16.2179 16.2179 16.6298 16.6298 16.7004 16.7004 17.7627 17.7627 18.0212 18.0212 18.2977 18.2977 18.5550 18.5550 20.9444 20.9444 21.0786 21.0786 21.1758 21.1758 21.3403 21.3403 21.6257 21.6257 k = 0.4091 0.4091-0.0000 ( 5354 PWs) bands (ev): -52.5825 -52.5825 -52.5658 -52.5658 -52.5570 -52.5570 -25.2792 -25.2792 -25.2317 -25.2317 -25.1814 -25.1814 -22.3258 -22.3258 -22.2102 -22.2102 -22.1241 -22.1241 -21.9152 -21.9152 -21.8379 -21.8379 -21.7415 -21.7415 6.7715 6.7715 11.7194 11.7194 11.8134 11.8134 13.3713 13.3713 15.3740 15.3740 15.6418 15.6418 15.9209 15.9209 15.9848 15.9848 16.0469 16.0469 16.0911 16.0911 16.2157 16.2157 16.6537 16.6537 16.7358 16.7358 17.7886 17.7886 18.0653 18.0653 18.2937 18.2937 18.5676 18.5676 20.9506 20.9506 21.0593 21.0593 21.2284 21.2284 21.3326 21.3326 21.6145 21.6145 k = 0.4000 0.4000-0.0000 ( 5354 PWs) bands (ev): -52.5840 -52.5840 -52.5653 -52.5653 -52.5560 -52.5560 -25.2805 -25.2805 -25.2330 -25.2330 -25.1784 -25.1784 -22.3276 -22.3276 -22.2094 -22.2094 -22.1239 -22.1239 -21.9139 -21.9139 -21.8370 -21.8370 -21.7430 -21.7430 6.7228 6.7228 11.7696 11.7696 11.8736 11.8736 13.3857 13.3857 15.3013 15.3013 15.5916 15.5916 15.8702 15.8702 15.9766 15.9766 16.0026 16.0026 16.1019 16.1019 16.2154 16.2154 16.6809 16.6809 16.7760 16.7760 17.8127 17.8127 18.1116 18.1116 18.2784 18.2784 18.5925 18.5925 20.9578 20.9578 21.0410 21.0410 21.2847 21.2847 21.3230 21.3230 21.6025 21.6025 k = 0.3909 0.3909-0.0000 ( 5362 PWs) bands (ev): -52.5855 -52.5855 -52.5648 -52.5648 -52.5551 -52.5551 -25.2819 -25.2819 -25.2345 -25.2345 -25.1751 -25.1751 -22.3296 -22.3296 -22.2085 -22.2085 -22.1237 -22.1237 -21.9125 -21.9125 -21.8360 -21.8360 -21.7445 -21.7445 6.6713 6.6713 11.8240 11.8240 11.9378 11.9378 13.4012 13.4012 15.2258 15.2258 15.5388 15.5388 15.8153 15.8153 15.9176 15.9176 16.0056 16.0056 16.1108 16.1108 16.2175 16.2175 16.7121 16.7121 16.8206 16.8206 17.8346 17.8346 18.1591 18.1591 18.2549 18.2549 18.6270 18.6270 20.9660 20.9660 21.0238 21.0238 21.3093 21.3093 21.3455 21.3455 21.5899 21.5899 k = 0.3818 0.3818-0.0000 ( 5368 PWs) bands (ev): -52.5871 -52.5871 -52.5642 -52.5642 -52.5542 -52.5542 -25.2832 -25.2832 -25.2361 -25.2361 -25.1718 -25.1718 -22.3318 -22.3318 -22.2075 -22.2075 -22.1236 -22.1236 -21.9109 -21.9109 -21.8350 -21.8350 -21.7461 -21.7461 6.6172 6.6172 11.8828 11.8828 12.0057 12.0057 13.4176 13.4176 15.1481 15.1481 15.4840 15.4840 15.7572 15.7572 15.8523 15.8523 16.0110 16.0110 16.1165 16.1165 16.2227 16.2227 16.7473 16.7473 16.8699 16.8699 17.8540 17.8540 18.2004 18.2004 18.2333 18.2333 18.6681 18.6681 20.9750 20.9750 21.0079 21.0079 21.2938 21.2938 21.4071 21.4071 21.5775 21.5775 k = 0.3727 0.3727-0.0000 ( 5366 PWs) bands (ev): -52.5886 -52.5886 -52.5636 -52.5636 -52.5532 -52.5532 -25.2846 -25.2846 -25.2378 -25.2378 -25.1682 -25.1682 -22.3343 -22.3343 -22.2063 -22.2063 -22.1235 -22.1235 -21.9092 -21.9092 -21.8339 -21.8339 -21.7478 -21.7478 6.5609 6.5609 11.9458 11.9458 12.0769 12.0769 13.4350 13.4350 15.0685 15.0685 15.4275 15.4275 15.6965 15.6965 15.7853 15.7853 16.0142 16.0142 16.1180 16.1180 16.2314 16.2314 16.7863 16.7863 16.9241 16.9241 17.8703 17.8703 18.1840 18.1840 18.2671 18.2671 18.7138 18.7138 20.9846 20.9846 20.9932 20.9932 21.2745 21.2745 21.4694 21.4694 21.5672 21.5672 k = 0.3636 0.3636-0.0000 ( 5354 PWs) bands (ev): -52.5902 -52.5902 -52.5629 -52.5629 -52.5524 -52.5524 -25.2859 -25.2859 -25.2395 -25.2395 -25.1645 -25.1645 -22.3369 -22.3369 -22.2050 -22.2050 -22.1234 -22.1234 -21.9072 -21.9072 -21.8327 -21.8327 -21.7495 -21.7495 6.5027 6.5027 12.0130 12.0130 12.1510 12.1510 13.4532 13.4532 14.9875 14.9875 15.3696 15.3696 15.6339 15.6339 15.7174 15.7174 16.0147 16.0147 16.1146 16.1146 16.2439 16.2439 16.8290 16.8290 16.9835 16.9835 17.8832 17.8832 18.1492 18.1492 18.3186 18.3186 18.7627 18.7627 20.9792 20.9792 20.9953 20.9953 21.2515 21.2515 21.5186 21.5186 21.5726 21.5726 k = 0.3545 0.3545-0.0000 ( 5366 PWs) bands (ev): -52.5917 -52.5917 -52.5622 -52.5622 -52.5515 -52.5515 -25.2873 -25.2873 -25.2414 -25.2414 -25.1608 -25.1608 -22.3397 -22.3397 -22.2036 -22.2036 -22.1234 -22.1234 -21.9052 -21.9052 -21.8315 -21.8315 -21.7513 -21.7513 6.4430 6.4430 12.0844 12.0844 12.2275 12.2275 13.4721 13.4721 14.9052 14.9052 15.3108 15.3108 15.5696 15.5696 15.6491 15.6491 16.0124 16.0124 16.1060 16.1060 16.2601 16.2601 16.8750 16.8750 17.0481 17.0481 17.8922 17.8922 18.1125 18.1125 18.3724 18.3724 18.8137 18.8137 20.9666 20.9666 21.0059 21.0059 21.2251 21.2251 21.5243 21.5243 21.6241 21.6241 k = 0.3455 0.3455-0.0000 ( 5372 PWs) bands (ev): -52.5933 -52.5933 -52.5615 -52.5615 -52.5507 -52.5507 -25.2886 -25.2886 -25.2434 -25.2434 -25.1570 -25.1570 -22.3428 -22.3428 -22.2020 -22.2020 -22.1235 -22.1235 -21.9029 -21.9029 -21.8303 -21.8303 -21.7531 -21.7531 6.3820 6.3820 12.1598 12.1598 12.3061 12.3061 13.4916 13.4916 14.8221 14.8221 15.2513 15.2513 15.5041 15.5041 15.5806 15.5806 16.0077 16.0077 16.0922 16.0922 16.2795 16.2795 16.9243 16.9243 17.1177 17.1177 17.8964 17.8964 18.0760 18.0760 18.4274 18.4274 18.8662 18.8662 20.9547 20.9547 21.0162 21.0162 21.1958 21.1958 21.5160 21.5160 21.6925 21.6925 k = 0.3364 0.3364-0.0000 ( 5366 PWs) bands (ev): -52.5949 -52.5949 -52.5607 -52.5607 -52.5499 -52.5499 -25.2899 -25.2899 -25.2454 -25.2454 -25.1531 -25.1531 -22.3460 -22.3460 -22.2003 -22.2003 -22.1236 -22.1236 -21.9005 -21.9005 -21.8290 -21.8290 -21.7549 -21.7549 6.3199 6.3199 12.2392 12.2392 12.3864 12.3864 13.5116 13.5116 14.7383 14.7383 15.1913 15.1913 15.4377 15.4377 15.5122 15.5122 16.0012 16.0012 16.0736 16.0736 16.3017 16.3017 16.9765 16.9765 17.1918 17.1918 17.8946 17.8946 18.0417 18.0417 18.4833 18.4833 18.9197 18.9197 20.9436 20.9436 21.0257 21.0257 21.1647 21.1647 21.5075 21.5075 21.7648 21.7648 k = 0.3273 0.3273-0.0000 ( 5370 PWs) bands (ev): -52.5964 -52.5964 -52.5599 -52.5599 -52.5491 -52.5491 -25.2912 -25.2912 -25.2475 -25.2475 -25.1491 -25.1491 -22.3494 -22.3494 -22.1986 -22.1986 -22.1238 -22.1238 -21.8979 -21.8979 -21.8277 -21.8277 -21.7567 -21.7567 6.2571 6.2571 12.3224 12.3224 12.4681 12.4681 13.5320 13.5320 14.6541 14.6541 15.1310 15.1310 15.3707 15.3707 15.4442 15.4442 15.9929 15.9929 16.0508 16.0508 16.3263 16.3263 17.0314 17.0314 17.2699 17.2699 17.8852 17.8852 18.0116 18.0116 18.5400 18.5400 18.9739 18.9739 20.9330 20.9330 21.0334 21.0334 21.1326 21.1326 21.5013 21.5013 21.8388 21.8388 k = 0.3182 0.3182-0.0000 ( 5366 PWs) bands (ev): -52.5980 -52.5980 -52.5591 -52.5591 -52.5484 -52.5484 -25.2925 -25.2925 -25.2497 -25.2497 -25.1450 -25.1450 -22.3529 -22.3529 -22.1967 -22.1967 -22.1241 -22.1241 -21.8951 -21.8951 -21.8263 -21.8263 -21.7585 -21.7585 6.1938 6.1938 12.4093 12.4093 12.5509 12.5509 13.5527 13.5527 14.5698 14.5698 15.0707 15.0707 15.3034 15.3034 15.3766 15.3766 15.9827 15.9827 16.0251 16.0251 16.3527 16.3527 17.0887 17.0887 17.3511 17.3511 17.8669 17.8669 17.9873 17.9873 18.5973 18.5973 19.0283 19.0283 20.9229 20.9229 21.0383 21.0383 21.1009 21.1009 21.4989 21.4989 21.9045 21.9045 k = 0.3091 0.3091-0.0000 ( 5365 PWs) bands (ev): -52.5996 -52.5996 -52.5583 -52.5583 -52.5477 -52.5477 -25.2937 -25.2937 -25.2519 -25.2519 -25.1410 -25.1410 -22.3566 -22.3566 -22.1947 -22.1947 -22.1244 -22.1244 -21.8921 -21.8921 -21.8249 -21.8249 -21.7603 -21.7603 6.1302 6.1302 12.4997 12.4997 12.6344 12.6344 13.5734 13.5734 14.4855 14.4855 15.0106 15.0106 15.2359 15.2359 15.3097 15.3097 15.9684 15.9684 16.0000 16.0000 16.3807 16.3807 17.1480 17.1480 17.4345 17.4345 17.8407 17.8407 17.9685 17.9685 18.6551 18.6551 19.0828 19.0828 20.9131 20.9131 21.0393 21.0393 21.0709 21.0709 21.5017 21.5017 21.9258 21.9258 k = 0.3000 0.3000-0.0000 ( 5383 PWs) bands (ev): -52.6011 -52.6011 -52.5574 -52.5574 -52.5470 -52.5470 -25.2950 -25.2950 -25.2543 -25.2543 -25.1369 -25.1369 -22.3605 -22.3605 -22.1927 -22.1927 -22.1249 -22.1249 -21.8890 -21.8890 -21.8236 -21.8236 -21.7621 -21.7621 6.0665 6.0665 12.5933 12.5933 12.7183 12.7183 13.5941 13.5941 14.4016 14.4016 14.9509 14.9509 15.1686 15.1686 15.2434 15.2434 15.9448 15.9448 15.9816 15.9816 16.4099 16.4099 17.2090 17.2090 17.5187 17.5187 17.8094 17.8094 17.9531 17.9531 18.7132 18.7132 19.1371 19.1371 20.9035 20.9035 21.0343 21.0343 21.0449 21.0449 21.5108 21.5108 21.9472 21.9472 k = 0.2909 0.2909-0.0000 ( 5383 PWs) bands (ev): -52.6027 -52.6027 -52.5566 -52.5566 -52.5463 -52.5463 -25.2962 -25.2962 -25.2567 -25.2567 -25.1328 -25.1328 -22.3644 -22.3644 -22.1906 -22.1906 -22.1254 -22.1254 -21.8858 -21.8858 -21.8222 -21.8222 -21.7639 -21.7639 6.0030 6.0030 12.6898 12.6898 12.8025 12.8025 13.6146 13.6146 14.3183 14.3183 14.8916 14.8916 15.1016 15.1016 15.1779 15.1779 15.9129 15.9129 15.9700 15.9700 16.4400 16.4400 17.2711 17.2711 17.6013 17.6013 17.7770 17.7770 17.9393 17.9393 18.7716 18.7716 19.1910 19.1910 20.8939 20.8939 21.0166 21.0166 21.0302 21.0302 21.5268 21.5268 21.9706 21.9706 k = 0.2818 0.2818-0.0000 ( 5391 PWs) bands (ev): -52.6042 -52.6042 -52.5557 -52.5557 -52.5457 -52.5457 -25.2974 -25.2974 -25.2591 -25.2591 -25.1287 -25.1287 -22.3685 -22.3685 -22.1885 -22.1885 -22.1259 -22.1259 -21.8823 -21.8823 -21.8208 -21.8208 -21.7656 -21.7656 5.9398 5.9398 12.7885 12.7885 12.8871 12.8871 13.6348 13.6348 14.2359 14.2359 14.8330 14.8330 15.0352 15.0352 15.1132 15.1132 15.8776 15.8776 15.9614 15.9614 16.4708 16.4708 17.3334 17.3334 17.6732 17.6732 17.7520 17.7520 17.9272 17.9272 18.8302 18.8302 19.2445 19.2445 20.8845 20.8845 20.9976 20.9976 21.0164 21.0164 21.5501 21.5501 21.9957 21.9957 k = 0.2727 0.2727-0.0000 ( 5391 PWs) bands (ev): -52.6057 -52.6057 -52.5548 -52.5548 -52.5451 -52.5451 -25.2985 -25.2985 -25.2616 -25.2616 -25.1245 -25.1245 -22.3726 -22.3726 -22.1864 -22.1864 -22.1265 -22.1265 -21.8787 -21.8787 -21.8194 -21.8194 -21.7672 -21.7672 5.8771 5.8771 12.8878 12.8878 12.9728 12.9728 13.6545 13.6545 14.1547 14.1547 14.7751 14.7751 14.9694 14.9694 15.0493 15.0493 15.8413 15.8413 15.9545 15.9545 16.5021 16.5021 17.3945 17.3945 17.6876 17.6876 17.7777 17.7777 17.9212 17.9212 18.8888 18.8888 19.2973 19.2973 20.8750 20.8750 20.9830 20.9830 20.9991 20.9991 21.5804 21.5804 22.0222 22.0222 k = 0.2636 0.2636-0.0000 ( 5373 PWs) bands (ev): -52.6073 -52.6073 -52.5539 -52.5539 -52.5445 -52.5445 -25.2995 -25.2995 -25.2640 -25.2640 -25.1204 -25.1204 -22.3767 -22.3767 -22.1842 -22.1842 -22.1271 -22.1271 -21.8750 -21.8750 -21.8179 -21.8179 -21.7687 -21.7687 5.8150 5.8150 12.9848 12.9848 13.0619 13.0619 13.6737 13.6737 14.0750 14.0750 14.7182 14.7182 14.9045 14.9045 14.9863 14.9863 15.8052 15.8052 15.9493 15.9493 16.5337 16.5337 17.4508 17.4508 17.6649 17.6649 17.8197 17.8197 17.9373 17.9373 18.9474 18.9474 19.3493 19.3493 20.8650 20.8650 20.9696 20.9696 20.9833 20.9833 21.6173 21.6173 22.0497 22.0497 k = 0.2545 0.2545-0.0000 ( 5373 PWs) bands (ev): -52.6087 -52.6087 -52.5530 -52.5530 -52.5439 -52.5439 -25.3006 -25.3006 -25.2665 -25.2665 -25.1164 -25.1164 -22.3809 -22.3809 -22.1820 -22.1820 -22.1278 -22.1278 -21.8712 -21.8712 -21.8165 -21.8165 -21.7703 -21.7703 5.7538 5.7538 13.0750 13.0750 13.1578 13.1578 13.6921 13.6921 13.9974 13.9974 14.6622 14.6622 14.8406 14.8406 14.9242 14.9242 15.7704 15.7704 15.9456 15.9456 16.5654 16.5654 17.4937 17.4937 17.6488 17.6488 17.8288 17.8288 17.9888 17.9888 19.0057 19.0057 19.4004 19.4004 20.8539 20.8539 20.9472 20.9472 20.9815 20.9815 21.6604 21.6604 22.0781 22.0781 k = 0.2455 0.2455-0.0000 ( 5377 PWs) bands (ev): -52.6102 -52.6102 -52.5521 -52.5521 -52.5434 -52.5434 -25.3016 -25.3016 -25.2691 -25.2691 -25.1124 -25.1124 -22.3852 -22.3852 -22.1799 -22.1799 -22.1286 -22.1286 -21.8672 -21.8672 -21.8151 -21.8151 -21.7717 -21.7717 5.6935 5.6935 13.1556 13.1556 13.2623 13.2623 13.7097 13.7097 13.9226 13.9226 14.6075 14.6075 14.7779 14.7779 14.8630 14.8630 15.7378 15.7378 15.9436 15.9436 16.5970 16.5970 17.5079 17.5079 17.6548 17.6548 17.8243 17.8243 18.0550 18.0550 19.0638 19.0638 19.4506 19.4506 20.8406 20.8406 20.9200 20.9200 20.9917 20.9917 21.7092 21.7092 22.1070 22.1070 k = 0.2364 0.2364-0.0000 ( 5377 PWs) bands (ev): -52.6117 -52.6117 -52.5512 -52.5512 -52.5429 -52.5429 -25.3025 -25.3025 -25.2716 -25.2716 -25.1084 -25.1084 -22.3895 -22.3895 -22.1777 -22.1777 -22.1294 -22.1294 -21.8632 -21.8632 -21.8137 -21.8137 -21.7731 -21.7731 5.6343 5.6343 13.2266 13.2266 13.3734 13.3734 13.7262 13.7262 13.8518 13.8518 14.5539 14.5539 14.7166 14.7166 14.8026 14.8026 15.7083 15.7083 15.9435 15.9435 16.6283 16.6283 17.4939 17.4939 17.6738 17.6738 17.8277 17.8277 18.1215 18.1215 19.1215 19.1215 19.4996 19.4996 20.8243 20.8243 20.8908 20.8908 21.0131 21.0131 21.7631 21.7631 22.1363 22.1363 k = 0.2273 0.2273-0.0000 ( 5379 PWs) bands (ev): -52.6131 -52.6131 -52.5503 -52.5503 -52.5424 -52.5424 -25.3035 -25.3035 -25.2741 -25.2741 -25.1045 -25.1045 -22.3937 -22.3937 -22.1756 -22.1756 -22.1303 -22.1303 -21.8591 -21.8591 -21.8124 -21.8124 -21.7744 -21.7744 5.5764 5.5764 13.2879 13.2879 13.4884 13.4884 13.7402 13.7402 13.7889 13.7889 14.5016 14.5016 14.6568 14.6568 14.7431 14.7431 15.6826 15.6826 15.9454 15.9454 16.6591 16.6591 17.4675 17.4675 17.6787 17.6787 17.8543 17.8543 18.1837 18.1837 19.1788 19.1788 19.5474 19.5474 20.8042 20.8042 20.8610 20.8610 21.0461 21.0461 21.8220 21.8220 22.1659 22.1659 k = 0.2182 0.2182-0.0000 ( 5379 PWs) bands (ev): -52.6145 -52.6145 -52.5494 -52.5494 -52.5419 -52.5419 -25.3044 -25.3044 -25.2767 -25.2767 -25.1007 -25.1007 -22.3980 -22.3980 -22.1736 -22.1736 -22.1312 -22.1312 -21.8549 -21.8549 -21.8111 -21.8111 -21.7755 -21.7755 5.5198 5.5198 13.3369 13.3369 13.6040 13.6040 13.7234 13.7234 13.7673 13.7673 14.4508 14.4508 14.5987 14.5987 14.6845 14.6845 15.6617 15.6617 15.9493 15.9493 16.6892 16.6892 17.4370 17.4370 17.6642 17.6642 17.9020 17.9020 18.2397 18.2397 19.2354 19.2354 19.5938 19.5938 20.7795 20.7795 20.8315 20.8315 21.0908 21.0908 21.8853 21.8853 22.1957 22.1957 k = 0.2091 0.2091-0.0000 ( 5379 PWs) bands (ev): -52.6158 -52.6158 -52.5485 -52.5485 -52.5415 -52.5415 -25.3052 -25.3052 -25.2792 -25.2792 -25.0969 -25.0969 -22.4022 -22.4022 -22.1715 -22.1715 -22.1321 -22.1321 -21.8506 -21.8506 -21.8098 -21.8098 -21.7766 -21.7766 5.4647 5.4647 13.3673 13.3673 13.6782 13.6782 13.7168 13.7168 13.7935 13.7935 14.4015 14.4015 14.5426 14.5426 14.6268 14.6268 15.6461 15.6461 15.9554 15.9554 16.7185 16.7185 17.4054 17.4054 17.6389 17.6389 17.9597 17.9597 18.2884 18.2884 19.2914 19.2914 19.6390 19.6390 20.7504 20.7504 20.8026 20.8026 21.1473 21.1473 21.9528 21.9528 22.2257 22.2257 k = 0.2000 0.2000-0.0000 ( 5373 PWs) bands (ev): -52.6171 -52.6171 -52.5477 -52.5477 -52.5410 -52.5410 -25.3060 -25.3060 -25.2817 -25.2817 -25.0932 -25.0932 -22.4064 -22.4064 -22.1696 -22.1696 -22.1330 -22.1330 -21.8463 -21.8463 -21.8085 -21.8085 -21.7776 -21.7776 5.4112 5.4112 13.3717 13.3717 13.6632 13.6632 13.7645 13.7645 13.8777 13.8777 14.3537 14.3537 14.4890 14.4890 14.5701 14.5701 15.6366 15.6366 15.9637 15.9637 16.7469 16.7469 17.3738 17.3738 17.6083 17.6083 18.0209 18.0209 18.3291 18.3291 19.3466 19.3466 19.6826 19.6826 20.7178 20.7178 20.7735 20.7735 21.2153 21.2153 22.0242 22.0242 22.2560 22.2560 k = 0.1909 0.1909-0.0000 ( 5375 PWs) bands (ev): -52.6184 -52.6184 -52.5468 -52.5468 -52.5406 -52.5406 -25.3068 -25.3068 -25.2842 -25.2842 -25.0897 -25.0897 -22.4105 -22.4105 -22.1676 -22.1676 -22.1340 -22.1340 -21.8421 -21.8421 -21.8073 -21.8073 -21.7785 -21.7785 5.3593 5.3593 13.3491 13.3491 13.6681 13.6681 13.7815 13.7815 13.9955 13.9955 14.3077 14.3077 14.4388 14.4388 14.5145 14.5145 15.6336 15.6336 15.9742 15.9742 16.7741 16.7741 17.3427 17.3427 17.5748 17.5748 18.0823 18.0823 18.3617 18.3617 19.4010 19.4010 19.7247 19.7247 20.6828 20.6828 20.7433 20.7433 21.2942 21.2942 22.0992 22.0992 22.2867 22.2867 k = 0.1818 0.1818-0.0000 ( 5379 PWs) bands (ev): -52.6197 -52.6197 -52.5460 -52.5460 -52.5403 -52.5403 -25.3075 -25.3075 -25.2866 -25.2866 -25.0862 -25.0862 -22.4145 -22.4145 -22.1658 -22.1658 -22.1350 -22.1350 -21.8379 -21.8379 -21.8061 -21.8061 -21.7794 -21.7794 5.3093 5.3093 13.3084 13.3084 13.6872 13.6872 13.7925 13.7925 14.1155 14.1155 14.2634 14.2634 14.3953 14.3953 14.4601 14.4601 15.6373 15.6373 15.9868 15.9868 16.7999 16.7999 17.3124 17.3124 17.5398 17.5398 18.1422 18.1422 18.3861 18.3861 19.4544 19.4544 19.7652 19.7652 20.6464 20.6464 20.7113 20.7113 21.3831 21.3831 22.1770 22.1770 22.3186 22.3186 k = 0.1727 0.1727-0.0000 ( 5375 PWs) bands (ev): -52.6209 -52.6209 -52.5452 -52.5452 -52.5399 -52.5399 -25.3082 -25.3082 -25.2890 -25.2890 -25.0829 -25.0829 -22.4184 -22.4184 -22.1640 -22.1640 -22.1359 -22.1359 -21.8337 -21.8337 -21.8050 -21.8050 -21.7801 -21.7801 5.2611 5.2611 13.2589 13.2589 13.7114 13.7114 13.8010 13.8010 14.2128 14.2128 14.2253 14.2253 14.3746 14.3746 14.4074 14.4074 15.6481 15.6481 16.0015 16.0015 16.8243 16.8243 17.2831 17.2831 17.5040 17.5040 18.1994 18.1994 18.4027 18.4027 19.5069 19.5069 19.8040 19.8040 20.6094 20.6094 20.6771 20.6771 21.4807 21.4807 22.2561 22.2561 22.3530 22.3530 k = 0.1636 0.1636-0.0000 ( 5377 PWs) bands (ev): -52.6220 -52.6220 -52.5444 -52.5444 -52.5396 -52.5396 -25.3088 -25.3088 -25.2913 -25.2913 -25.0797 -25.0797 -22.4222 -22.4222 -22.1623 -22.1623 -22.1369 -22.1369 -21.8296 -21.8296 -21.8039 -21.8039 -21.7807 -21.7807 5.2149 5.2149 13.2062 13.2062 13.7356 13.7356 13.8078 13.8078 14.1793 14.1793 14.2432 14.2432 14.3543 14.3543 14.4362 14.4362 15.6657 15.6657 16.0183 16.0183 16.8471 16.8471 17.2549 17.2549 17.4679 17.4679 18.2527 18.2527 18.4119 18.4119 19.5583 19.5583 19.8411 19.8411 20.5720 20.5720 20.6408 20.6408 21.5853 21.5853 22.3305 22.3305 22.3951 22.3951 k = 0.1545 0.1545-0.0000 ( 5373 PWs) bands (ev): -52.6231 -52.6231 -52.5436 -52.5436 -52.5392 -52.5392 -25.3094 -25.3094 -25.2936 -25.2936 -25.0765 -25.0765 -22.4259 -22.4259 -22.1607 -22.1607 -22.1378 -22.1378 -21.8256 -21.8256 -21.8028 -21.8028 -21.7812 -21.7812 5.1707 5.1707 13.1529 13.1529 13.7573 13.7573 13.8132 13.8132 14.1405 14.1405 14.2148 14.2148 14.3042 14.3042 14.5534 14.5534 15.6899 15.6899 16.0370 16.0370 16.8681 16.8681 17.2279 17.2279 17.4321 17.4321 18.3011 18.3011 18.4142 18.4142 19.6085 19.6085 19.8764 19.8764 20.5348 20.5348 20.6027 20.6027 21.6946 21.6946 22.3841 22.3841 22.4392 22.4392 k = 0.1455 0.1455-0.0000 ( 5369 PWs) bands (ev): -52.6242 -52.6242 -52.5429 -52.5429 -52.5390 -52.5390 -25.3100 -25.3100 -25.2957 -25.2957 -25.0736 -25.0736 -22.4294 -22.4294 -22.1592 -22.1592 -22.1387 -22.1387 -21.8217 -21.8217 -21.8017 -21.8017 -21.7817 -21.7817 5.1286 5.1286 13.1005 13.1005 13.7756 13.7756 13.8174 13.8174 14.1035 14.1035 14.1774 14.1774 14.2557 14.2557 14.6831 14.6831 15.7202 15.7202 16.0574 16.0574 16.8872 16.8872 17.2021 17.2021 17.3969 17.3969 18.3435 18.3435 18.4105 18.4105 19.6575 19.6575 19.9097 19.9097 20.4978 20.4978 20.5635 20.5635 21.8057 21.8057 22.4081 22.4081 22.4604 22.4604 k = 0.1364 0.1364-0.0000 ( 5367 PWs) bands (ev): -52.6252 -52.6252 -52.5422 -52.5422 -52.5387 -52.5387 -25.3105 -25.3105 -25.2978 -25.2978 -25.0707 -25.0707 -22.4328 -22.4328 -22.1577 -22.1577 -22.1396 -22.1396 -21.8181 -21.8181 -21.8007 -21.8007 -21.7820 -21.7820 5.0887 5.0887 13.0497 13.0497 13.7902 13.7902 13.8206 13.8206 14.0685 14.0685 14.1393 14.1393 14.2090 14.2090 14.8163 14.8163 15.7559 15.7559 16.0793 16.0793 16.9043 16.9043 17.1775 17.1775 17.3626 17.3626 18.3791 18.3791 18.4013 18.4013 19.7051 19.7051 19.9411 19.9411 20.4612 20.4612 20.5238 20.5238 21.9149 21.9149 22.4112 22.4112 22.5024 22.5024 k = 0.1273 0.1273-0.0000 ( 5365 PWs) bands (ev): -52.6261 -52.6261 -52.5415 -52.5415 -52.5384 -52.5384 -25.3110 -25.3110 -25.2998 -25.2998 -25.0681 -25.0681 -22.4360 -22.4360 -22.1564 -22.1564 -22.1405 -22.1405 -21.8147 -21.8147 -21.7996 -21.7996 -21.7823 -21.7823 5.0511 5.0511 13.0011 13.0011 13.8012 13.8012 13.8228 13.8228 14.0354 14.0354 14.1024 14.1024 14.1644 14.1644 14.9507 14.9507 15.7963 15.7963 16.1026 16.1026 16.9192 16.9192 17.1543 17.1543 17.3297 17.3297 18.3873 18.3873 18.4068 18.4068 19.7513 19.7513 19.9704 19.9704 20.4252 20.4252 20.4848 20.4848 22.0172 22.0172 22.4093 22.4093 22.5589 22.5589 k = 0.1182 0.1182-0.0000 ( 5359 PWs) bands (ev): -52.6270 -52.6270 -52.5409 -52.5409 -52.5382 -52.5382 -25.3115 -25.3115 -25.3016 -25.3016 -25.0656 -25.0656 -22.4391 -22.4391 -22.1551 -22.1551 -22.1413 -22.1413 -21.8116 -21.8116 -21.7985 -21.7985 -21.7825 -21.7825 5.0158 5.0158 12.9550 12.9550 13.8089 13.8089 13.8243 13.8243 14.0045 14.0045 14.0674 14.0674 14.1221 14.1221 15.0852 15.0852 15.8405 15.8405 16.1271 16.1271 16.9320 16.9320 17.1322 17.1322 17.2983 17.2983 18.3695 18.3695 18.4258 18.4258 19.7958 19.7958 19.9975 19.9975 20.3900 20.3900 20.4473 20.4473 22.1074 22.1074 22.4071 22.4071 22.6307 22.6307 k = 0.1091 0.1091-0.0000 ( 5359 PWs) bands (ev): -52.6279 -52.6279 -52.5403 -52.5403 -52.5380 -52.5380 -25.3119 -25.3119 -25.3034 -25.3034 -25.0633 -25.0633 -22.4420 -22.4420 -22.1539 -22.1539 -22.1421 -22.1421 -21.8088 -21.8088 -21.7972 -21.7972 -21.7826 -21.7826 4.9829 4.9829 12.9117 12.9117 13.8137 13.8137 13.8252 13.8252 13.9755 13.9755 14.0347 14.0347 14.0823 14.0823 15.2190 15.2190 15.8875 15.8875 16.1525 16.1525 16.9425 16.9425 17.1114 17.1114 17.2688 17.2688 18.3484 18.3484 18.4353 18.4353 19.8386 19.8386 20.0223 20.0223 20.3562 20.3562 20.4123 20.4123 22.1819 22.1819 22.4054 22.4054 22.7199 22.7199 k = 0.1000 0.1000-0.0000 ( 5375 PWs) bands (ev): -52.6287 -52.6287 -52.5398 -52.5398 -52.5378 -52.5378 -25.3123 -25.3123 -25.3051 -25.3051 -25.0611 -25.0611 -22.4447 -22.4447 -22.1528 -22.1528 -22.1428 -22.1428 -21.8066 -21.8066 -21.7958 -21.7958 -21.7827 -21.7827 4.9524 4.9524 12.8713 12.8713 13.8161 13.8161 13.8255 13.8255 13.9487 13.9487 14.0044 14.0044 14.0451 14.0451 15.3512 15.3512 15.9363 15.9363 16.1786 16.1786 16.9507 16.9507 17.0917 17.0917 17.2414 17.2414 18.3248 18.3248 18.4349 18.4349 19.8794 19.8794 20.0446 20.0446 20.3243 20.3243 20.3801 20.3801 22.2400 22.2400 22.4045 22.4045 22.8253 22.8253 k = 0.0909 0.0909-0.0000 ( 5383 PWs) bands (ev): -52.6294 -52.6294 -52.5392 -52.5392 -52.5376 -52.5376 -25.3127 -25.3127 -25.3066 -25.3066 -25.0592 -25.0592 -22.4472 -22.4472 -22.1519 -22.1519 -22.1435 -22.1435 -21.8048 -21.8048 -21.7942 -21.7942 -21.7828 -21.7828 4.9244 4.9244 12.8340 12.8340 13.8168 13.8168 13.8251 13.8251 13.9241 13.9241 13.9766 13.9766 14.0107 14.0107 15.4810 15.4810 15.9858 15.9858 16.2054 16.2054 16.9568 16.9568 17.0730 17.0730 17.2165 17.2165 18.2995 18.2995 18.4246 18.4246 19.9180 19.9180 20.0641 20.0641 20.2954 20.2954 20.3512 20.3512 22.2843 22.2843 22.4044 22.4044 22.9435 22.9435 k = 0.0818 0.0818-0.0000 ( 5387 PWs) bands (ev): -52.6300 -52.6300 -52.5388 -52.5388 -52.5374 -52.5374 -25.3130 -25.3130 -25.3081 -25.3081 -25.0574 -25.0574 -22.4494 -22.4494 -22.1510 -22.1510 -22.1442 -22.1442 -21.8034 -21.8034 -21.7925 -21.7925 -21.7828 -21.7828 4.8990 4.8990 12.7999 12.7999 13.8164 13.8164 13.8238 13.8238 13.9015 13.9015 13.9516 13.9516 13.9794 13.9794 15.6073 15.6073 16.0348 16.0348 16.2326 16.2326 16.9607 16.9607 17.0552 17.0552 17.1942 17.1942 18.2731 18.2731 18.4047 18.4047 19.9541 19.9541 20.0805 20.0805 20.2705 20.2705 20.3254 20.3254 22.3181 22.3181 22.4052 22.4052 23.0695 23.0695 k = 0.0727 0.0727-0.0000 ( 5389 PWs) bands (ev): -52.6306 -52.6306 -52.5384 -52.5384 -52.5373 -52.5373 -25.3133 -25.3133 -25.3093 -25.3093 -25.0557 -25.0557 -22.4515 -22.4515 -22.1501 -22.1501 -22.1447 -22.1447 -21.8024 -21.8024 -21.7907 -21.7907 -21.7827 -21.7827 4.8761 4.8761 12.7692 12.7692 13.8153 13.8153 13.8217 13.8217 13.8811 13.8811 13.9292 13.9292 13.9513 13.9513 15.7288 15.7288 16.0821 16.0821 16.2602 16.2602 16.9626 16.9626 17.0383 17.0383 17.1747 17.1747 18.2465 18.2465 18.3762 18.3762 19.9873 19.9873 20.0934 20.0934 20.2506 20.2506 20.3028 20.3028 22.3441 22.3441 22.4066 22.4066 23.1990 23.1990 k = 0.0636 0.0636-0.0000 ( 5385 PWs) bands (ev): -52.6311 -52.6311 -52.5380 -52.5380 -52.5371 -52.5371 -25.3135 -25.3135 -25.3105 -25.3105 -25.0543 -25.0543 -22.4533 -22.4533 -22.1494 -22.1494 -22.1453 -22.1453 -21.8016 -21.8016 -21.7889 -21.7889 -21.7827 -21.7827 4.8558 4.8558 12.7419 12.7419 13.8136 13.8136 13.8191 13.8191 13.8629 13.8629 13.9097 13.9097 13.9265 13.9265 15.8438 15.8438 16.1264 16.1264 16.2885 16.2885 16.9630 16.9630 17.0222 17.0222 17.1581 17.1581 18.2204 18.2204 18.3404 18.3404 20.0174 20.0174 20.1022 20.1022 20.2362 20.2362 20.2834 20.2834 22.3645 22.3645 22.4084 22.4084 23.3284 23.3284 k = 0.0545 0.0545-0.0000 ( 5401 PWs) bands (ev): -52.6316 -52.6316 -52.5376 -52.5376 -52.5370 -52.5370 -25.3138 -25.3138 -25.3115 -25.3115 -25.0530 -25.0530 -22.4550 -22.4550 -22.1488 -22.1488 -22.1458 -22.1458 -21.8011 -21.8011 -21.7873 -21.7873 -21.7826 -21.7826 4.8381 4.8381 12.7181 12.7181 13.8116 13.8116 13.8160 13.8160 13.8469 13.8469 13.8931 13.8931 13.9053 13.9053 15.9505 15.9505 16.1663 16.1663 16.3174 16.3174 16.9622 16.9622 17.0068 17.0068 17.1443 17.1443 18.1957 18.1957 18.2994 18.2994 20.0439 20.0439 20.1071 20.1071 20.2275 20.2275 20.2671 20.2671 22.3805 22.3805 22.4105 22.4105 23.4542 23.4542 k = 0.0455 0.0455-0.0000 ( 5405 PWs) bands (ev): -52.6320 -52.6320 -52.5374 -52.5374 -52.5369 -52.5369 -25.3140 -25.3140 -25.3124 -25.3124 -25.0519 -25.0519 -22.4563 -22.4563 -22.1483 -22.1483 -22.1462 -22.1462 -21.8007 -21.8007 -21.7858 -21.7858 -21.7825 -21.7825 4.8231 4.8231 12.6979 12.6979 13.8094 13.8094 13.8126 13.8126 13.8332 13.8332 13.8794 13.8794 13.8877 13.8877 16.0462 16.0462 16.2007 16.2007 16.3472 16.3472 16.9605 16.9605 16.9926 16.9926 17.1332 17.1332 18.1730 18.1730 18.2558 18.2558 20.0664 20.0664 20.1086 20.1086 20.2236 20.2236 20.2539 20.2539 22.3931 22.3931 22.4126 22.4126 23.5731 23.5731 k = 0.0364 0.0364-0.0000 ( 5415 PWs) bands (ev): -52.6323 -52.6323 -52.5371 -52.5371 -52.5369 -52.5369 -25.3142 -25.3142 -25.3131 -25.3131 -25.0510 -25.0510 -22.4575 -22.4575 -22.1479 -22.1479 -22.1465 -22.1465 -21.8004 -21.8004 -21.7846 -21.7846 -21.7824 -21.7824 4.8108 4.8108 12.6812 12.6812 13.8070 13.8070 13.8094 13.8094 13.8217 13.8217 13.8686 13.8686 13.8737 13.8737 16.1282 16.1282 16.2288 16.2288 16.3773 16.3773 16.9585 16.9585 16.9798 16.9798 17.1246 17.1246 18.1533 18.1533 18.2128 18.2128 20.0843 20.0843 20.1082 20.1082 20.2231 20.2231 20.2437 20.2437 22.4028 22.4028 22.4147 22.4147 23.6816 23.6816 k = 0.0273 0.0273-0.0000 ( 5415 PWs) bands (ev): -52.6325 -52.6325 -52.5370 -52.5370 -52.5368 -52.5368 -25.3143 -25.3143 -25.3137 -25.3137 -25.0504 -25.0504 -22.4584 -22.4584 -22.1475 -22.1475 -22.1468 -22.1468 -21.8002 -21.8002 -21.7836 -21.7836 -21.7824 -21.7824 4.8012 4.8012 12.6682 12.6682 13.8046 13.8046 13.8064 13.8064 13.8127 13.8127 13.8605 13.8605 13.8632 13.8632 16.1936 16.1936 16.2503 16.2503 16.4064 16.4064 16.9564 16.9564 16.9689 16.9689 17.1181 17.1181 18.1370 18.1370 18.1738 18.1738 20.0959 20.0959 20.1090 20.1090 20.2243 20.2243 20.2363 20.2363 22.4100 22.4100 22.4164 22.4164 23.7752 23.7752 k = 0.0182 0.0182-0.0000 ( 5419 PWs) bands (ev): -52.6327 -52.6327 -52.5368 -52.5368 -52.5368 -52.5368 -25.3144 -25.3144 -25.3141 -25.3141 -25.0499 -25.0499 -22.4590 -22.4590 -22.1473 -22.1473 -22.1470 -22.1470 -21.8001 -21.8001 -21.7829 -21.7829 -21.7823 -21.7823 4.7944 4.7944 12.6589 12.6589 13.8026 13.8026 13.8040 13.8040 13.8061 13.8061 13.8549 13.8549 13.8561 13.8561 16.2403 16.2403 16.2654 16.2654 16.4318 16.4318 16.9548 16.9548 16.9605 16.9605 17.1136 17.1136 18.1249 18.1249 18.1425 18.1425 20.0990 20.0990 20.1139 20.1139 20.2260 20.2260 20.2314 20.2314 22.4150 22.4150 22.4178 22.4178 23.8488 23.8488 k = 0.0091 0.0091-0.0000 ( 5425 PWs) bands (ev): -52.6328 -52.6328 -52.5368 -52.5368 -52.5367 -52.5367 -25.3144 -25.3144 -25.3144 -25.3144 -25.0496 -25.0496 -22.4594 -22.4594 -22.1472 -22.1472 -22.1471 -22.1471 -21.8000 -21.8000 -21.7824 -21.7824 -21.7823 -21.7823 4.7903 4.7903 12.6534 12.6534 13.8012 13.8012 13.8019 13.8019 13.8027 13.8027 13.8517 13.8517 13.8519 13.8519 16.2681 16.2681 16.2743 16.2743 16.4495 16.4495 16.9537 16.9537 16.9551 16.9551 17.1109 17.1109 18.1175 18.1175 18.1221 18.1221 20.0987 20.0987 20.1187 20.1187 20.2273 20.2273 20.2286 20.2286 22.4179 22.4179 22.4186 22.4186 23.8965 23.8971 k = 0.0000 0.0000 0.0000 ( 5449 PWs) bands (ev): -52.6329 -52.6329 -52.5367 -52.5367 -52.5367 -52.5367 -25.3145 -25.3145 -25.3145 -25.3145 -25.0495 -25.0495 -22.4596 -22.4596 -22.1472 -22.1472 -22.1472 -22.1472 -21.8001 -21.8001 -21.7823 -21.7823 -21.7823 -21.7823 4.7889 4.7889 12.6515 12.6515 13.8006 13.8006 13.8006 13.8006 13.8020 13.8020 13.8506 13.8506 13.8506 13.8506 16.2772 16.2772 16.2772 16.2772 16.4558 16.4558 16.9533 16.9533 16.9533 16.9533 17.1100 17.1100 18.1150 18.1150 18.1150 18.1150 20.0984 20.0984 20.1204 20.1204 20.2278 20.2278 20.2278 20.2278 22.4189 22.4189 22.4189 22.4189 23.9131 23.9131 k = 0.0000 0.0000 0.0000 ( 5449 PWs) bands (ev): -52.6329 -52.6329 -52.5367 -52.5367 -52.5367 -52.5367 -25.3145 -25.3145 -25.3145 -25.3145 -25.0495 -25.0495 -22.4596 -22.4596 -22.1472 -22.1472 -22.1472 -22.1472 -21.8001 -21.8001 -21.7823 -21.7823 -21.7823 -21.7823 4.7889 4.7889 12.6515 12.6515 13.8006 13.8006 13.8006 13.8006 13.8020 13.8020 13.8506 13.8506 13.8506 13.8506 16.2772 16.2772 16.2772 16.2772 16.4558 16.4558 16.9533 16.9533 16.9533 16.9533 17.1100 17.1100 18.1150 18.1150 18.1150 18.1150 20.0984 20.0984 20.1204 20.1204 20.2278 20.2278 20.2278 20.2278 22.4189 22.4189 22.4189 22.4189 23.9131 23.9131 k = 0.0074 0.0074 0.0074 ( 5428 PWs) bands (ev): -52.6328 -52.6328 -52.5367 -52.5367 -52.5367 -52.5367 -25.3144 -25.3144 -25.3144 -25.3144 -25.0496 -25.0496 -22.4594 -22.4594 -22.1472 -22.1472 -22.1471 -22.1471 -21.8000 -21.8000 -21.7824 -21.7824 -21.7823 -21.7823 4.7902 4.7902 12.6533 12.6533 13.8011 13.8011 13.8020 13.8020 13.8026 13.8026 13.8516 13.8516 13.8519 13.8519 16.2689 16.2689 16.2737 16.2737 16.4496 16.4496 16.9540 16.9540 16.9547 16.9547 17.1109 17.1109 18.1196 18.1196 18.1198 18.1198 20.0987 20.0987 20.1187 20.1187 20.2272 20.2272 20.2287 20.2287 22.4183 22.4183 22.4183 22.4183 23.8969 23.8989 k = 0.0147 0.0147 0.0147 ( 5419 PWs) bands (ev): -52.6327 -52.6327 -52.5368 -52.5368 -52.5368 -52.5368 -25.3143 -25.3143 -25.3141 -25.3141 -25.0499 -25.0499 -22.4590 -22.4590 -22.1473 -22.1473 -22.1470 -22.1470 -21.8001 -21.8001 -21.7829 -21.7829 -21.7823 -21.7823 4.7943 4.7943 12.6588 12.6588 13.8020 13.8020 13.8046 13.8046 13.8058 13.8058 13.8548 13.8548 13.8560 13.8560 16.2444 16.2444 16.2625 16.2625 16.4318 16.4318 16.9561 16.9561 16.9590 16.9590 17.1134 17.1134 18.1330 18.1330 18.1338 18.1338 20.0987 20.0987 20.1142 20.1142 20.2258 20.2258 20.2316 20.2316 22.4163 22.4163 22.4166 22.4166 23.8483 23.8483 k = 0.0221 0.0221 0.0221 ( 5419 PWs) bands (ev): -52.6325 -52.6325 -52.5369 -52.5369 -52.5369 -52.5369 -25.3142 -25.3142 -25.3138 -25.3138 -25.0503 -25.0503 -22.4584 -22.4584 -22.1475 -22.1475 -22.1469 -22.1469 -21.8002 -21.8002 -21.7836 -21.7836 -21.7823 -21.7823 4.8010 4.8010 12.6679 12.6679 13.8030 13.8030 13.8080 13.8080 13.8120 13.8120 13.8604 13.8604 13.8631 13.8631 16.2051 16.2051 16.2417 16.2417 16.4058 16.4058 16.9596 16.9596 16.9657 16.9657 17.1176 17.1176 18.1541 18.1541 18.1557 18.1557 20.0940 20.0940 20.1108 20.1108 20.2244 20.2244 20.2366 20.2366 22.4130 22.4130 22.4136 22.4136 23.7707 23.7707 k = 0.0294 0.0294 0.0294 ( 5413 PWs) bands (ev): -52.6323 -52.6323 -52.5370 -52.5370 -52.5370 -52.5370 -25.3140 -25.3140 -25.3133 -25.3133 -25.0510 -25.0510 -22.4575 -22.4575 -22.1477 -22.1477 -22.1467 -22.1467 -21.8004 -21.8004 -21.7846 -21.7846 -21.7823 -21.7823 4.8104 4.8104 12.6807 12.6807 13.8038 13.8038 13.8127 13.8127 13.8202 13.8202 13.8686 13.8686 13.8735 13.8735 16.1528 16.1528 16.2082 16.2082 16.3768 16.3768 16.9642 16.9642 16.9746 16.9746 17.1233 17.1233 18.1812 18.1812 18.1834 18.1834 20.0798 20.0798 20.1124 20.1124 20.2241 20.2241 20.2439 20.2439 22.4083 22.4083 22.4094 22.4094 23.6707 23.6707 k = 0.0368 0.0368 0.0368 ( 5407 PWs) bands (ev): -52.6320 -52.6320 -52.5371 -52.5371 -52.5371 -52.5371 -25.3138 -25.3138 -25.3126 -25.3126 -25.0519 -25.0519 -22.4564 -22.4564 -22.1481 -22.1481 -22.1464 -22.1464 -21.8007 -21.8007 -21.7859 -21.7859 -21.7823 -21.7823 4.8225 4.8225 12.6970 12.6970 13.8041 13.8041 13.8187 13.8187 13.8296 13.8296 13.8799 13.8799 13.8874 13.8874 16.0894 16.0894 16.1597 16.1597 16.3492 16.3492 16.9700 16.9700 16.9853 16.9853 17.1306 17.1306 18.2124 18.2124 18.2148 18.2148 20.0580 20.0580 20.1164 20.1164 20.2261 20.2261 20.2539 20.2539 22.4021 22.4021 22.4039 22.4039 23.5546 23.5546 k = 0.0441 0.0441 0.0441 ( 5383 PWs) bands (ev): -52.6316 -52.6316 -52.5373 -52.5373 -52.5373 -52.5373 -25.3135 -25.3135 -25.3118 -25.3118 -25.0529 -25.0529 -22.4550 -22.4550 -22.1485 -22.1485 -22.1460 -22.1460 -21.8011 -21.8011 -21.7873 -21.7873 -21.7823 -21.7823 4.8373 4.8373 12.7169 12.7169 13.8037 13.8037 13.8259 13.8259 13.8398 13.8398 13.8948 13.8948 13.9049 13.9049 16.0172 16.0172 16.0969 16.0969 16.3246 16.3246 16.9766 16.9766 16.9976 16.9976 17.1394 17.1394 18.2456 18.2456 18.2475 18.2475 20.0297 20.0297 20.1210 20.1210 20.2315 20.2315 20.2668 20.2668 22.3944 22.3944 22.3970 22.3970 23.4272 23.4272 k = 0.0515 0.0515 0.0515 ( 5383 PWs) bands (ev): -52.6312 -52.6312 -52.5375 -52.5375 -52.5375 -52.5375 -25.3132 -25.3132 -25.3109 -25.3109 -25.0542 -25.0542 -22.4534 -22.4534 -22.1490 -22.1490 -22.1457 -22.1457 -21.8018 -21.8018 -21.7889 -21.7889 -21.7823 -21.7823 4.8547 4.8547 12.7402 12.7402 13.8026 13.8026 13.8340 13.8340 13.8502 13.8502 13.9136 13.9136 13.9259 13.9259 15.9379 15.9379 16.0227 16.0227 16.3025 16.3025 16.9839 16.9839 17.0112 17.0112 17.1497 17.1497 18.2788 18.2788 18.2794 18.2794 19.9954 19.9954 20.1254 20.1254 20.2415 20.2415 20.2831 20.2831 22.3849 22.3849 22.3886 22.3886 23.2919 23.2919 k = 0.0588 0.0588 0.0588 ( 5377 PWs) bands (ev): -52.6306 -52.6306 -52.5378 -52.5378 -52.5378 -52.5378 -25.3129 -25.3129 -25.3099 -25.3099 -25.0555 -25.0555 -22.4516 -22.4516 -22.1496 -22.1496 -22.1453 -22.1453 -21.8027 -21.8027 -21.7905 -21.7905 -21.7823 -21.7823 4.8747 4.8747 12.7671 12.7671 13.8008 13.8008 13.8428 13.8428 13.8604 13.8604 13.9364 13.9364 13.9503 13.9503 15.8533 15.8533 15.9400 15.9400 16.2816 16.2816 16.9918 16.9918 17.0261 17.0261 17.1616 17.1616 18.3086 18.3086 18.3101 18.3101 19.9553 19.9553 20.1289 20.1289 20.2567 20.2567 20.3030 20.3030 22.3735 22.3735 22.3783 22.3783 23.1509 23.1509 k = 0.0662 0.0662 0.0662 ( 5383 PWs) bands (ev): -52.6301 -52.6301 -52.5381 -52.5381 -52.5381 -52.5381 -25.3125 -25.3125 -25.3087 -25.3087 -25.0572 -25.0572 -22.4496 -22.4496 -22.1503 -22.1503 -22.1448 -22.1448 -21.8040 -21.8040 -21.7920 -21.7920 -21.7823 -21.7823 4.8973 4.8973 12.7972 12.7972 13.7980 13.7980 13.8523 13.8523 13.8702 13.8702 13.9629 13.9629 13.9780 13.9780 15.7651 15.7651 15.8517 15.8517 16.2613 16.2613 17.0000 17.0000 17.0423 17.0423 17.1750 17.1750 18.3334 18.3334 18.3381 18.3381 19.9099 19.9099 20.1311 20.1311 20.2775 20.2775 20.3269 20.3269 22.3598 22.3598 22.3659 22.3659 23.0060 23.0060 k = 0.0735 0.0735 0.0735 ( 5383 PWs) bands (ev): -52.6294 -52.6294 -52.5384 -52.5384 -52.5384 -52.5384 -25.3121 -25.3121 -25.3074 -25.3074 -25.0590 -25.0590 -22.4474 -22.4474 -22.1510 -22.1510 -22.1443 -22.1443 -21.8059 -21.8059 -21.7933 -21.7933 -21.7823 -21.7823 4.9225 4.9225 12.8307 12.8307 13.7943 13.7943 13.8619 13.8619 13.8795 13.8795 13.9930 13.9930 14.0089 14.0089 15.6748 15.6748 15.7597 15.7597 16.2410 16.2410 17.0084 17.0084 17.0595 17.0595 17.1900 17.1900 18.3528 18.3528 18.3614 18.3614 19.8597 19.8597 20.1321 20.1321 20.3040 20.3040 20.3549 20.3549 22.3435 22.3435 22.3509 22.3509 22.8587 22.8587 k = 0.0809 0.0809 0.0809 ( 5380 PWs) bands (ev): -52.6287 -52.6287 -52.5387 -52.5387 -52.5387 -52.5387 -25.3116 -25.3116 -25.3060 -25.3060 -25.0609 -25.0609 -22.4450 -22.4450 -22.1518 -22.1518 -22.1438 -22.1438 -21.8083 -21.8083 -21.7942 -21.7942 -21.7822 -21.7822 4.9502 4.9502 12.8673 12.8673 13.7895 13.7895 13.8714 13.8714 13.8878 13.8878 14.0263 14.0263 14.0428 14.0428 15.5837 15.5837 15.6659 15.6659 16.2208 16.2208 17.0169 17.0169 17.0778 17.0778 17.2066 17.2066 18.3658 18.3658 18.3790 18.3790 19.8048 19.8048 20.1320 20.1320 20.3356 20.3356 20.3870 20.3870 22.3242 22.3242 22.3326 22.3326 22.7101 22.7101 k = 0.0882 0.0882 0.0882 ( 5386 PWs) bands (ev): -52.6280 -52.6280 -52.5391 -52.5391 -52.5391 -52.5391 -25.3112 -25.3112 -25.3045 -25.3045 -25.0631 -25.0631 -22.4424 -22.4424 -22.1527 -22.1527 -22.1432 -22.1432 -21.8113 -21.8113 -21.7949 -21.7949 -21.7822 -21.7822 4.9805 4.9805 12.9069 12.9069 13.7835 13.7835 13.8803 13.8803 13.8945 13.8945 14.0628 14.0628 14.0796 14.0796 15.4933 15.4933 15.5718 15.5718 16.2005 16.2005 17.0254 17.0254 17.0970 17.0970 17.2246 17.2246 18.3718 18.3718 18.3904 18.3904 19.7458 19.7458 20.1310 20.1310 20.3718 20.3718 20.4230 20.4230 22.3012 22.3012 22.3102 22.3102 22.5612 22.5612 k = 0.0956 0.0956 0.0956 ( 5380 PWs) bands (ev): -52.6271 -52.6271 -52.5395 -52.5395 -52.5395 -52.5395 -25.3107 -25.3107 -25.3029 -25.3029 -25.0653 -25.0653 -22.4396 -22.4396 -22.1537 -22.1537 -22.1426 -22.1426 -21.8147 -21.8147 -21.7953 -21.7953 -21.7821 -21.7821 5.0133 5.0133 12.9494 12.9494 13.7761 13.7761 13.8878 13.8878 13.8991 13.8991 14.1022 14.1022 14.1190 14.1190 15.4053 15.4053 15.4791 15.4791 16.1803 16.1803 17.0336 17.0336 17.1170 17.1170 17.2441 17.2441 18.3708 18.3708 18.3952 18.3952 19.6829 19.6829 20.1293 20.1293 20.4119 20.4119 20.4625 20.4625 22.2741 22.2741 22.2819 22.2819 22.4139 22.4139 k = 0.1029 0.1029 0.1029 ( 5380 PWs) bands (ev): -52.6263 -52.6263 -52.5399 -52.5399 -52.5399 -52.5399 -25.3101 -25.3101 -25.3011 -25.3011 -25.0678 -25.0678 -22.4366 -22.4366 -22.1547 -22.1547 -22.1420 -22.1420 -21.8185 -21.8185 -21.7955 -21.7955 -21.7820 -21.7820 5.0485 5.0485 12.9945 12.9945 13.7674 13.7674 13.8932 13.8932 13.9005 13.9005 14.1441 14.1441 14.1608 14.1608 15.3212 15.3212 15.3893 15.3893 16.1602 16.1602 17.0417 17.0417 17.1375 17.1375 17.2649 17.2649 18.3627 18.3627 18.3933 18.3933 19.6166 19.6166 20.1270 20.1270 20.4549 20.4549 20.5050 20.5050 22.2333 22.2333 22.2423 22.2423 22.2826 22.2826 k = 0.1103 0.1103 0.1103 ( 5380 PWs) bands (ev): -52.6253 -52.6253 -52.5404 -52.5404 -52.5404 -52.5404 -25.3096 -25.3096 -25.2993 -25.2993 -25.0704 -25.0704 -22.4335 -22.4335 -22.1558 -22.1558 -22.1414 -22.1414 -21.8227 -21.8227 -21.7956 -21.7956 -21.7818 -21.7818 5.0862 5.0862 13.0421 13.0421 13.7571 13.7571 13.8954 13.8954 13.8975 13.8975 14.1884 14.1884 14.2047 14.2047 15.2429 15.2429 15.3043 15.3043 16.1405 16.1405 17.0496 17.0496 17.1585 17.1585 17.2869 17.2869 18.3479 18.3479 18.3849 18.3849 19.5470 19.5470 20.1243 20.1243 20.5001 20.5001 20.5499 20.5499 22.1076 22.1076 22.2054 22.2054 22.2238 22.2238 k = 0.1176 0.1176 0.1176 ( 5380 PWs) bands (ev): -52.6243 -52.6243 -52.5408 -52.5408 -52.5408 -52.5408 -25.3090 -25.3090 -25.2974 -25.2974 -25.0731 -25.0731 -22.4302 -22.4302 -22.1569 -22.1569 -22.1407 -22.1407 -21.8271 -21.8271 -21.7955 -21.7955 -21.7816 -21.7816 5.1263 5.1263 13.0918 13.0918 13.7454 13.7454 13.8888 13.8888 13.8932 13.8932 14.2347 14.2347 14.2504 14.2504 15.1725 15.1725 15.2261 15.2261 16.1212 16.1212 17.0572 17.0572 17.1796 17.1796 17.3098 17.3098 18.3267 18.3267 18.3703 18.3703 19.4746 19.4746 20.1212 20.1212 20.5464 20.5464 20.5962 20.5962 21.9648 21.9648 22.1633 22.1633 22.1783 22.1783 k = 0.1250 0.1250 0.1250 ( 5386 PWs) bands (ev): -52.6233 -52.6233 -52.5414 -52.5414 -52.5413 -52.5413 -25.3084 -25.3084 -25.2953 -25.2953 -25.0761 -25.0761 -22.4268 -22.4268 -22.1581 -22.1581 -22.1400 -22.1400 -21.8318 -21.8318 -21.7954 -21.7954 -21.7814 -21.7814 5.1687 5.1687 13.1431 13.1431 13.7322 13.7322 13.8727 13.8727 13.8849 13.8849 14.2826 14.2826 14.2974 14.2974 15.1121 15.1121 15.1570 15.1570 16.1025 16.1025 17.0647 17.0647 17.2006 17.2006 17.3333 17.3333 18.2998 18.2998 18.3502 18.3502 19.3997 19.3997 20.1177 20.1177 20.5929 20.5929 20.6431 20.6431 21.8228 21.8228 22.1162 22.1162 22.1286 22.1286 k = 0.1324 0.1324 0.1324 ( 5383 PWs) bands (ev): -52.6222 -52.6222 -52.5419 -52.5419 -52.5419 -52.5419 -25.3078 -25.3078 -25.2932 -25.2932 -25.0791 -25.0791 -22.4233 -22.4233 -22.1594 -22.1594 -22.1392 -22.1392 -21.8368 -21.8368 -21.7951 -21.7951 -21.7810 -21.7810 5.2134 5.2134 13.1953 13.1953 13.7179 13.7179 13.8479 13.8479 13.8692 13.8692 14.3316 14.3316 14.3450 14.3450 15.0639 15.0639 15.0994 15.0994 16.0845 16.0845 17.0720 17.0720 17.2212 17.2212 17.3571 17.3571 18.2677 18.2677 18.3250 18.3250 19.3225 19.3225 20.1141 20.1141 20.6388 20.6388 20.6898 20.6898 21.6834 21.6834 22.0646 22.0646 22.0742 22.0742 k = 0.1397 0.1397 0.1397 ( 5380 PWs) bands (ev): -52.6211 -52.6211 -52.5424 -52.5424 -52.5424 -52.5424 -25.3072 -25.3072 -25.2910 -25.2910 -25.0822 -25.0822 -22.4197 -22.4197 -22.1607 -22.1607 -22.1385 -22.1385 -21.8419 -21.8419 -21.7948 -21.7948 -21.7807 -21.7807 5.2603 5.2603 13.2475 13.2475 13.7029 13.7029 13.8132 13.8132 13.8447 13.8447 14.3812 14.3812 14.3925 14.3925 15.0297 15.0297 15.0558 15.0558 16.0672 16.0672 17.0792 17.0792 17.2410 17.2410 17.3810 17.3810 18.2313 18.2313 18.2956 18.2956 19.2434 19.2434 20.1101 20.1101 20.6830 20.6830 20.7353 20.7353 21.5474 21.5474 22.0094 22.0094 22.0156 22.0156 k = 0.1471 0.1471 0.1471 ( 5374 PWs) bands (ev): -52.6199 -52.6199 -52.5430 -52.5430 -52.5430 -52.5430 -25.3065 -25.3065 -25.2887 -25.2887 -25.0855 -25.0855 -22.4159 -22.4159 -22.1621 -22.1621 -22.1377 -22.1377 -21.8472 -21.8472 -21.7943 -21.7943 -21.7802 -21.7802 5.3095 5.3095 13.2980 13.2980 13.6881 13.6881 13.7680 13.7680 13.8106 13.8106 14.4308 14.4308 14.4392 14.4392 15.0108 15.0108 15.0282 15.0282 16.0507 16.0507 17.0864 17.0864 17.2595 17.2595 17.4042 17.4042 18.1913 18.1913 18.2628 18.2628 19.1626 19.1626 20.1060 20.1060 20.7249 20.7249 20.7788 20.7788 21.4154 21.4154 21.9515 21.9515 21.9541 21.9541 k = 0.1544 0.1544 0.1544 ( 5371 PWs) bands (ev): -52.6187 -52.6187 -52.5436 -52.5436 -52.5436 -52.5436 -25.3059 -25.3059 -25.2863 -25.2863 -25.0889 -25.0889 -22.4122 -22.4122 -22.1634 -22.1634 -22.1370 -22.1370 -21.8526 -21.8526 -21.7937 -21.7937 -21.7797 -21.7797 5.3608 5.3608 13.3436 13.3436 13.6749 13.6749 13.7125 13.7125 13.7678 13.7678 14.4798 14.4798 14.4845 14.4845 15.0077 15.0077 15.0178 15.0178 16.0351 16.0351 17.0936 17.0936 17.2761 17.2761 17.4264 17.4264 18.1486 18.1486 18.2273 18.2273 19.0804 19.0804 20.1016 20.1016 20.7637 20.7637 20.8194 20.8194 21.2880 21.2880 21.8907 21.8907 21.8923 21.8923 k = 0.1618 0.1618 0.1618 ( 5371 PWs) bands (ev): -52.6174 -52.6174 -52.5442 -52.5442 -52.5442 -52.5442 -25.3053 -25.3053 -25.2839 -25.2839 -25.0924 -25.0924 -22.4084 -22.4084 -22.1648 -22.1648 -22.1362 -22.1362 -21.8582 -21.8582 -21.7930 -21.7930 -21.7792 -21.7792 5.4143 5.4143 13.3797 13.3797 13.6476 13.6476 13.6607 13.6607 13.7239 13.7239 14.5278 14.5278 14.5278 14.5278 15.0200 15.0200 15.0248 15.0248 16.0202 16.0202 17.1010 17.1010 17.2904 17.2904 17.4466 17.4466 18.1044 18.1044 18.1901 18.1901 18.9971 18.9971 20.0972 20.0972 20.7990 20.7990 20.8564 20.8564 21.1657 21.1657 21.8267 21.8267 21.8329 21.8329 k = 0.1691 0.1691 0.1691 ( 5359 PWs) bands (ev): -52.6162 -52.6162 -52.5448 -52.5448 -52.5448 -52.5448 -25.3047 -25.3047 -25.2814 -25.2814 -25.0959 -25.0959 -22.4045 -22.4045 -22.1662 -22.1662 -22.1355 -22.1355 -21.8639 -21.8639 -21.7923 -21.7923 -21.7785 -21.7785 5.4698 5.4698 13.3997 13.3997 13.5744 13.5744 13.6226 13.6226 13.7087 13.7087 14.5692 14.5692 14.5746 14.5746 15.0468 15.0468 15.0483 15.0483 16.0061 16.0061 17.1086 17.1086 17.3014 17.3014 17.4640 17.4640 18.0598 18.0598 18.1522 18.1522 18.9130 18.9130 20.0925 20.0925 20.8302 20.8302 20.8893 20.8893 21.0491 21.0491 21.7633 21.7633 21.7746 21.7746 k = 0.1765 0.1765 0.1765 ( 5347 PWs) bands (ev): -52.6148 -52.6148 -52.5455 -52.5455 -52.5455 -52.5455 -25.3041 -25.3041 -25.2788 -25.2788 -25.0996 -25.0996 -22.4007 -22.4007 -22.1675 -22.1675 -22.1347 -22.1347 -21.8696 -21.8696 -21.7914 -21.7914 -21.7777 -21.7777 5.5273 5.5273 13.3991 13.3991 13.4944 13.4944 13.5584 13.5584 13.7300 13.7300 14.6091 14.6091 14.6202 14.6202 15.0862 15.0862 15.0865 15.0865 15.9925 15.9925 17.1167 17.1167 17.3086 17.3086 17.4771 17.4771 18.0164 18.0164 18.1147 18.1147 18.8281 18.8281 20.0878 20.0878 20.8565 20.8565 20.9174 20.9174 20.9389 20.9389 21.7016 21.7016 21.7184 21.7184 k = 0.1838 0.1838 0.1838 ( 5347 PWs) bands (ev): -52.6135 -52.6135 -52.5462 -52.5462 -52.5461 -52.5461 -25.3035 -25.3035 -25.2763 -25.2763 -25.1033 -25.1033 -22.3969 -22.3969 -22.1689 -22.1689 -22.1340 -22.1340 -21.8755 -21.8755 -21.7904 -21.7904 -21.7769 -21.7769 5.5867 5.5867 13.3774 13.3774 13.4091 13.4091 13.4870 13.4870 13.7709 13.7709 14.6483 14.6483 14.6651 14.6651 15.1365 15.1365 15.1375 15.1375 15.9795 15.9795 17.1253 17.1253 17.3109 17.3109 17.4842 17.4842 17.9760 17.9760 18.0785 18.0785 18.7429 18.7429 20.0829 20.0829 20.8323 20.8323 20.8812 20.8812 20.9402 20.9402 21.6424 21.6424 21.6654 21.6654 k = 0.1912 0.1912 0.1912 ( 5353 PWs) bands (ev): -52.6121 -52.6121 -52.5468 -52.5468 -52.5468 -52.5468 -25.3030 -25.3030 -25.2737 -25.2737 -25.1071 -25.1071 -22.3932 -22.3932 -22.1702 -22.1702 -22.1334 -22.1334 -21.8814 -21.8814 -21.7893 -21.7893 -21.7760 -21.7760 5.6480 5.6480 13.3197 13.3197 13.3330 13.3330 13.4195 13.4195 13.8228 13.8228 14.6874 14.6874 14.7095 14.7095 15.1968 15.1968 15.1978 15.1978 15.9668 15.9668 17.1346 17.1346 17.3075 17.3075 17.4835 17.4835 17.9408 17.9408 18.0447 18.0447 18.6575 18.6575 20.0779 20.0779 20.7363 20.7363 20.8977 20.8977 20.9576 20.9576 21.5868 21.5868 21.6165 21.6165 k = 0.1985 0.1985 0.1985 ( 5356 PWs) bands (ev): -52.6107 -52.6107 -52.5475 -52.5475 -52.5475 -52.5475 -25.3024 -25.3024 -25.2710 -25.2710 -25.1110 -25.1110 -22.3895 -22.3895 -22.1714 -22.1714 -22.1327 -22.1327 -21.8874 -21.8874 -21.7881 -21.7881 -21.7751 -21.7751 5.7112 5.7112 13.2274 13.2274 13.2644 13.2644 13.3632 13.3632 13.8809 13.8809 14.7270 14.7270 14.7539 14.7539 15.2653 15.2653 15.2661 15.2661 15.9542 15.9542 17.1449 17.1449 17.2977 17.2977 17.4732 17.4732 17.9128 17.9128 18.0141 18.0141 18.5722 18.5722 20.0729 20.0729 20.6468 20.6468 20.9102 20.9102 20.9694 20.9694 21.5353 21.5353 21.5725 21.5725 k = 0.2059 0.2059 0.2059 ( 5365 PWs) bands (ev): -52.6093 -52.6093 -52.5482 -52.5482 -52.5482 -52.5482 -25.3020 -25.3020 -25.2684 -25.2684 -25.1149 -25.1149 -22.3860 -22.3860 -22.1726 -22.1726 -22.1321 -22.1321 -21.8934 -21.8934 -21.7868 -21.7868 -21.7740 -21.7740 5.7761 5.7761 13.1330 13.1330 13.1804 13.1804 13.3130 13.3130 13.9422 13.9422 14.7673 14.7673 14.7986 14.7986 15.3404 15.3404 15.3410 15.3410 15.9414 15.9414 17.1564 17.1564 17.2810 17.2810 17.4524 17.4524 17.8929 17.8929 17.9875 17.9875 18.4871 18.4871 20.0678 20.0678 20.5650 20.5650 20.9182 20.9182 20.9757 20.9757 21.4887 21.4887 21.5339 21.5339 k = 0.2132 0.2132 0.2132 ( 5365 PWs) bands (ev): -52.6078 -52.6078 -52.5489 -52.5489 -52.5489 -52.5489 -25.3016 -25.3016 -25.2657 -25.2657 -25.1187 -25.1187 -22.3826 -22.3826 -22.1737 -22.1737 -22.1315 -22.1315 -21.8993 -21.8993 -21.7853 -21.7853 -21.7728 -21.7728 5.8427 5.8427 13.0374 13.0374 13.0897 13.0897 13.2628 13.2628 14.0048 14.0048 14.8086 14.8086 14.8437 14.8437 15.4210 15.4210 15.4215 15.4215 15.9283 15.9283 17.1690 17.1690 17.2573 17.2573 17.4217 17.4217 17.8810 17.8810 17.9651 17.9651 18.4025 18.4025 20.0626 20.0626 20.4914 20.4914 20.9218 20.9218 20.9770 20.9770 21.4472 21.4472 21.5009 21.5009 k = 0.2206 0.2206 0.2206 ( 5371 PWs) bands (ev): -52.6064 -52.6064 -52.5497 -52.5497 -52.5496 -52.5496 -25.3012 -25.3012 -25.2630 -25.2630 -25.1227 -25.1227 -22.3794 -22.3794 -22.1746 -22.1746 -22.1309 -22.1309 -21.9053 -21.9053 -21.7838 -21.7838 -21.7716 -21.7716 5.9110 5.9110 12.9411 12.9411 12.9959 12.9959 13.2105 13.2105 14.0675 14.0675 14.8508 14.8508 14.8893 14.8893 15.5062 15.5062 15.5068 15.5068 15.9146 15.9146 17.1827 17.1827 17.2268 17.2268 17.3834 17.3834 17.8755 17.8755 17.9467 17.9467 18.3187 18.3187 20.0574 20.0574 20.4262 20.4262 20.9215 20.9215 20.9740 20.9740 21.4111 21.4111 21.4733 21.4733 k = 0.2279 0.2279 0.2279 ( 5365 PWs) bands (ev): -52.6049 -52.6049 -52.5504 -52.5504 -52.5504 -52.5504 -25.3008 -25.3008 -25.2602 -25.2602 -25.1266 -25.1266 -22.3763 -22.3763 -22.1754 -22.1754 -22.1303 -22.1303 -21.9112 -21.9112 -21.7821 -21.7821 -21.7702 -21.7702 5.9808 5.9808 12.8446 12.8446 12.9007 12.9007 13.1556 13.1556 14.1293 14.1293 14.8938 14.8938 14.9355 14.9355 15.5952 15.5952 15.5961 15.5961 15.9002 15.9002 17.1901 17.1901 17.1957 17.1957 17.3417 17.3417 17.8742 17.8742 17.9319 17.9319 18.2360 18.2360 20.0522 20.0522 20.3697 20.3697 20.9180 20.9180 20.9677 20.9677 21.3801 21.3801 21.4506 21.4506 k = 0.2353 0.2353 0.2353 ( 5377 PWs) bands (ev): -52.6034 -52.6034 -52.5511 -52.5511 -52.5511 -52.5511 -25.3006 -25.3006 -25.2575 -25.2575 -25.1305 -25.1305 -22.3735 -22.3735 -22.1761 -22.1761 -22.1299 -22.1299 -21.9172 -21.9172 -21.7803 -21.7803 -21.7688 -21.7688 6.0521 6.0521 12.7484 12.7484 12.8050 12.8050 13.0980 13.0980 14.1894 14.1894 14.9374 14.9374 14.9822 14.9822 15.6873 15.6873 15.6891 15.6891 15.8850 15.8850 17.1483 17.1483 17.2013 17.2013 17.3061 17.3061 17.8748 17.8748 17.9200 17.9200 18.1550 18.1550 20.0470 20.0470 20.3220 20.3220 20.9123 20.9123 20.9595 20.9595 21.3539 21.3539 21.4320 21.4320 k = 0.2426 0.2426 0.2426 ( 5377 PWs) bands (ev): -52.6019 -52.6019 -52.5518 -52.5518 -52.5518 -52.5518 -25.3004 -25.3004 -25.2548 -25.2548 -25.1344 -25.1344 -22.3709 -22.3709 -22.1765 -22.1765 -22.1294 -22.1294 -21.9230 -21.9230 -21.7784 -21.7784 -21.7673 -21.7673 6.1249 6.1249 12.6528 12.6528 12.7094 12.7094 13.0378 13.0378 14.2471 14.2471 14.9816 14.9816 15.0291 15.0291 15.7802 15.7802 15.7852 15.7852 15.8705 15.8705 17.1022 17.1022 17.1823 17.1823 17.2960 17.2960 17.8749 17.8749 17.9101 17.9101 18.0768 18.0768 20.0417 20.0417 20.2831 20.2831 20.9053 20.9053 20.9505 20.9505 21.3319 21.3319 21.4168 21.4168 k = 0.2500 0.2500 0.2500 ( 5365 PWs) bands (ev): -52.6004 -52.6004 -52.5526 -52.5526 -52.5526 -52.5526 -25.3002 -25.3002 -25.2521 -25.2521 -25.1382 -25.1382 -22.3685 -22.3685 -22.1768 -22.1768 -22.1289 -22.1289 -21.9288 -21.9288 -21.7764 -21.7764 -21.7656 -21.7656 6.1990 6.1990 12.5581 12.5581 12.6144 12.6144 12.9752 12.9752 14.3017 14.3017 15.0260 15.0260 15.0762 15.0762 15.8373 15.8373 15.8839 15.8839 15.8929 15.8929 17.0531 17.0531 17.1389 17.1389 17.3132 17.3132 17.8702 17.8702 17.9015 17.9015 18.0045 18.0045 20.0364 20.0364 20.2531 20.2531 20.8981 20.8981 20.9419 20.9419 21.3133 21.3133 21.4040 21.4040 k = 0.2574 0.2574 0.2574 ( 5377 PWs) bands (ev): -52.5990 -52.5990 -52.5533 -52.5533 -52.5533 -52.5533 -25.3002 -25.3002 -25.2494 -25.2494 -25.1420 -25.1420 -22.3664 -22.3664 -22.1768 -22.1768 -22.1285 -22.1285 -21.9345 -21.9345 -21.7744 -21.7744 -21.7639 -21.7639 6.2743 6.2743 12.4646 12.4646 12.5203 12.5203 12.9104 12.9104 14.3527 14.3527 15.0705 15.0705 15.1234 15.1234 15.8235 15.8235 15.9848 15.9848 15.9866 15.9866 17.0021 17.0021 17.0866 17.0866 17.3440 17.3440 17.8496 17.8496 17.8935 17.8935 17.9488 17.9488 20.0311 20.0311 20.2318 20.2318 20.8916 20.8916 20.9345 20.9345 21.2975 21.2975 21.3931 21.3931 k = 0.2647 0.2647 0.2647 ( 5377 PWs) bands (ev): -52.5975 -52.5975 -52.5540 -52.5540 -52.5540 -52.5540 -25.3002 -25.3002 -25.2467 -25.2467 -25.1458 -25.1458 -22.3646 -22.3646 -22.1767 -22.1767 -22.1282 -22.1282 -21.9401 -21.9401 -21.7722 -21.7722 -21.7622 -21.7622 6.3509 6.3509 12.3724 12.3724 12.4274 12.4274 12.8434 12.8434 14.3995 14.3995 15.1146 15.1146 15.1702 15.1702 15.8027 15.8027 16.0873 16.0873 16.0874 16.0874 16.9505 16.9505 17.0322 17.0322 17.3830 17.3830 17.7998 17.7998 17.8855 17.8855 17.9225 17.9225 20.0257 20.0257 20.2191 20.2191 20.8867 20.8867 20.9292 20.9292 21.2839 21.2839 21.3835 21.3835 k = 0.2721 0.2721 0.2721 ( 5365 PWs) bands (ev): -52.5960 -52.5960 -52.5548 -52.5548 -52.5548 -52.5548 -25.3003 -25.3003 -25.2441 -25.2441 -25.1494 -25.1494 -22.3631 -22.3631 -22.1762 -22.1762 -22.1278 -22.1278 -21.9456 -21.9456 -21.7699 -21.7699 -21.7603 -21.7603 6.4285 6.4285 12.2818 12.2818 12.3359 12.3359 12.7745 12.7745 14.4418 14.4418 15.1583 15.1583 15.2166 15.2166 15.7797 15.7797 16.1894 16.1894 16.1905 16.1905 16.8997 16.8997 16.9788 16.9788 17.4288 17.4288 17.7336 17.7336 17.8772 17.8772 17.9130 17.9130 20.0203 20.0203 20.2145 20.2145 20.8839 20.8839 20.9263 20.9263 21.2719 21.2719 21.3748 21.3748 k = 0.2794 0.2794 0.2794 ( 5370 PWs) bands (ev): -52.5945 -52.5945 -52.5555 -52.5555 -52.5555 -52.5555 -25.3005 -25.3005 -25.2415 -25.2415 -25.1530 -25.1530 -22.3620 -22.3620 -22.1756 -22.1756 -22.1276 -22.1276 -21.9510 -21.9510 -21.7675 -21.7675 -21.7584 -21.7584 6.5072 6.5072 12.1929 12.1929 12.2461 12.2461 12.7039 12.7039 14.4790 14.4790 15.2010 15.2010 15.2622 15.2622 15.7553 15.7553 16.2908 16.2908 16.2925 16.2925 16.8521 16.8521 16.9289 16.9289 17.4803 17.4803 17.6642 17.6642 17.8682 17.8682 17.9077 17.9077 20.0150 20.0150 20.2178 20.2178 20.8835 20.8835 20.9262 20.9262 21.2612 21.2612 21.3666 21.3666 k = 0.2868 0.2868 0.2868 ( 5370 PWs) bands (ev): -52.5931 -52.5931 -52.5562 -52.5562 -52.5562 -52.5562 -25.3008 -25.3008 -25.2389 -25.2389 -25.1564 -25.1564 -22.3611 -22.3611 -22.1747 -22.1747 -22.1274 -22.1274 -21.9563 -21.9563 -21.7651 -21.7651 -21.7564 -21.7564 6.5869 6.5869 12.1058 12.1058 12.1581 12.1581 12.6316 12.6316 14.5108 14.5108 15.2425 15.2425 15.3068 15.3068 15.7297 15.7297 16.3885 16.3885 16.3896 16.3896 16.8118 16.8118 16.8860 16.8860 17.5316 17.5316 17.6011 17.6011 17.8585 17.8585 17.9031 17.9031 20.0097 20.0097 20.2285 20.2285 20.8858 20.8858 20.9289 20.9289 21.2516 21.2516 21.3588 21.3588 k = 0.2941 0.2941 0.2941 ( 5388 PWs) bands (ev): -52.5917 -52.5917 -52.5569 -52.5569 -52.5569 -52.5569 -25.3012 -25.3012 -25.2364 -25.2364 -25.1598 -25.1598 -22.3606 -22.3606 -22.1737 -22.1737 -22.1272 -22.1272 -21.9615 -21.9615 -21.7627 -21.7627 -21.7544 -21.7544 6.6674 6.6674 12.0208 12.0208 12.0720 12.0720 12.5578 12.5578 14.5372 14.5372 15.2824 15.2824 15.3498 15.3498 15.7034 15.7034 16.4721 16.4721 16.4757 16.4757 16.7892 16.7892 16.8571 16.8571 17.5116 17.5116 17.6161 17.6161 17.8479 17.8479 17.8985 17.8985 20.0045 20.0045 20.2461 20.2461 20.8907 20.8907 20.9343 20.9343 21.2427 21.2427 21.3511 21.3511 k = 0.3015 0.3015 0.3015 ( 5388 PWs) bands (ev): -52.5903 -52.5903 -52.5576 -52.5576 -52.5576 -52.5576 -25.3017 -25.3017 -25.2340 -25.2340 -25.1630 -25.1630 -22.3603 -22.3603 -22.1724 -22.1724 -22.1271 -22.1271 -21.9665 -21.9665 -21.7601 -21.7601 -21.7522 -21.7522 6.7486 6.7486 11.9379 11.9379 11.9880 11.9880 12.4827 12.4827 14.5579 14.5579 15.3203 15.3203 15.3911 15.3911 15.6769 15.6769 16.5200 16.5200 16.5385 16.5385 16.8045 16.8045 16.8567 16.8567 17.4470 17.4470 17.6819 17.6819 17.8365 17.8365 17.8946 17.8946 19.9995 19.9995 20.2701 20.2701 20.8980 20.8980 20.9422 20.9422 21.2345 21.2345 21.3437 21.3437 k = 0.3088 0.3088 0.3088 ( 5388 PWs) bands (ev): -52.5889 -52.5889 -52.5583 -52.5583 -52.5583 -52.5583 -25.3023 -25.3023 -25.2315 -25.2315 -25.1660 -25.1660 -22.3603 -22.3603 -22.1709 -22.1709 -22.1270 -22.1270 -21.9714 -21.9714 -21.7575 -21.7575 -21.7501 -21.7501 6.8305 6.8305 11.8572 11.8572 11.9063 11.9063 12.4064 12.4064 14.5729 14.5729 15.3556 15.3556 15.4301 15.4301 15.6504 15.6504 16.5230 16.5230 16.5623 16.5623 16.8685 16.8685 16.8995 16.8995 17.3816 17.3816 17.7511 17.7511 17.8245 17.8245 17.8955 17.8955 19.9945 19.9945 20.3000 20.3000 20.9074 20.9074 20.9523 20.9523 21.2270 21.2270 21.3364 21.3364 k = 0.3162 0.3162 0.3162 ( 5388 PWs) bands (ev): -52.5875 -52.5875 -52.5590 -52.5590 -52.5590 -52.5590 -25.3030 -25.3030 -25.2292 -25.2292 -25.1689 -25.1689 -22.3606 -22.3606 -22.1692 -22.1692 -22.1269 -22.1269 -21.9762 -21.9762 -21.7549 -21.7549 -21.7479 -21.7479 6.9129 6.9129 11.7788 11.7788 11.8268 11.8268 12.3290 12.3290 14.5823 14.5823 15.3879 15.3879 15.4662 15.4662 15.6245 15.6245 16.4997 16.4997 16.5538 16.5538 16.9630 16.9630 16.9783 16.9783 17.3186 17.3186 17.8055 17.8055 17.8120 17.8120 17.9167 17.9167 19.9897 19.9897 20.3351 20.3351 20.9184 20.9184 20.9641 20.9641 21.2202 21.2202 21.3292 21.3292 k = 0.3235 0.3235 0.3235 ( 5397 PWs) bands (ev): -52.5862 -52.5862 -52.5597 -52.5597 -52.5597 -52.5597 -25.3039 -25.3039 -25.2269 -25.2269 -25.1717 -25.1717 -22.3611 -22.3611 -22.1673 -22.1673 -22.1268 -22.1268 -21.9807 -21.9807 -21.7523 -21.7523 -21.7457 -21.7457 6.9958 6.9958 11.7029 11.7029 11.7498 11.7498 12.2508 12.2508 14.5864 14.5864 15.4164 15.4164 15.4991 15.4991 15.5996 15.5996 16.4673 16.4673 16.5307 16.5307 17.0713 17.0713 17.0728 17.0728 17.2617 17.2617 17.7993 17.7993 17.8236 17.8236 17.9792 17.9792 19.9850 19.9850 20.3751 20.3751 20.9304 20.9304 20.9770 20.9770 21.2143 21.2143 21.3224 21.3224 k = 0.3309 0.3309 0.3309 ( 5400 PWs) bands (ev): -52.5849 -52.5849 -52.5603 -52.5603 -52.5603 -52.5603 -25.3048 -25.3048 -25.2247 -25.2247 -25.1743 -25.1743 -22.3618 -22.3618 -22.1654 -22.1654 -22.1268 -22.1268 -21.9852 -21.9852 -21.7496 -21.7496 -21.7435 -21.7435 7.0790 7.0790 11.6295 11.6295 11.6753 11.6753 12.1719 12.1719 14.5853 14.5853 15.4406 15.4406 15.5280 15.5280 15.5763 15.5763 16.4334 16.4334 16.5034 16.5034 17.1426 17.1426 17.1860 17.1860 17.2413 17.2413 17.7867 17.7867 17.8212 17.8212 18.0668 18.0668 19.9804 19.9804 20.4192 20.4192 20.9425 20.9425 20.9903 20.9903 21.2096 21.2096 21.3160 21.3160 k = 0.3382 0.3382 0.3382 ( 5394 PWs) bands (ev): -52.5836 -52.5836 -52.5610 -52.5610 -52.5610 -52.5610 -25.3058 -25.3058 -25.2225 -25.2225 -25.1767 -25.1767 -22.3627 -22.3627 -22.1633 -22.1633 -22.1268 -22.1268 -21.9894 -21.9894 -21.7469 -21.7469 -21.7412 -21.7412 7.1624 7.1624 11.5586 11.5586 11.6035 11.6035 12.0924 12.0924 14.5796 14.5796 15.4594 15.4594 15.5523 15.5523 15.5554 15.5554 16.4015 16.4015 16.4767 16.4767 17.1151 17.1151 17.3040 17.3040 17.3253 17.3253 17.7748 17.7748 17.8127 17.8127 18.1650 18.1650 19.9760 19.9760 20.4669 20.4669 20.9539 20.9539 21.0032 21.0032 21.2063 21.2063 21.3104 21.3104 k = 0.3456 0.3456 0.3456 ( 5406 PWs) bands (ev): -52.5824 -52.5824 -52.5616 -52.5616 -52.5616 -52.5616 -25.3068 -25.3068 -25.2204 -25.2204 -25.1790 -25.1790 -22.3638 -22.3638 -22.1611 -22.1611 -22.1269 -22.1269 -21.9935 -21.9935 -21.7443 -21.7443 -21.7390 -21.7390 7.2458 7.2458 11.4905 11.4905 11.5342 11.5342 12.0125 12.0125 14.5695 14.5695 15.4710 15.4710 15.5383 15.5383 15.5716 15.5716 16.3733 16.3733 16.4529 16.4529 17.0638 17.0638 17.4231 17.4231 17.4381 17.4381 17.7645 17.7645 17.8026 17.8026 18.2694 18.2694 19.9717 19.9717 20.5177 20.5177 20.9634 20.9634 21.0149 21.0149 21.2049 21.2049 21.3057 21.3057 k = 0.3529 0.3529 0.3529 ( 5406 PWs) bands (ev): -52.5812 -52.5812 -52.5622 -52.5622 -52.5622 -52.5622 -25.3080 -25.3080 -25.2184 -25.2184 -25.1811 -25.1811 -22.3649 -22.3649 -22.1589 -22.1589 -22.1270 -22.1270 -21.9974 -21.9974 -21.7417 -21.7417 -21.7368 -21.7368 7.3292 7.3292 11.4250 11.4250 11.4678 11.4678 11.9325 11.9325 14.5558 14.5558 15.4730 15.4730 15.5274 15.5274 15.5852 15.5852 16.3497 16.3497 16.4329 16.4329 17.0113 17.0113 17.5398 17.5398 17.5549 17.5549 17.7589 17.7589 17.7933 17.7933 18.3784 18.3784 19.9675 19.9675 20.5708 20.5708 20.9702 20.9702 21.0243 21.0243 21.2059 21.2059 21.3023 21.3023 k = 0.3603 0.3603 0.3603 ( 5400 PWs) bands (ev): -52.5800 -52.5800 -52.5628 -52.5628 -52.5628 -52.5628 -25.3092 -25.3092 -25.2164 -25.2164 -25.1830 -25.1830 -22.3662 -22.3662 -22.1565 -22.1565 -22.1270 -22.1270 -22.0011 -22.0011 -21.7391 -21.7391 -21.7346 -21.7346 7.4122 7.4122 11.3624 11.3624 11.4042 11.4042 11.8524 11.8524 14.5388 14.5388 15.4655 15.4655 15.5226 15.5226 15.5931 15.5931 16.3315 16.3315 16.4174 16.4174 16.9603 16.9603 17.6402 17.6402 17.6662 17.6662 17.7717 17.7717 17.7919 17.7919 18.4908 18.4908 19.9636 19.9636 20.6259 20.6259 20.9731 20.9731 21.0303 21.0303 21.2094 21.2094 21.3007 21.3007 k = 0.3676 0.3676 0.3676 ( 5388 PWs) bands (ev): -52.5789 -52.5789 -52.5633 -52.5633 -52.5633 -52.5633 -25.3104 -25.3104 -25.2145 -25.2145 -25.1848 -25.1848 -22.3676 -22.3676 -22.1542 -22.1542 -22.1271 -22.1271 -22.0047 -22.0047 -21.7365 -21.7365 -21.7324 -21.7324 7.4949 7.4949 11.3026 11.3026 11.3434 11.3434 11.7725 11.7725 14.5193 14.5193 15.4527 15.4527 15.5196 15.5196 15.5951 15.5951 16.3187 16.3187 16.4063 16.4063 16.9114 16.9114 17.6843 17.6843 17.7296 17.7296 17.8399 17.8399 17.8426 17.8426 18.6059 18.6059 19.9597 19.9597 20.6821 20.6821 20.9716 20.9716 21.0321 21.0321 21.2155 21.2155 21.3012 21.3012 k = 0.3750 0.3750 0.3750 ( 5382 PWs) bands (ev): -52.5778 -52.5778 -52.5639 -52.5639 -52.5639 -52.5639 -25.3117 -25.3117 -25.2128 -25.2128 -25.1865 -25.1865 -22.3690 -22.3690 -22.1519 -22.1519 -22.1272 -22.1272 -22.0080 -22.0080 -21.7340 -21.7340 -21.7303 -21.7303 7.5768 7.5768 11.2458 11.2458 11.2856 11.2856 11.6930 11.6930 14.4977 14.4977 15.4384 15.4384 15.5153 15.5153 15.5918 15.5918 16.3110 16.3110 16.3994 16.3994 16.8650 16.8650 17.6882 17.6882 17.7329 17.7329 17.9496 17.9496 17.9554 17.9554 18.7228 18.7228 19.9561 19.9561 20.7390 20.7390 20.9652 20.9652 21.0287 21.0287 21.2238 21.2238 21.3037 21.3037 k = 0.3824 0.3824 0.3824 ( 5388 PWs) bands (ev): -52.5768 -52.5768 -52.5644 -52.5644 -52.5644 -52.5644 -25.3130 -25.3130 -25.2111 -25.2111 -25.1880 -25.1880 -22.3705 -22.3705 -22.1497 -22.1497 -22.1273 -22.1273 -22.0112 -22.0112 -21.7316 -21.7316 -21.7283 -21.7283 7.6579 7.6579 11.1919 11.1919 11.2308 11.2308 11.6142 11.6142 14.4746 14.4746 15.4238 15.4238 15.5085 15.5085 15.5837 15.5837 16.3080 16.3080 16.3961 16.3961 16.8213 16.8213 17.6834 17.6834 17.7248 17.7248 18.0720 18.0720 18.0786 18.0786 18.8407 18.8407 19.9526 19.9526 20.7960 20.7960 20.9539 20.9539 21.0198 21.0198 21.2338 21.2338 21.3082 21.3082 k = 0.3897 0.3897 0.3897 ( 5394 PWs) bands (ev): -52.5759 -52.5759 -52.5649 -52.5649 -52.5649 -52.5649 -25.3144 -25.3144 -25.2095 -25.2095 -25.1894 -25.1894 -22.3720 -22.3720 -22.1474 -22.1474 -22.1275 -22.1275 -22.0142 -22.0142 -21.7292 -21.7292 -21.7263 -21.7263 7.7379 7.7379 11.1410 11.1410 11.1790 11.1790 11.5363 11.5363 14.4507 14.4507 15.4096 15.4096 15.4995 15.4995 15.5716 15.5716 16.3087 16.3087 16.3957 16.3957 16.7804 16.7804 17.6770 17.6770 17.7149 17.7149 18.1973 18.1973 18.2049 18.2049 18.9590 18.9590 19.9493 19.9493 20.8522 20.8522 20.9379 20.9379 21.0051 21.0051 21.2447 21.2447 21.3142 21.3142 k = 0.3971 0.3971 0.3971 ( 5394 PWs) bands (ev): -52.5750 -52.5750 -52.5653 -52.5653 -52.5653 -52.5653 -25.3157 -25.3157 -25.2080 -25.2080 -25.1906 -25.1906 -22.3735 -22.3735 -22.1453 -22.1453 -22.1276 -22.1276 -22.0170 -22.0170 -21.7270 -21.7270 -21.7244 -21.7244 7.8165 7.8165 11.0932 11.0932 11.1303 11.1303 11.4597 11.4597 14.4263 14.4263 15.3959 15.3959 15.4885 15.4885 15.5566 15.5566 16.3124 16.3124 16.3975 16.3975 16.7426 16.7426 17.6706 17.6706 17.7051 17.7051 18.3237 18.3237 18.3325 18.3325 19.0768 19.0768 19.9462 19.9462 20.9051 20.9051 20.9191 20.9191 20.9844 20.9844 21.2558 21.2558 21.3212 21.3212 k = 0.4044 0.4044 0.4044 ( 5400 PWs) bands (ev): -52.5741 -52.5741 -52.5658 -52.5658 -52.5658 -52.5658 -25.3170 -25.3170 -25.2066 -25.2066 -25.1917 -25.1917 -22.3749 -22.3749 -22.1432 -22.1432 -22.1278 -22.1278 -22.0197 -22.0197 -21.7248 -21.7248 -21.7226 -21.7226 7.8934 7.8934 11.0485 11.0485 11.0847 11.0847 11.3846 11.3846 14.4019 14.4019 15.3826 15.3826 15.4764 15.4764 15.5396 15.5396 16.3182 16.3182 16.4007 16.4007 16.7079 16.7079 17.6648 17.6648 17.6958 17.6958 18.4505 18.4505 18.4608 18.4608 19.1933 19.1933 19.9433 19.9433 20.8899 20.8899 20.9577 20.9577 20.9617 20.9617 21.2667 21.2667 21.3285 21.3285 k = 0.4118 0.4118 0.4118 ( 5415 PWs) bands (ev): -52.5733 -52.5733 -52.5662 -52.5662 -52.5662 -52.5662 -25.3183 -25.3183 -25.2054 -25.2054 -25.1927 -25.1927 -22.3764 -22.3764 -22.1413 -22.1413 -22.1279 -22.1279 -22.0221 -22.0221 -21.7228 -21.7228 -21.7208 -21.7208 7.9682 7.9682 11.0070 11.0070 11.0423 11.0423 11.3115 11.3115 14.3780 14.3780 15.3697 15.3697 15.4637 15.4637 15.5213 15.5213 16.3253 16.3253 16.4045 16.4045 16.6766 16.6766 17.6598 17.6598 17.6872 17.6872 18.5774 18.5774 18.5891 18.5891 19.3076 19.3076 19.9406 19.9406 20.8590 20.8590 20.9251 20.9251 21.0125 21.0125 21.2770 21.2770 21.3357 21.3357 k = 0.4191 0.4191 0.4191 ( 5409 PWs) bands (ev): -52.5726 -52.5726 -52.5665 -52.5665 -52.5665 -52.5665 -25.3195 -25.3195 -25.2041 -25.2041 -25.1936 -25.1936 -22.3777 -22.3777 -22.1395 -22.1395 -22.1281 -22.1281 -22.0243 -22.0243 -21.7209 -21.7209 -21.7192 -21.7192 8.0405 8.0405 10.9686 10.9686 11.0031 11.0031 11.2408 11.2408 14.3548 14.3548 15.3573 15.3573 15.4510 15.4510 15.5026 15.5026 16.3332 16.3332 16.4081 16.4081 16.6490 16.6490 17.6558 17.6558 17.6795 17.6795 18.7038 18.7038 18.7173 18.7173 19.4189 19.4189 19.9381 19.9381 20.8226 20.8226 20.8863 20.8863 21.0604 21.0604 21.2865 21.2865 21.3424 21.3424 k = 0.4265 0.4265 0.4265 ( 5409 PWs) bands (ev): -52.5719 -52.5719 -52.5669 -52.5669 -52.5669 -52.5669 -25.3207 -25.3207 -25.2030 -25.2030 -25.1943 -25.1943 -22.3790 -22.3790 -22.1377 -22.1377 -22.1282 -22.1282 -22.0264 -22.0264 -21.7191 -21.7191 -21.7177 -21.7177 8.1098 8.1098 10.9335 10.9335 10.9670 10.9670 11.1731 11.1731 14.3327 14.3327 15.3452 15.3452 15.4388 15.4388 15.4840 15.4840 16.3412 16.3412 16.4108 16.4108 16.6252 16.6252 17.6525 17.6525 17.6728 17.6728 18.8297 18.8297 18.8450 18.8450 19.5261 19.5261 19.9359 19.9359 20.7806 20.7806 20.8413 20.8413 21.1046 21.1046 21.2953 21.2953 21.3484 21.3484 k = 0.4338 0.4338 0.4338 ( 5409 PWs) bands (ev): -52.5713 -52.5713 -52.5672 -52.5672 -52.5672 -52.5672 -25.3218 -25.3218 -25.2020 -25.2020 -25.1950 -25.1950 -22.3802 -22.3802 -22.1361 -22.1361 -22.1283 -22.1283 -22.0282 -22.0282 -21.7175 -21.7175 -21.7163 -21.7163 8.1757 8.1757 10.9016 10.9016 10.9340 10.9340 11.1088 11.1088 14.3120 14.3120 15.3336 15.3336 15.4273 15.4273 15.4660 15.4660 16.3491 16.3491 16.4121 16.4121 16.6055 16.6055 17.6501 17.6501 17.6670 17.6670 18.9546 18.9546 18.9720 18.9720 19.6282 19.6282 19.9339 19.9339 20.7328 20.7328 20.7899 20.7899 21.1445 21.1445 21.3035 21.3035 21.3536 21.3536 k = 0.4412 0.4412 0.4412 ( 5403 PWs) bands (ev): -52.5707 -52.5707 -52.5675 -52.5675 -52.5675 -52.5675 -25.3228 -25.3228 -25.2011 -25.2011 -25.1956 -25.1956 -22.3813 -22.3813 -22.1346 -22.1346 -22.1284 -22.1284 -22.0299 -22.0299 -21.7159 -21.7159 -21.7150 -21.7150 8.2375 8.2375 10.8730 10.8730 10.9042 10.9042 11.0487 11.0487 14.2930 14.2930 15.3225 15.3225 15.4170 15.4170 15.4490 15.4490 16.3565 16.3565 16.4117 16.4117 16.5899 16.5899 17.6484 17.6484 17.6621 17.6621 19.0782 19.0782 19.0979 19.0979 19.7242 19.7242 19.9323 19.9323 20.6790 20.6790 20.7322 20.7322 21.1794 21.1794 21.3116 21.3116 21.3579 21.3579 k = 0.4485 0.4485 0.4485 ( 5415 PWs) bands (ev): -52.5702 -52.5702 -52.5677 -52.5677 -52.5677 -52.5677 -25.3238 -25.3238 -25.2003 -25.2003 -25.1961 -25.1961 -22.3823 -22.3823 -22.1334 -22.1334 -22.1286 -22.1286 -22.0314 -22.0314 -21.7146 -21.7146 -21.7139 -21.7139 8.2946 8.2946 10.8477 10.8477 10.8773 10.8773 10.9936 10.9936 14.2757 14.2757 15.3121 15.3121 15.4079 15.4079 15.4334 15.4334 16.3633 16.3633 16.4095 16.4095 16.5782 16.5782 17.6473 17.6473 17.6580 17.6580 19.2001 19.2001 19.2225 19.2225 19.8127 19.8127 19.9311 19.9311 20.6193 20.6193 20.6681 20.6681 21.2086 21.2086 21.3199 21.3199 21.3613 21.3613 k = 0.4559 0.4559 0.4559 ( 5421 PWs) bands (ev): -52.5698 -52.5698 -52.5680 -52.5680 -52.5680 -52.5680 -25.3246 -25.3246 -25.1996 -25.1996 -25.1966 -25.1966 -22.3832 -22.3832 -22.1322 -22.1322 -22.1287 -22.1287 -22.0326 -22.0326 -21.7135 -21.7135 -21.7129 -21.7129 8.3462 8.3462 10.8257 10.8257 10.8532 10.8532 10.9443 10.9443 14.2604 14.2604 15.3026 15.3026 15.4000 15.4000 15.4195 15.4195 16.3692 16.3692 16.4059 16.4059 16.5700 16.5700 17.6467 17.6467 17.6547 17.6547 19.3198 19.3198 19.3453 19.3453 19.8915 19.8915 19.9314 19.9314 20.5537 20.5537 20.5978 20.5978 21.2315 21.2315 21.3290 21.3290 21.3641 21.3641 k = 0.4632 0.4632 0.4632 ( 5433 PWs) bands (ev): -52.5694 -52.5694 -52.5681 -52.5681 -52.5681 -52.5681 -25.3253 -25.3253 -25.1991 -25.1991 -25.1969 -25.1969 -22.3839 -22.3839 -22.1313 -22.1313 -22.1288 -22.1288 -22.0337 -22.0337 -21.7125 -21.7125 -21.7121 -21.7121 8.3917 8.3917 10.8071 10.8071 10.8315 10.8315 10.9022 10.9022 14.2472 14.2472 15.2942 15.2942 15.3935 15.3935 15.4074 15.4074 16.3744 16.3744 16.4014 16.4014 16.5646 16.5646 17.6465 17.6465 17.6521 17.6521 19.4368 19.4368 19.4660 19.4660 19.9262 19.9262 19.9666 19.9666 20.4825 20.4825 20.5217 20.5217 21.2484 21.2484 21.3387 21.3387 21.3662 21.3662 k = 0.4706 0.4706 0.4706 ( 5424 PWs) bands (ev): -52.5691 -52.5691 -52.5683 -52.5683 -52.5683 -52.5683 -25.3259 -25.3259 -25.1986 -25.1986 -25.1972 -25.1972 -22.3845 -22.3845 -22.1304 -22.1304 -22.1289 -22.1289 -22.0346 -22.0346 -21.7116 -21.7116 -21.7114 -21.7114 8.4303 8.4303 10.7919 10.7919 10.8117 10.8117 10.8685 10.8685 14.2363 14.2363 15.2871 15.2871 15.3881 15.3881 15.3973 15.3973 16.3786 16.3786 16.3967 16.3967 16.5613 16.5613 17.6464 17.6464 17.6501 17.6501 19.5500 19.5500 19.5841 19.5841 19.9273 19.9273 20.0251 20.0251 20.4064 20.4064 20.4401 20.4401 21.2599 21.2599 21.3485 21.3485 21.3677 21.3677 k = 0.4779 0.4779 0.4779 ( 5409 PWs) bands (ev): -52.5689 -52.5689 -52.5684 -52.5684 -52.5684 -52.5684 -25.3263 -25.3263 -25.1982 -25.1982 -25.1974 -25.1974 -22.3850 -22.3850 -22.1298 -22.1298 -22.1289 -22.1289 -22.0352 -22.0352 -21.7109 -21.7109 -21.7108 -21.7108 8.4612 8.4612 10.7800 10.7800 10.7936 10.7936 10.8439 10.8439 14.2277 14.2277 15.2813 15.2813 15.3841 15.3841 15.3893 15.3893 16.3818 16.3818 16.3924 16.3924 16.5594 16.5594 17.6465 17.6465 17.6486 17.6486 19.6576 19.6576 19.6985 19.6985 19.9285 19.9285 20.0728 20.0728 20.3268 20.3268 20.3540 20.3540 21.2673 21.2673 21.3574 21.3574 21.3688 21.3688 k = 0.4853 0.4853 0.4853 ( 5400 PWs) bands (ev): -52.5687 -52.5687 -52.5685 -52.5685 -52.5685 -52.5685 -25.3266 -25.3266 -25.1979 -25.1979 -25.1975 -25.1975 -22.3853 -22.3853 -22.1293 -22.1293 -22.1289 -22.1289 -22.0357 -22.0357 -21.7105 -21.7105 -21.7104 -21.7104 8.4838 8.4838 10.7715 10.7715 10.7784 10.7784 10.8281 10.8281 14.2215 14.2215 15.2772 15.2772 15.3812 15.3812 15.3835 15.3835 16.3842 16.3842 16.3890 16.3890 16.5584 16.5584 17.6467 17.6467 17.6476 17.6476 19.7550 19.7550 19.8073 19.8073 19.9322 19.9322 20.1077 20.1077 20.2463 20.2463 20.2654 20.2654 21.2718 21.2718 21.3643 21.3643 21.3695 21.3695 k = 0.4926 0.4926 0.4926 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3269 -25.3269 -25.1977 -25.1977 -25.1976 -25.1976 -22.3855 -22.3855 -22.1290 -22.1290 -22.1289 -22.1289 -22.0360 -22.0360 -21.7102 -21.7102 -21.7102 -21.7102 8.4976 8.4976 10.7664 10.7664 10.7682 10.7682 10.8194 10.8194 14.2178 14.2178 15.2746 15.2746 15.3795 15.3795 15.3801 15.3801 16.3856 16.3856 16.3868 16.3868 16.5579 16.5579 17.6468 17.6468 17.6470 17.6470 19.8295 19.8295 19.9042 19.9042 19.9429 19.9429 20.1288 20.1288 20.1738 20.1738 20.1806 20.1806 21.2742 21.2742 21.3686 21.3686 21.3699 21.3699 k = 0.5000 0.5000 0.5000 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3269 -25.3269 -25.1976 -25.1976 -25.1976 -25.1976 -22.3856 -22.3856 -22.1289 -22.1289 -22.1289 -22.1289 -22.0361 -22.0361 -21.7101 -21.7101 -21.7101 -21.7101 8.5023 8.5023 10.7647 10.7647 10.7647 10.7647 10.8166 10.8166 14.2165 14.2165 15.2738 15.2738 15.3789 15.3789 15.3789 15.3789 16.3861 16.3861 16.3861 16.3861 16.5578 16.5578 17.6468 17.6468 17.6468 17.6468 19.8569 19.8569 19.9554 19.9554 19.9554 19.9554 20.1335 20.1335 20.1335 20.1335 20.1405 20.1405 21.2750 21.2750 21.3701 21.3701 21.3701 21.3701 k = 0.5000 0.5000 0.5000 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3269 -25.3269 -25.1976 -25.1976 -25.1976 -25.1976 -22.3856 -22.3856 -22.1289 -22.1289 -22.1289 -22.1289 -22.0361 -22.0361 -21.7101 -21.7101 -21.7101 -21.7101 8.5023 8.5023 10.7647 10.7647 10.7647 10.7647 10.8166 10.8166 14.2165 14.2165 15.2738 15.2738 15.3789 15.3789 15.3789 15.3789 16.3861 16.3861 16.3861 16.3861 16.5578 16.5578 17.6468 17.6468 17.6468 17.6468 19.8569 19.8569 19.9554 19.9554 19.9554 19.9554 20.1335 20.1335 20.1335 20.1335 20.1405 20.1405 21.2750 21.2750 21.3701 21.3701 21.3701 21.3701 k = 0.4909 0.5000 0.4909 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5685 -52.5685 -25.3268 -25.3268 -25.1977 -25.1977 -25.1976 -25.1976 -22.3855 -22.3855 -22.1290 -22.1290 -22.1289 -22.1289 -22.0360 -22.0360 -21.7102 -21.7102 -21.7101 -21.7101 8.4975 8.4975 10.7662 10.7662 10.7685 10.7685 10.8195 10.8195 14.2178 14.2178 15.2746 15.2746 15.3795 15.3795 15.3801 15.3801 16.3856 16.3856 16.3868 16.3868 16.5579 16.5579 17.6463 17.6463 17.6474 17.6474 19.8291 19.8291 19.9033 19.9033 19.9427 19.9427 20.1286 20.1286 20.1741 20.1741 20.1817 20.1817 21.2742 21.2742 21.3685 21.3685 21.3700 21.3700 k = 0.4818 0.5000 0.4818 ( 5400 PWs) bands (ev): -52.5687 -52.5687 -52.5686 -52.5686 -52.5685 -52.5685 -25.3266 -25.3266 -25.1978 -25.1978 -25.1975 -25.1975 -22.3853 -22.3853 -22.1293 -22.1293 -22.1289 -22.1289 -22.0357 -22.0357 -21.7105 -21.7105 -21.7103 -21.7103 8.4835 8.4835 10.7705 10.7705 10.7794 10.7794 10.8286 10.8286 14.2216 14.2216 15.2772 15.2772 15.3812 15.3812 15.3837 15.3837 16.3842 16.3842 16.3890 16.3890 16.5584 16.5584 17.6449 17.6449 17.6493 17.6493 19.7542 19.7542 19.8055 19.8055 19.9307 19.9307 20.1068 20.1068 20.2473 20.2473 20.2683 20.2683 21.2718 21.2718 21.3640 21.3640 21.3697 21.3697 k = 0.4727 0.5000 0.4727 ( 5418 PWs) bands (ev): -52.5688 -52.5688 -52.5686 -52.5686 -52.5683 -52.5683 -25.3263 -25.3263 -25.1981 -25.1981 -25.1975 -25.1975 -22.3850 -22.3850 -22.1298 -22.1298 -22.1289 -22.1289 -22.0352 -22.0352 -21.7111 -21.7111 -21.7107 -21.7107 8.4605 8.4605 10.7773 10.7773 10.7953 10.7953 10.8460 10.8460 14.2279 14.2279 15.2815 15.2815 15.3840 15.3840 15.3897 15.3897 16.3820 16.3820 16.3924 16.3924 16.5594 16.5594 17.6427 17.6427 17.6524 17.6524 19.6562 19.6562 19.6962 19.6962 19.9248 19.9248 20.0710 20.0710 20.3285 20.3285 20.3590 20.3590 21.2673 21.2673 21.3570 21.3570 21.3690 21.3690 k = 0.4636 0.5000 0.4636 ( 5430 PWs) bands (ev): -52.5690 -52.5690 -52.5686 -52.5686 -52.5681 -52.5681 -25.3259 -25.3259 -25.1985 -25.1985 -25.1973 -25.1973 -22.3845 -22.3845 -22.1305 -22.1305 -22.1289 -22.1289 -22.0346 -22.0346 -21.7119 -21.7119 -21.7112 -21.7112 8.4292 8.4292 10.7863 10.7863 10.8141 10.8141 10.8736 10.8736 14.2367 14.2367 15.2873 15.2873 15.3878 15.3878 15.3982 15.3982 16.3788 16.3788 16.3968 16.3968 16.5612 16.5612 17.6397 17.6397 17.6568 17.6568 19.5475 19.5475 19.5825 19.5825 19.9204 19.9204 20.0220 20.0220 20.4089 20.4089 20.4474 20.4474 21.2602 21.2602 21.3482 21.3482 21.3679 21.3679 k = 0.4545 0.5000 0.4545 ( 5430 PWs) bands (ev): -52.5692 -52.5692 -52.5686 -52.5686 -52.5679 -52.5679 -25.3253 -25.3253 -25.1990 -25.1990 -25.1971 -25.1971 -22.3839 -22.3839 -22.1314 -22.1314 -22.1288 -22.1288 -22.0337 -22.0337 -21.7130 -21.7130 -21.7117 -21.7117 8.3904 8.3904 10.7969 10.7969 10.8351 10.8351 10.9116 10.9116 14.2479 14.2479 15.2946 15.2946 15.3927 15.3927 15.4091 15.4091 16.3747 16.3747 16.4016 16.4016 16.5644 16.5644 17.6360 17.6360 17.6624 17.6624 19.4321 19.4321 19.4666 19.4666 19.9158 19.9158 19.9612 19.9612 20.4854 20.4854 20.5318 20.5318 21.2499 21.2499 21.3384 21.3384 21.3660 21.3660 k = 0.4455 0.5000 0.4455 ( 5418 PWs) bands (ev): -52.5695 -52.5695 -52.5686 -52.5686 -52.5676 -52.5676 -25.3245 -25.3245 -25.1995 -25.1995 -25.1967 -25.1967 -22.3831 -22.3831 -22.1323 -22.1323 -22.1286 -22.1286 -22.0326 -22.0326 -21.7141 -21.7141 -21.7124 -21.7124 8.3447 8.3447 10.8091 10.8091 10.8592 10.8592 10.9585 10.9585 14.2615 14.2615 15.3031 15.3031 15.3984 15.3984 15.4226 15.4226 16.3698 16.3698 16.4065 16.4065 16.5694 16.5694 17.6317 17.6317 17.6693 17.6693 19.3115 19.3115 19.3499 19.3499 19.8873 19.8873 19.9130 19.9130 20.5565 20.5565 20.6112 20.6112 21.2362 21.2362 21.3285 21.3285 21.3632 21.3632 k = 0.4364 0.5000 0.4364 ( 5408 PWs) bands (ev): -52.5698 -52.5698 -52.5685 -52.5685 -52.5673 -52.5673 -25.3237 -25.3237 -25.2001 -25.2001 -25.1964 -25.1964 -22.3822 -22.3822 -22.1335 -22.1335 -22.1285 -22.1285 -22.0312 -22.0312 -21.7155 -21.7155 -21.7132 -21.7132 8.2932 8.2932 10.8228 10.8228 10.8868 10.8868 11.0129 11.0129 14.2773 14.2773 15.3128 15.3128 15.4049 15.4049 15.4387 15.4387 16.3641 16.3641 16.4106 16.4106 16.5770 16.5770 17.6272 17.6272 17.6775 17.6775 19.1869 19.1869 19.2329 19.2329 19.8061 19.8061 19.9069 19.9069 20.6209 20.6209 20.6853 20.6853 21.2195 21.2195 21.3186 21.3186 21.3596 21.3596 k = 0.4273 0.5000 0.4273 ( 5404 PWs) bands (ev): -52.5702 -52.5702 -52.5685 -52.5685 -52.5669 -52.5669 -25.3227 -25.3227 -25.2008 -25.2008 -25.1960 -25.1960 -22.3811 -22.3811 -22.1349 -22.1349 -22.1283 -22.1283 -22.0297 -22.0297 -21.7171 -21.7171 -21.7141 -21.7141 8.2366 8.2366 10.8379 10.8379 10.9183 10.9183 11.0736 11.0736 14.2953 14.2953 15.3233 15.3233 15.4120 15.4120 15.4575 15.4575 16.3576 16.3576 16.4134 16.4134 16.5879 16.5879 17.6224 17.6224 17.6868 17.6868 19.0591 19.0591 19.1157 19.1157 19.7156 19.7156 19.9009 19.9009 20.6773 20.6773 20.7536 20.7536 21.2010 21.2010 21.3088 21.3088 21.3551 21.3551 k = 0.4182 0.5000 0.4182 ( 5408 PWs) bands (ev): -52.5706 -52.5706 -52.5685 -52.5685 -52.5665 -52.5665 -25.3217 -25.3217 -25.2016 -25.2016 -25.1956 -25.1956 -22.3800 -22.3800 -22.1364 -22.1364 -22.1282 -22.1282 -22.0281 -22.0281 -21.7189 -21.7189 -21.7151 -21.7151 8.1757 8.1757 10.8546 10.8546 10.9538 10.9538 11.1396 11.1396 14.3153 14.3153 15.3346 15.3346 15.4196 15.4196 15.4788 15.4788 16.3504 16.3504 16.4143 16.4143 16.6026 16.6026 17.6177 17.6177 17.6974 17.6974 18.9290 18.9290 18.9984 18.9984 19.6174 19.6174 19.8943 19.8943 20.7242 20.7242 20.8161 20.8161 21.1826 21.1826 21.2985 21.2985 21.3500 21.3500 k = 0.4091 0.5000 0.4091 ( 5408 PWs) bands (ev): -52.5711 -52.5711 -52.5685 -52.5685 -52.5660 -52.5660 -25.3205 -25.3205 -25.2024 -25.2024 -25.1951 -25.1951 -22.3787 -22.3787 -22.1381 -22.1381 -22.1280 -22.1280 -22.0262 -22.0262 -21.7209 -21.7209 -21.7163 -21.7163 8.1112 8.1112 10.8729 10.8729 10.9933 10.9933 11.2099 11.2099 14.3373 14.3373 15.3463 15.3463 15.4274 15.4274 15.5028 15.5028 16.3425 16.3425 16.4133 16.4133 16.6213 16.6213 17.6133 17.6133 17.7091 17.7091 18.7971 18.7971 18.8813 18.8813 19.5128 19.5128 19.8870 19.8870 20.7596 20.7596 20.8728 20.8728 21.1669 21.1669 21.2876 21.2876 21.3445 21.3445 k = 0.4000 0.5000 0.4000 ( 5396 PWs) bands (ev): -52.5716 -52.5716 -52.5685 -52.5685 -52.5655 -52.5655 -25.3193 -25.3193 -25.2034 -25.2034 -25.1945 -25.1945 -22.3774 -22.3774 -22.1400 -22.1400 -22.1278 -22.1278 -22.0241 -22.0241 -21.7230 -21.7230 -21.7175 -21.7175 8.0438 8.0438 10.8928 10.8928 11.0367 11.0367 11.2839 11.2839 14.3610 14.3610 15.3582 15.3582 15.4353 15.4353 15.5295 15.5295 16.3341 16.3341 16.4104 16.4104 16.6441 16.6441 17.6093 17.6093 17.7217 17.7217 18.6639 18.6639 18.7646 18.7646 19.4027 19.4027 19.8789 19.8789 20.7813 20.7813 20.9240 20.9240 21.1565 21.1565 21.2758 21.2758 21.3388 21.3388 k = 0.3909 0.5000 0.3909 ( 5396 PWs) bands (ev): -52.5721 -52.5721 -52.5685 -52.5685 -52.5650 -52.5650 -25.3180 -25.3180 -25.2044 -25.2044 -25.1938 -25.1938 -22.3759 -22.3759 -22.1420 -22.1420 -22.1276 -22.1276 -22.0218 -22.0218 -21.7253 -21.7253 -21.7189 -21.7189 7.9740 7.9740 10.9142 10.9142 11.0840 11.0840 11.3610 11.3610 14.3864 14.3864 15.3701 15.3701 15.4431 15.4431 15.5587 15.5587 16.3249 16.3249 16.4061 16.4061 16.6708 16.6708 17.6060 17.6060 17.7352 17.7352 18.5297 18.5297 18.6486 18.6486 19.2882 19.2882 19.8701 19.8701 20.7880 20.7880 20.9699 20.9699 21.1532 21.1532 21.2631 21.2631 21.3331 21.3331 k = 0.3818 0.5000 0.3818 ( 5394 PWs) bands (ev): -52.5727 -52.5727 -52.5685 -52.5685 -52.5644 -52.5644 -25.3166 -25.3166 -25.2055 -25.2055 -25.1931 -25.1931 -22.3744 -22.3744 -22.1442 -22.1442 -22.1273 -22.1273 -22.0193 -22.0193 -21.7277 -21.7277 -21.7203 -21.7203 7.9023 7.9023 10.9372 10.9372 11.1351 11.1351 11.4406 11.4406 14.4132 14.4132 15.3816 15.3816 15.4507 15.4507 15.5904 15.5904 16.3149 16.3149 16.4011 16.4011 16.7014 16.7014 17.6034 17.6034 17.7492 17.7492 18.3951 18.3951 18.5334 18.5334 19.1703 19.1703 19.8605 19.8605 20.7803 20.7803 21.0111 21.0111 21.1568 21.1568 21.2499 21.2499 21.3274 21.3274 k = 0.3727 0.5000 0.3727 ( 5394 PWs) bands (ev): -52.5734 -52.5734 -52.5685 -52.5685 -52.5637 -52.5637 -25.3152 -25.3152 -25.2066 -25.2066 -25.1924 -25.1924 -22.3728 -22.3728 -22.1464 -22.1464 -22.1271 -22.1271 -22.0166 -22.0166 -21.7303 -21.7303 -21.7219 -21.7219 7.8293 7.8293 10.9617 10.9617 11.1898 11.1898 11.5223 11.5223 14.4413 14.4413 15.3924 15.3924 15.4579 15.4579 15.6246 15.6246 16.3036 16.3036 16.3961 16.3961 16.7354 16.7354 17.6018 17.6018 17.7632 17.7632 18.2603 18.2603 18.4195 18.4195 19.0500 19.0500 19.8502 19.8502 20.7606 20.7606 21.0478 21.0478 21.1652 21.1652 21.2367 21.2367 21.3220 21.3220 k = 0.3636 0.5000 0.3636 ( 5384 PWs) bands (ev): -52.5740 -52.5740 -52.5685 -52.5685 -52.5631 -52.5631 -25.3138 -25.3138 -25.2078 -25.2078 -25.1915 -25.1915 -22.3711 -22.3711 -22.1488 -22.1488 -22.1268 -22.1268 -22.0137 -22.0137 -21.7330 -21.7330 -21.7235 -21.7235 7.7551 7.7551 10.9876 10.9876 11.2482 11.2482 11.6056 11.6056 14.4705 14.4705 15.4019 15.4019 15.4649 15.4649 15.6612 15.6612 16.2907 16.2907 16.3922 16.3922 16.7729 16.7729 17.6011 17.6011 17.7766 17.7766 18.1259 18.1259 18.3070 18.3070 18.9285 18.9285 19.8391 19.8391 20.7322 20.7322 21.0802 21.0802 21.1752 21.1752 21.2246 21.2246 21.3168 21.3168 k = 0.3545 0.5000 0.3545 ( 5372 PWs) bands (ev): -52.5747 -52.5747 -52.5685 -52.5685 -52.5623 -52.5623 -25.3123 -25.3123 -25.2089 -25.2089 -25.1906 -25.1906 -22.3694 -22.3694 -22.1513 -22.1513 -22.1265 -22.1265 -22.0106 -22.0106 -21.7357 -21.7357 -21.7253 -21.7253 7.6803 7.6803 11.0150 11.0150 11.3100 11.3100 11.6902 11.6902 14.5005 14.5005 15.4094 15.4094 15.4720 15.4720 15.7000 15.7000 16.2755 16.2755 16.3903 16.3903 16.8136 16.8136 17.6013 17.6013 17.7881 17.7881 17.9925 17.9925 18.1964 18.1964 18.8073 18.8073 19.8273 19.8273 20.6978 20.6978 21.1082 21.1082 21.1836 21.1836 21.2155 21.2155 21.3119 21.3119 k = 0.3455 0.5000 0.3455 ( 5380 PWs) bands (ev): -52.5755 -52.5755 -52.5685 -52.5685 -52.5616 -52.5616 -25.3109 -25.3109 -25.2102 -25.2102 -25.1897 -25.1897 -22.3677 -22.3677 -22.1540 -22.1540 -22.1262 -22.1262 -22.0074 -22.0074 -21.7386 -21.7386 -21.7271 -21.7271 7.6051 7.6051 11.0437 11.0437 11.3752 11.3752 11.7757 11.7757 14.5311 14.5311 15.4142 15.4142 15.4794 15.4794 15.7410 15.7410 16.2578 16.2578 16.3911 16.3911 16.8573 16.8573 17.6020 17.6020 17.7923 17.7923 17.8644 17.8644 18.0883 18.0883 18.6879 18.6879 19.8147 19.8147 20.6598 20.6598 21.1310 21.1310 21.1871 21.1871 21.2130 21.2130 21.3073 21.3073 k = 0.3364 0.5000 0.3364 ( 5384 PWs) bands (ev): -52.5762 -52.5762 -52.5685 -52.5685 -52.5608 -52.5608 -25.3094 -25.3094 -25.2115 -25.2115 -25.1887 -25.1887 -22.3659 -22.3659 -22.1567 -22.1567 -22.1259 -22.1259 -22.0040 -22.0040 -21.7415 -21.7415 -21.7290 -21.7290 7.5298 7.5298 11.0738 11.0738 11.4436 11.4436 11.8618 11.8618 14.5622 14.5622 15.4156 15.4156 15.4877 15.4877 15.7841 15.7841 16.2376 16.2376 16.3952 16.3952 16.9040 16.9040 17.6022 17.6022 17.7178 17.7178 17.8115 17.8115 17.9838 17.9838 18.5730 18.5730 19.8014 19.8014 20.6196 20.6196 21.1457 21.1457 21.1883 21.1883 21.2168 21.2168 21.3034 21.3034 k = 0.3273 0.5000 0.3273 ( 5396 PWs) bands (ev): -52.5770 -52.5770 -52.5685 -52.5685 -52.5600 -52.5600 -25.3081 -25.3081 -25.2128 -25.2128 -25.1876 -25.1876 -22.3642 -22.3642 -22.1596 -22.1596 -22.1256 -22.1256 -22.0004 -22.0004 -21.7446 -21.7446 -21.7311 -21.7311 7.4545 7.4545 11.1051 11.1051 11.5151 11.5151 11.9483 11.9483 14.5933 14.5933 15.4132 15.4132 15.4968 15.4968 15.8290 15.8290 16.2149 16.2149 16.4027 16.4027 16.9534 16.9534 17.5832 17.5832 17.6075 17.6075 17.8045 17.8045 17.8855 17.8855 18.4659 18.4659 19.7874 19.7874 20.5785 20.5785 21.1507 21.1507 21.1929 21.1929 21.2232 21.2232 21.3003 21.3003 k = 0.3182 0.5000 0.3182 ( 5410 PWs) bands (ev): -52.5778 -52.5778 -52.5685 -52.5685 -52.5592 -52.5592 -25.3068 -25.3068 -25.2141 -25.2141 -25.1865 -25.1865 -22.3624 -22.3624 -22.1625 -22.1625 -22.1252 -22.1252 -21.9967 -21.9967 -21.7477 -21.7477 -21.7332 -21.7332 7.3796 7.3796 11.1375 11.1375 11.5897 11.5897 12.0350 12.0350 14.6244 14.6244 15.4072 15.4072 15.5067 15.5067 15.8754 15.8754 16.1902 16.1902 16.4136 16.4136 17.0054 17.0054 17.4595 17.4595 17.5932 17.5932 17.7818 17.7818 17.8041 17.8041 18.3716 18.3716 19.7727 19.7727 20.5372 20.5372 21.1505 21.1505 21.1971 21.1971 21.2314 21.2314 21.2988 21.2988 k = 0.3091 0.5000 0.3091 ( 5390 PWs) bands (ev): -52.5786 -52.5786 -52.5685 -52.5685 -52.5584 -52.5584 -25.3054 -25.3054 -25.2154 -25.2154 -25.1852 -25.1852 -22.3606 -22.3606 -22.1653 -22.1653 -22.1248 -22.1248 -21.9927 -21.9927 -21.7507 -21.7507 -21.7353 -21.7353 7.3053 7.3053 11.1711 11.1711 11.6670 11.6670 12.1216 12.1216 14.6549 14.6549 15.3975 15.3975 15.5173 15.5173 15.9229 15.9229 16.1641 16.1641 16.4275 16.4275 17.0593 17.0593 17.3333 17.3333 17.5620 17.5620 17.7308 17.7308 17.7587 17.7587 18.2960 18.2960 19.7574 19.7574 20.4965 20.4965 21.1501 21.1501 21.1968 21.1968 21.2398 21.2398 21.3000 21.3000 k = 0.3000 0.5000 0.3000 ( 5390 PWs) bands (ev): -52.5795 -52.5795 -52.5685 -52.5685 -52.5575 -52.5575 -25.3042 -25.3042 -25.2166 -25.2166 -25.1840 -25.1840 -22.3589 -22.3589 -22.1683 -22.1683 -22.1244 -22.1244 -21.9887 -21.9887 -21.7539 -21.7539 -21.7375 -21.7375 7.2316 7.2316 11.2056 11.2056 11.7470 11.7470 12.2079 12.2079 14.6847 14.6847 15.3847 15.3847 15.5282 15.5282 15.9701 15.9701 16.1382 16.1382 16.4440 16.4440 17.1122 17.1122 17.2126 17.2126 17.4990 17.4990 17.7017 17.7017 17.7056 17.7056 18.2430 18.2430 19.7415 19.7415 20.4568 20.4568 21.1516 21.1516 21.1926 21.1926 21.2458 21.2458 21.3053 21.3053 k = 0.2909 0.5000 0.2909 ( 5382 PWs) bands (ev): -52.5804 -52.5804 -52.5685 -52.5685 -52.5566 -52.5566 -25.3031 -25.3031 -25.2178 -25.2178 -25.1826 -25.1826 -22.3572 -22.3572 -22.1712 -22.1712 -22.1240 -22.1240 -21.9844 -21.9844 -21.7570 -21.7570 -21.7397 -21.7397 7.1587 7.1587 11.2411 11.2411 11.8295 11.8295 12.2938 12.2938 14.7135 14.7135 15.3688 15.3688 15.5396 15.5396 16.0117 16.0117 16.1178 16.1178 16.4621 16.4621 17.0797 17.0797 17.1817 17.1817 17.4182 17.4182 17.6247 17.6247 17.7026 17.7026 18.2114 18.2114 19.7251 19.7251 20.4187 20.4187 21.1544 21.1544 21.1861 21.1861 21.2486 21.2486 21.3147 21.3147 k = 0.2818 0.5000 0.2818 ( 5386 PWs) bands (ev): -52.5812 -52.5812 -52.5685 -52.5685 -52.5558 -52.5558 -25.3021 -25.3021 -25.2190 -25.2190 -25.1812 -25.1812 -22.3556 -22.3556 -22.1742 -22.1742 -22.1236 -22.1236 -21.9801 -21.9801 -21.7602 -21.7602 -21.7420 -21.7420 7.0869 7.0869 11.2774 11.2774 11.9143 11.9143 12.3790 12.3790 14.7408 14.7408 15.3502 15.3502 15.5512 15.5512 16.0282 16.0282 16.1227 16.1227 16.4798 16.4798 16.9680 16.9680 17.2295 17.2295 17.3392 17.3392 17.5329 17.5329 17.7093 17.7093 18.1959 18.1959 19.7082 19.7082 20.3823 20.3823 21.1546 21.1546 21.1813 21.1813 21.2503 21.2503 21.3270 21.3270 k = 0.2727 0.5000 0.2727 ( 5384 PWs) bands (ev): -52.5821 -52.5821 -52.5685 -52.5685 -52.5549 -52.5549 -25.3012 -25.3012 -25.2201 -25.2201 -25.1797 -25.1797 -22.3540 -22.3540 -22.1771 -22.1771 -22.1231 -22.1231 -21.9756 -21.9756 -21.7633 -21.7633 -21.7443 -21.7443 7.0161 7.0161 11.3145 11.3145 12.0013 12.0013 12.4634 12.4634 14.7663 14.7663 15.3293 15.3293 15.5632 15.5632 16.0107 16.0107 16.1618 16.1618 16.4931 16.4931 16.8631 16.8631 17.2136 17.2136 17.3255 17.3255 17.4342 17.4342 17.7206 17.7206 18.1905 18.1905 19.6909 19.6909 20.3482 20.3482 21.1459 21.1459 21.1826 21.1826 21.2549 21.2549 21.3410 21.3410 k = 0.2636 0.5000 0.2636 ( 5386 PWs) bands (ev): -52.5830 -52.5830 -52.5685 -52.5685 -52.5539 -52.5539 -25.3005 -25.3005 -25.2212 -25.2212 -25.1781 -25.1781 -22.3526 -22.3526 -22.1800 -22.1800 -22.1227 -22.1227 -21.9710 -21.9710 -21.7664 -21.7664 -21.7467 -21.7467 6.9467 6.9467 11.3522 11.3522 12.0902 12.0902 12.5468 12.5468 14.7897 14.7897 15.3063 15.3063 15.5756 15.5756 15.9807 15.9807 16.2134 16.2134 16.4922 16.4922 16.7772 16.7772 17.1338 17.1338 17.3142 17.3142 17.3957 17.3957 17.7347 17.7347 18.1907 18.1907 19.6733 19.6733 20.3165 20.3165 21.1302 21.1302 21.1845 21.1845 21.2671 21.2671 21.3558 21.3558 k = 0.2545 0.5000 0.2545 ( 5390 PWs) bands (ev): -52.5839 -52.5839 -52.5685 -52.5685 -52.5530 -52.5530 -25.2999 -25.2999 -25.2221 -25.2221 -25.1765 -25.1765 -22.3513 -22.3513 -22.1829 -22.1829 -22.1222 -22.1222 -21.9663 -21.9663 -21.7695 -21.7695 -21.7491 -21.7491 6.8786 6.8786 11.3904 11.3904 12.1807 12.1807 12.6292 12.6292 14.8106 14.8106 15.2814 15.2814 15.5884 15.5884 15.9468 15.9468 16.2681 16.2681 16.4608 16.4608 16.7280 16.7280 17.0480 17.0480 17.2116 17.2116 17.4563 17.4563 17.7509 17.7509 18.1936 18.1936 19.6556 19.6556 20.2875 20.2875 21.1106 21.1106 21.1818 21.1818 21.2897 21.2897 21.3710 21.3710 k = 0.2455 0.5000 0.2455 ( 5390 PWs) bands (ev): -52.5848 -52.5848 -52.5685 -52.5685 -52.5521 -52.5521 -25.2995 -25.2995 -25.2230 -25.2230 -25.1749 -25.1749 -22.3500 -22.3500 -22.1857 -22.1857 -22.1217 -22.1217 -21.9615 -21.9615 -21.7726 -21.7726 -21.7516 -21.7516 6.8120 6.8120 11.4291 11.4291 12.2728 12.2728 12.7104 12.7104 14.8287 14.8287 15.2551 15.2551 15.6017 15.6017 15.9111 15.9111 16.3159 16.3159 16.4020 16.4020 16.7200 16.7200 16.9629 16.9629 17.1051 17.1051 17.5244 17.5244 17.7686 17.7686 18.1973 18.1973 19.6378 19.6378 20.2612 20.2612 21.0881 21.0881 21.1749 21.1749 21.3215 21.3215 21.3867 21.3867 k = 0.2364 0.5000 0.2364 ( 5378 PWs) bands (ev): -52.5857 -52.5857 -52.5686 -52.5686 -52.5512 -52.5512 -25.2992 -25.2992 -25.2238 -25.2238 -25.1732 -25.1732 -22.3489 -22.3489 -22.1884 -22.1884 -22.1211 -22.1211 -21.9566 -21.9566 -21.7756 -21.7756 -21.7540 -21.7540 6.7469 6.7469 11.4681 11.4681 12.3661 12.3661 12.7902 12.7902 14.8437 14.8437 15.2275 15.2275 15.6154 15.6154 15.8746 15.8746 16.2817 16.2817 16.4065 16.4065 16.7368 16.7368 16.8796 16.8796 17.0002 17.0002 17.5944 17.5944 17.7881 17.7881 18.2008 18.2008 19.6201 19.6201 20.2380 20.2380 21.0632 21.0632 21.1648 21.1648 21.3601 21.3601 21.4033 21.4033 k = 0.2273 0.5000 0.2273 ( 5366 PWs) bands (ev): -52.5866 -52.5866 -52.5686 -52.5686 -52.5503 -52.5503 -25.2990 -25.2990 -25.2244 -25.2244 -25.1715 -25.1715 -22.3479 -22.3479 -22.1909 -22.1909 -22.1206 -22.1206 -21.9517 -21.9517 -21.7785 -21.7785 -21.7565 -21.7565 6.6836 6.6836 11.5074 11.5074 12.4604 12.4604 12.8686 12.8686 14.8553 14.8553 15.1989 15.1989 15.6296 15.6296 15.8376 15.8376 16.1895 16.1895 16.4626 16.4626 16.7641 16.7641 16.7997 16.7997 16.8989 16.8989 17.6644 17.6644 17.8097 17.8097 18.2034 18.2034 19.6027 19.6027 20.2178 20.2178 21.0363 21.0363 21.1524 21.1524 21.4007 21.4007 21.4238 21.4238 k = 0.2182 0.5000 0.2182 ( 5370 PWs) bands (ev): -52.5875 -52.5875 -52.5686 -52.5686 -52.5494 -52.5494 -25.2990 -25.2990 -25.2250 -25.2250 -25.1698 -25.1698 -22.3470 -22.3470 -22.1934 -22.1934 -22.1200 -22.1200 -21.9467 -21.9467 -21.7815 -21.7815 -21.7589 -21.7589 6.6220 6.6220 11.5467 11.5467 12.5554 12.5554 12.9454 12.9454 14.8633 14.8633 15.1696 15.1696 15.6443 15.6443 15.8004 15.8004 16.0910 16.0910 16.5230 16.5230 16.7201 16.7201 16.7901 16.7901 16.8125 16.8125 17.7316 17.7316 17.8357 17.8357 18.2048 18.2048 19.5858 19.5858 20.2007 20.2007 21.0075 21.0075 21.1383 21.1383 21.4275 21.4275 21.4624 21.4624 k = 0.2091 0.5000 0.2091 ( 5368 PWs) bands (ev): -52.5884 -52.5884 -52.5686 -52.5686 -52.5485 -52.5485 -25.2992 -25.2992 -25.2255 -25.2255 -25.1680 -25.1680 -22.3463 -22.3463 -22.1958 -22.1958 -22.1194 -22.1194 -21.9417 -21.9417 -21.7843 -21.7843 -21.7614 -21.7614 6.5623 6.5623 11.5860 11.5860 12.6508 12.6508 13.0206 13.0206 14.8675 14.8675 15.1397 15.1397 15.6591 15.6591 15.7633 15.7633 15.9923 15.9923 16.5754 16.5754 16.6512 16.6512 16.7120 16.7120 16.8403 16.8403 17.7891 17.7891 17.8722 17.8722 18.2051 18.2051 19.5697 19.5697 20.1867 20.1867 20.9771 20.9771 21.1224 21.1224 21.4452 21.4452 21.5122 21.5122 k = 0.2000 0.5000 0.2000 ( 5360 PWs) bands (ev): -52.5892 -52.5892 -52.5686 -52.5686 -52.5476 -52.5476 -25.2995 -25.2995 -25.2259 -25.2259 -25.1663 -25.1663 -22.3458 -22.3458 -22.1979 -22.1979 -22.1188 -22.1188 -21.9367 -21.9367 -21.7871 -21.7871 -21.7639 -21.7639 6.5045 6.5045 11.6251 11.6251 12.7463 12.7463 13.0941 13.0941 14.8678 14.8678 15.1095 15.1095 15.6739 15.6739 15.7267 15.7267 15.8950 15.8950 16.5537 16.5537 16.6041 16.6041 16.6860 16.6860 16.8799 16.8799 17.8292 17.8292 17.9259 17.9259 18.2046 18.2046 19.5548 19.5548 20.1759 20.1759 20.9455 20.9455 21.1049 21.1049 21.4616 21.4616 21.5629 21.5629 k = 0.1909 0.5000 0.1909 ( 5372 PWs) bands (ev): -52.5901 -52.5901 -52.5686 -52.5686 -52.5468 -52.5468 -25.3000 -25.3000 -25.2262 -25.2262 -25.1645 -25.1645 -22.3454 -22.3454 -22.2000 -22.2000 -22.1182 -22.1182 -21.9317 -21.9317 -21.7899 -21.7899 -21.7663 -21.7663 6.4487 6.4487 11.6640 11.6640 12.8417 12.8417 13.1658 13.1658 14.8642 14.8642 15.0792 15.0792 15.6837 15.6837 15.6950 15.6950 15.8003 15.8003 16.4858 16.4858 16.5301 16.5301 16.7426 16.7426 16.9210 16.9210 17.8569 17.8569 17.9906 17.9906 18.2040 18.2040 19.5413 19.5413 20.1682 20.1682 20.9128 20.9128 21.0857 21.0857 21.4777 21.4777 21.6103 21.6103 k = 0.1818 0.5000 0.1818 ( 5372 PWs) bands (ev): -52.5909 -52.5909 -52.5686 -52.5686 -52.5459 -52.5459 -25.3006 -25.3006 -25.2264 -25.2264 -25.1627 -25.1627 -22.3452 -22.3452 -22.2019 -22.2019 -22.1175 -22.1175 -21.9267 -21.9267 -21.7925 -21.7925 -21.7688 -21.7688 6.3951 6.3951 11.7024 11.7024 12.9365 12.9365 13.2358 13.2358 14.8568 14.8568 15.0488 15.0488 15.6525 15.6525 15.6957 15.6957 15.7172 15.7172 16.4161 16.4161 16.4571 16.4571 16.8100 16.8100 16.9631 16.9631 17.8794 17.8794 18.0565 18.0565 18.2054 18.2054 19.5297 19.5297 20.1634 20.1634 20.8792 20.8792 21.0648 21.0648 21.4936 21.4936 21.6508 21.6508 k = 0.1727 0.5000 0.1727 ( 5352 PWs) bands (ev): -52.5917 -52.5917 -52.5687 -52.5687 -52.5451 -52.5451 -25.3012 -25.3012 -25.2265 -25.2265 -25.1609 -25.1609 -22.3450 -22.3450 -22.2036 -22.2036 -22.1168 -22.1168 -21.9216 -21.9216 -21.7951 -21.7951 -21.7711 -21.7711 6.3435 6.3435 11.7402 11.7402 13.0304 13.0304 13.3039 13.3039 14.8457 14.8457 15.0187 15.0187 15.6093 15.6093 15.6244 15.6244 15.7210 15.7210 16.3487 16.3487 16.3891 16.3891 16.8804 16.8804 17.0056 17.0056 17.8997 17.8997 18.1138 18.1138 18.2153 18.2153 19.5206 19.5206 20.1616 20.1616 20.8450 20.8450 21.0420 21.0420 21.5094 21.5094 21.6811 21.6811 k = 0.1636 0.5000 0.1636 ( 5352 PWs) bands (ev): -52.5925 -52.5925 -52.5687 -52.5687 -52.5443 -52.5443 -25.3020 -25.3020 -25.2266 -25.2266 -25.1592 -25.1592 -22.3451 -22.3451 -22.2052 -22.2052 -22.1162 -22.1162 -21.9166 -21.9166 -21.7976 -21.7976 -21.7735 -21.7735 6.2943 6.2943 11.7773 11.7773 13.1230 13.1230 13.3701 13.3701 14.8311 14.8311 14.9889 14.9889 15.5276 15.5276 15.5857 15.5857 15.7339 15.7339 16.2853 16.2853 16.3260 16.3260 16.9525 16.9525 17.0481 17.0481 17.9186 17.9186 18.1465 18.1465 18.2483 18.2483 19.5146 19.5146 20.1623 20.1623 20.8106 20.8106 21.0173 21.0173 21.5252 21.5252 21.6990 21.6990 k = 0.1545 0.5000 0.1545 ( 5358 PWs) bands (ev): -52.5933 -52.5933 -52.5687 -52.5687 -52.5435 -52.5435 -25.3028 -25.3028 -25.2266 -25.2266 -25.1575 -25.1575 -22.3453 -22.3453 -22.2067 -22.2067 -22.1156 -22.1156 -21.9117 -21.9117 -21.8001 -21.8001 -21.7758 -21.7758 6.2473 6.2473 11.8135 11.8135 13.2138 13.2138 13.4345 13.4345 14.8133 14.8133 14.9596 14.9596 15.4443 15.4443 15.5523 15.5523 15.7460 15.7460 16.2267 16.2267 16.2674 16.2674 17.0258 17.0258 17.0904 17.0904 17.9364 17.9364 18.1554 18.1554 18.3027 18.3027 19.5124 19.5124 20.1655 20.1655 20.7760 20.7760 20.9904 20.9904 21.5407 21.5407 21.7041 21.7041 k = 0.1455 0.5000 0.1455 ( 5362 PWs) bands (ev): -52.5940 -52.5940 -52.5687 -52.5687 -52.5428 -52.5428 -25.3037 -25.3037 -25.2266 -25.2266 -25.1559 -25.1559 -22.3456 -22.3456 -22.2080 -22.2080 -22.1149 -22.1149 -21.9069 -21.9069 -21.8026 -21.8026 -21.7781 -21.7781 6.2026 6.2026 11.8487 11.8487 13.3025 13.3025 13.4972 13.4972 14.7927 14.7927 14.9309 14.9309 15.3639 15.3639 15.5204 15.5204 15.7569 15.7569 16.1733 16.1733 16.2131 16.2131 17.1000 17.1000 17.1323 17.1323 17.9532 17.9532 18.1558 18.1558 18.3624 18.3624 19.5148 19.5148 20.1710 20.1710 20.7417 20.7417 20.9611 20.9611 21.5560 21.5560 21.6973 21.6973 k = 0.1364 0.5000 0.1364 ( 5358 PWs) bands (ev): -52.5947 -52.5947 -52.5687 -52.5687 -52.5421 -52.5421 -25.3046 -25.3046 -25.2265 -25.2265 -25.1543 -25.1543 -22.3459 -22.3459 -22.2091 -22.2091 -22.1143 -22.1143 -21.9021 -21.9021 -21.8050 -21.8050 -21.7802 -21.7802 6.1604 6.1604 11.8828 11.8828 13.3886 13.3886 13.5581 13.5581 14.7699 14.7699 14.9030 14.9030 15.2866 15.2866 15.4899 15.4899 15.7661 15.7661 16.1250 16.1250 16.1632 16.1632 17.1711 17.1711 17.1772 17.1772 17.9690 17.9690 18.1538 18.1538 18.4207 18.4207 19.5225 19.5225 20.1782 20.1782 20.7079 20.7079 20.9294 20.9294 21.5708 21.5708 21.6794 21.6794 k = 0.1273 0.5000 0.1273 ( 5362 PWs) bands (ev): -52.5954 -52.5954 -52.5687 -52.5687 -52.5414 -52.5414 -25.3056 -25.3056 -25.2264 -25.2264 -25.1528 -25.1528 -22.3464 -22.3464 -22.2101 -22.2101 -22.1137 -22.1137 -21.8974 -21.8974 -21.8073 -21.8073 -21.7824 -21.7824 6.1207 6.1207 11.9155 11.9155 13.4715 13.4715 13.6173 13.6173 14.7452 14.7452 14.8760 14.8760 15.2125 15.2125 15.4608 15.4608 15.7735 15.7735 16.0814 16.0814 16.1181 16.1181 17.2126 17.2126 17.2512 17.2512 17.9837 17.9837 18.1515 18.1515 18.4747 18.4747 19.5364 19.5364 20.1870 20.1870 20.6749 20.6749 20.8950 20.8950 21.5847 21.5847 21.6447 21.6447 k = 0.1182 0.5000 0.1182 ( 5358 PWs) bands (ev): -52.5960 -52.5960 -52.5688 -52.5688 -52.5408 -52.5408 -25.3066 -25.3066 -25.2262 -25.2262 -25.1513 -25.1513 -22.3470 -22.3470 -22.2109 -22.2109 -22.1131 -22.1131 -21.8928 -21.8928 -21.8096 -21.8096 -21.7844 -21.7844 6.0834 6.0834 11.9467 11.9467 13.5507 13.5507 13.6751 13.6751 14.7193 14.7193 14.8499 14.8499 15.1417 15.1417 15.4333 15.4333 15.7791 15.7791 16.0413 16.0413 16.0785 16.0785 17.2512 17.2512 17.3270 17.3270 17.9973 17.9973 18.1495 18.1495 18.5233 18.5233 19.5572 19.5572 20.1968 20.1968 20.6431 20.6431 20.8575 20.8575 21.5564 21.5564 21.6019 21.6019 k = 0.1091 0.5000 0.1091 ( 5370 PWs) bands (ev): -52.5966 -52.5966 -52.5688 -52.5688 -52.5402 -52.5402 -25.3075 -25.3075 -25.2261 -25.2261 -25.1499 -25.1499 -22.3476 -22.3476 -22.2117 -22.2117 -22.1125 -22.1125 -21.8883 -21.8883 -21.8119 -21.8119 -21.7863 -21.7863 6.0488 6.0488 11.9763 11.9763 13.6255 13.6255 13.7316 13.7316 14.6928 14.6928 14.8250 14.8250 15.0741 15.0741 15.4075 15.4075 15.7826 15.7826 16.0039 16.0039 16.0451 16.0451 17.2882 17.2882 17.4028 17.4028 18.0098 18.0098 18.1483 18.1483 18.5655 18.5655 19.5851 19.5851 20.2072 20.2072 20.6129 20.6129 20.8168 20.8168 21.4382 21.4382 21.6120 21.6120 k = 0.1000 0.5000 0.1000 ( 5366 PWs) bands (ev): -52.5971 -52.5971 -52.5688 -52.5688 -52.5396 -52.5396 -25.3085 -25.3085 -25.2259 -25.2259 -25.1486 -25.1486 -22.3482 -22.3482 -22.2123 -22.2123 -22.1119 -22.1119 -21.8840 -21.8840 -21.8142 -21.8142 -21.7881 -21.7881 6.0167 6.0167 12.0042 12.0042 13.6953 13.6953 13.7870 13.7870 14.6661 14.6661 14.8013 14.8013 15.0099 15.0099 15.3834 15.3834 15.7844 15.7844 15.9687 15.9687 16.0178 16.0178 17.3234 17.3234 17.4780 17.4780 18.0211 18.0211 18.1480 18.1480 18.6012 18.6012 19.6203 19.6203 20.2178 20.2178 20.5846 20.5846 20.7726 20.7726 21.3164 21.3164 21.5934 21.5934 k = 0.0909 0.5000 0.0909 ( 5370 PWs) bands (ev): -52.5976 -52.5976 -52.5688 -52.5688 -52.5391 -52.5391 -25.3094 -25.3094 -25.2257 -25.2257 -25.1474 -25.1474 -22.3489 -22.3489 -22.2129 -22.2129 -22.1114 -22.1114 -21.8797 -21.8797 -21.8164 -21.8164 -21.7898 -21.7898 5.9873 5.9873 12.0301 12.0301 13.7597 13.7597 13.8413 13.8413 14.6399 14.6399 14.7788 14.7788 14.9491 14.9491 15.3612 15.3612 15.7846 15.7846 15.9359 15.9359 15.9958 15.9958 17.3564 17.3564 17.5522 17.5522 18.0314 18.0314 18.1487 18.1487 18.6305 18.6305 19.6623 19.6623 20.2277 20.2277 20.5588 20.5588 20.7245 20.7245 21.1988 21.1988 21.5635 21.5635 k = 0.0818 0.5000 0.0818 ( 5366 PWs) bands (ev): -52.5981 -52.5981 -52.5688 -52.5688 -52.5386 -52.5386 -25.3102 -25.3102 -25.2256 -25.2256 -25.1462 -25.1462 -22.3495 -22.3495 -22.2133 -22.2133 -22.1108 -22.1108 -21.8756 -21.8756 -21.8187 -21.8187 -21.7914 -21.7914 5.9606 5.9606 12.0541 12.0541 13.8184 13.8184 13.8943 13.8943 14.6147 14.6147 14.7575 14.7575 14.8919 14.8919 15.3409 15.3409 15.7836 15.7836 15.9057 15.9057 15.9781 15.9781 17.3872 17.3872 17.6246 17.6246 18.0406 18.0406 18.1503 18.1503 18.6539 18.6539 19.7106 19.7106 20.2366 20.2366 20.5358 20.5358 20.6725 20.6725 21.0875 21.0875 21.5345 21.5345 k = 0.0727 0.5000 0.0727 ( 5370 PWs) bands (ev): -52.5985 -52.5985 -52.5688 -52.5688 -52.5382 -52.5382 -25.3110 -25.3110 -25.2254 -25.2254 -25.1452 -25.1452 -22.3501 -22.3501 -22.2137 -22.2137 -22.1104 -22.1104 -21.8716 -21.8716 -21.8210 -21.8210 -21.7928 -21.7928 5.9366 5.9366 12.0758 12.0758 13.8717 13.8717 13.9452 13.9452 14.5909 14.5909 14.7373 14.7373 14.8387 14.8387 15.3225 15.3225 15.7817 15.7817 15.8786 15.8786 15.9638 15.9638 17.4154 17.4154 17.6945 17.6945 18.0488 18.0488 18.1526 18.1526 18.6722 18.6722 19.7642 19.7642 20.2438 20.2438 20.5162 20.5162 20.6168 20.6168 20.9839 20.9839 21.5071 21.5071 k = 0.0636 0.5000 0.0636 ( 5374 PWs) bands (ev): -52.5989 -52.5989 -52.5689 -52.5689 -52.5378 -52.5378 -25.3117 -25.3117 -25.2252 -25.2252 -25.1443 -25.1443 -22.3507 -22.3507 -22.2140 -22.2140 -22.1100 -22.1100 -21.8678 -21.8678 -21.8233 -21.8233 -21.7941 -21.7941 5.9153 5.9153 12.0953 12.0953 13.9199 13.9199 13.9930 13.9930 14.5690 14.5690 14.7173 14.7173 14.7905 14.7905 15.3062 15.3062 15.7794 15.7794 15.8546 15.8546 15.9523 15.9523 17.4408 17.4408 17.7609 17.7609 18.0561 18.0561 18.1554 18.1554 18.6863 18.6863 19.8219 19.8219 20.2486 20.2486 20.5002 20.5002 20.5584 20.5584 20.8887 20.8887 21.4818 21.4818 k = 0.0545 0.5000 0.0545 ( 5374 PWs) bands (ev): -52.5992 -52.5992 -52.5689 -52.5689 -52.5375 -52.5375 -25.3123 -25.3123 -25.2251 -25.2251 -25.1435 -25.1435 -22.3513 -22.3513 -22.2143 -22.2143 -22.1096 -22.1096 -21.8642 -21.8642 -21.8256 -21.8256 -21.7952 -21.7952 5.8968 5.8968 12.1124 12.1124 13.9635 13.9635 14.0368 14.0368 14.5493 14.5493 14.6954 14.6954 14.7498 14.7498 15.2919 15.2919 15.7768 15.7768 15.8341 15.8341 15.9428 15.9428 17.4633 17.4633 17.8225 17.8225 18.0624 18.0624 18.1585 18.1585 18.6971 18.6971 19.8825 19.8825 20.2507 20.2507 20.4880 20.4880 20.4991 20.4991 20.8017 20.8017 21.4589 21.4589 k = 0.0455 0.5000 0.0455 ( 5378 PWs) bands (ev): -52.5995 -52.5995 -52.5689 -52.5689 -52.5372 -52.5372 -25.3129 -25.3129 -25.2250 -25.2250 -25.1429 -25.1429 -22.3517 -22.3517 -22.2145 -22.2145 -22.1093 -22.1093 -21.8607 -21.8607 -21.8279 -21.8279 -21.7962 -21.7962 5.8812 5.8812 12.1270 12.1270 14.0024 14.0024 14.0757 14.0757 14.5323 14.5323 14.6684 14.6684 14.7205 14.7205 15.2797 15.2797 15.7740 15.7740 15.8171 15.8171 15.9351 15.9351 17.4826 17.4826 17.8781 17.8781 18.0679 18.0679 18.1618 18.1618 18.7053 18.7053 19.9447 19.9447 20.2499 20.2499 20.4418 20.4418 20.4792 20.4792 20.7225 20.7225 21.4390 21.4390 k = 0.0364 0.5000 0.0364 ( 5370 PWs) bands (ev): -52.5997 -52.5997 -52.5689 -52.5689 -52.5370 -52.5370 -25.3133 -25.3133 -25.2249 -25.2249 -25.1423 -25.1423 -22.3521 -22.3521 -22.2146 -22.2146 -22.1090 -22.1090 -21.8574 -21.8574 -21.8302 -21.8302 -21.7970 -21.7970 5.8683 5.8683 12.1391 12.1391 14.0362 14.0362 14.1092 14.1092 14.5180 14.5180 14.6373 14.6373 14.7021 14.7021 15.2697 15.2697 15.7709 15.7709 15.8039 15.8039 15.9289 15.9289 17.4986 17.4986 17.9261 17.9261 18.0725 18.0725 18.1650 18.1650 18.7117 18.7117 20.0071 20.0071 20.2459 20.2459 20.3903 20.3903 20.4734 20.4734 20.6503 20.6503 21.4222 21.4222 k = 0.0273 0.5000 0.0273 ( 5378 PWs) bands (ev): -52.5999 -52.5999 -52.5689 -52.5689 -52.5368 -52.5368 -25.3137 -25.3137 -25.2248 -25.2248 -25.1419 -25.1419 -22.3524 -22.3524 -22.2147 -22.2147 -22.1088 -22.1088 -21.8544 -21.8544 -21.8324 -21.8324 -21.7976 -21.7976 5.8583 5.8583 12.1486 12.1486 14.0642 14.0642 14.1367 14.1367 14.5068 14.5068 14.6076 14.6076 14.6904 14.6904 15.2619 15.2619 15.7676 15.7676 15.7947 15.7947 15.9240 15.9240 17.5112 17.5112 17.9651 17.9651 18.0761 18.0761 18.1679 18.1679 18.7165 18.7165 20.0678 20.0678 20.2387 20.2387 20.3486 20.3486 20.4696 20.4696 20.5854 20.5854 21.4089 21.4089 k = 0.0182 0.5000 0.0182 ( 5378 PWs) bands (ev): -52.6000 -52.6000 -52.5689 -52.5689 -52.5366 -52.5366 -25.3140 -25.3140 -25.2247 -25.2247 -25.1415 -25.1415 -22.3527 -22.3527 -22.2148 -22.2148 -22.1086 -22.1086 -21.8518 -21.8518 -21.8345 -21.8345 -21.7980 -21.7980 5.8511 5.8511 12.1553 12.1553 14.0852 14.0852 14.1574 14.1574 14.4988 14.4988 14.5834 14.5834 14.6829 14.6829 15.2563 15.2563 15.7643 15.7643 15.7891 15.7891 15.9206 15.9206 17.5203 17.5203 17.9939 17.9939 18.0787 18.0787 18.1704 18.1704 18.7199 18.7199 20.1236 20.1236 20.2285 20.2285 20.3194 20.3194 20.4663 20.4663 20.5301 20.5301 21.3992 21.3992 k = 0.0091 0.5000 0.0091 ( 5368 PWs) bands (ev): -52.6001 -52.6001 -52.5689 -52.5689 -52.5366 -52.5366 -25.3141 -25.3141 -25.2247 -25.2247 -25.1413 -25.1413 -22.3528 -22.3528 -22.2148 -22.2148 -22.1085 -22.1085 -21.8499 -21.8499 -21.8360 -21.8360 -21.7982 -21.7982 5.8468 5.8468 12.1594 12.1594 14.0983 14.0983 14.1705 14.1705 14.4940 14.4940 14.5676 14.5676 14.6785 14.6785 15.2530 15.2530 15.7618 15.7618 15.7862 15.7862 15.9185 15.9185 17.5258 17.5258 18.0115 18.0115 18.0803 18.0803 18.1721 18.1721 18.7220 18.7220 20.1686 20.1686 20.2174 20.2174 20.3027 20.3027 20.4605 20.4605 20.4930 20.4930 21.3934 21.3934 k = 0.0000 0.5000-0.0000 ( 5358 PWs) bands (ev): -52.6001 -52.6001 -52.5689 -52.5689 -52.5365 -52.5365 -25.3142 -25.3142 -25.2246 -25.2246 -25.1412 -25.1412 -22.3529 -22.3529 -22.2148 -22.2148 -22.1085 -22.1085 -21.8491 -21.8491 -21.8367 -21.8367 -21.7983 -21.7983 5.8454 5.8454 12.1608 12.1608 14.1028 14.1028 14.1750 14.1750 14.4924 14.4924 14.5620 14.5620 14.6771 14.6771 15.2519 15.2519 15.7608 15.7608 15.7854 15.7854 15.9178 15.9178 17.5276 17.5276 18.0174 18.0174 18.0808 18.0808 18.1727 18.1727 18.7227 18.7227 20.1904 20.1904 20.2094 20.2094 20.2970 20.2970 20.4541 20.4541 20.4827 20.4827 21.3914 21.3914 k = 0.5000 0.5000-0.0000 ( 5360 PWs) bands (ev): -52.5687 -52.5687 -52.5684 -52.5684 -52.5683 -52.5683 -25.2714 -25.2714 -25.2249 -25.2249 -25.1984 -25.1984 -22.3181 -22.3181 -22.2127 -22.2127 -22.1257 -22.1257 -21.9210 -21.9210 -21.8425 -21.8425 -21.7340 -21.7340 7.0280 7.0280 11.4658 11.4658 11.5131 11.5131 13.2996 13.2996 15.7444 15.7444 15.8713 15.8713 15.9714 15.9714 16.1399 16.1399 16.1760 16.1760 16.2328 16.2328 16.2472 16.2472 16.5036 16.5036 16.6664 16.6664 17.5822 17.5822 17.7978 17.7978 18.1742 18.1742 18.6390 18.6390 20.9215 20.9215 20.9219 20.9219 21.2601 21.2601 21.3856 21.3856 21.4363 21.4363 k = 0.5000 0.5000 0.0128 ( 5360 PWs) bands (ev): -52.5687 -52.5687 -52.5684 -52.5684 -52.5683 -52.5683 -25.2716 -25.2716 -25.2248 -25.2248 -25.1984 -25.1984 -22.3183 -22.3183 -22.2125 -22.2125 -22.1257 -22.1257 -21.9216 -21.9216 -21.8419 -21.8419 -21.7340 -21.7340 7.0296 7.0296 11.4644 11.4644 11.5117 11.5117 13.2961 13.2961 15.7325 15.7325 15.8651 15.8651 15.9609 15.9609 16.1466 16.1466 16.1897 16.1897 16.2450 16.2450 16.2478 16.2478 16.5046 16.5046 16.6663 16.6663 17.5836 17.5836 17.7875 17.7875 18.1859 18.1859 18.6365 18.6365 20.9225 20.9225 20.9227 20.9227 21.2605 21.2605 21.3889 21.3889 21.4362 21.4362 k = 0.5000 0.5000 0.0256 ( 5376 PWs) bands (ev): -52.5687 -52.5687 -52.5684 -52.5684 -52.5683 -52.5683 -25.2720 -25.2720 -25.2245 -25.2245 -25.1984 -25.1984 -22.3189 -22.3189 -22.2119 -22.2119 -22.1257 -22.1257 -21.9231 -21.9231 -21.8404 -21.8404 -21.7339 -21.7339 7.0341 7.0341 11.4603 11.4603 11.5074 11.5074 13.2854 13.2854 15.6998 15.6998 15.8486 15.8486 15.9353 15.9353 16.1636 16.1636 16.2241 16.2241 16.2506 16.2506 16.2788 16.2788 16.5079 16.5079 16.6661 16.6661 17.5876 17.5876 17.7604 17.7604 18.2178 18.2178 18.6290 18.6290 20.9252 20.9252 20.9253 20.9253 21.2618 21.2618 21.3981 21.3981 21.4355 21.4355 k = 0.5000 0.5000 0.0385 ( 5368 PWs) bands (ev): -52.5687 -52.5687 -52.5684 -52.5684 -52.5683 -52.5683 -25.2727 -25.2727 -25.2240 -25.2240 -25.1984 -25.1984 -22.3199 -22.3199 -22.2107 -22.2107 -22.1257 -22.1257 -21.9255 -21.9255 -21.8379 -21.8379 -21.7337 -21.7337 7.0417 7.0417 11.4534 11.4534 11.5004 11.5004 13.2678 13.2678 15.6526 15.6526 15.8257 15.8257 15.9037 15.9037 16.1822 16.1822 16.2590 16.2590 16.2697 16.2697 16.3279 16.3279 16.5144 16.5144 16.6663 16.6663 17.5922 17.5922 17.7247 17.7247 18.2631 18.2631 18.6168 18.6168 20.9296 20.9296 20.9297 20.9297 21.2640 21.2640 21.4046 21.4046 21.4329 21.4329 k = 0.5000 0.5000 0.0513 ( 5376 PWs) bands (ev): -52.5687 -52.5687 -52.5684 -52.5684 -52.5683 -52.5683 -25.2737 -25.2737 -25.2234 -25.2234 -25.1984 -25.1984 -22.3212 -22.3212 -22.2093 -22.2093 -22.1257 -22.1257 -21.9286 -21.9286 -21.8346 -21.8346 -21.7334 -21.7334 7.0523 7.0523 11.4439 11.4439 11.4906 11.4906 13.2433 13.2433 15.5968 15.5968 15.7999 15.7999 15.8707 15.8707 16.1929 16.1929 16.2768 16.2768 16.3208 16.3208 16.3865 16.3865 16.5264 16.5264 16.6678 16.6678 17.5912 17.5912 17.6924 17.6924 18.3168 18.3168 18.6001 18.6001 20.9352 20.9352 20.9358 20.9358 21.2671 21.2671 21.3486 21.3486 21.4471 21.4471 k = 0.5000 0.5000 0.0641 ( 5360 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5683 -52.5683 -25.2749 -25.2749 -25.2225 -25.2225 -25.1983 -25.1983 -22.3228 -22.3228 -22.2074 -22.2074 -22.1257 -22.1257 -21.9323 -21.9323 -21.8307 -21.8307 -21.7331 -21.7331 7.0660 7.0660 11.4319 11.4319 11.4782 11.4782 13.2122 13.2122 15.5360 15.5360 15.7732 15.7732 15.8385 15.8385 16.1937 16.1937 16.3010 16.3010 16.3737 16.3737 16.4505 16.4505 16.5467 16.5467 16.6721 16.6721 17.5709 17.5709 17.6804 17.6804 18.3756 18.3756 18.5792 18.5792 20.9418 20.9418 20.9433 20.9433 21.2624 21.2624 21.2710 21.2710 21.4504 21.4504 k = 0.5000 0.5000 0.0769 ( 5360 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5683 -52.5683 -25.2763 -25.2763 -25.2216 -25.2216 -25.1983 -25.1983 -22.3247 -22.3247 -22.2052 -22.2052 -22.1257 -22.1257 -21.9364 -21.9364 -21.8263 -21.8263 -21.7327 -21.7327 7.0826 7.0826 11.4175 11.4175 11.4634 11.4634 13.1746 13.1746 15.4727 15.4727 15.7468 15.7468 15.8077 15.8077 16.1879 16.1879 16.3234 16.3234 16.4243 16.4243 16.5177 16.5177 16.5784 16.5784 16.6824 16.6824 17.5305 17.5305 17.6917 17.6917 18.4374 18.4374 18.5544 18.5544 20.9489 20.9489 20.9519 20.9519 21.1789 21.1789 21.2759 21.2759 21.4518 21.4518 k = 0.5000 0.5000 0.0897 ( 5360 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5683 -52.5683 -25.2779 -25.2779 -25.2206 -25.2206 -25.1983 -25.1983 -22.3268 -22.3268 -22.2027 -22.2027 -22.1257 -22.1257 -21.9408 -21.9408 -21.8216 -21.8216 -21.7322 -21.7322 7.1022 7.1022 11.4008 11.4008 11.4462 11.4462 13.1308 13.1308 15.4081 15.4081 15.7213 15.7213 15.7787 15.7787 16.1778 16.1778 16.3395 16.3395 16.4669 16.4669 16.5868 16.5868 16.6232 16.6232 16.7029 16.7029 17.4817 17.4817 17.7160 17.7160 18.5012 18.5012 18.5263 18.5263 20.9548 20.9548 20.9615 20.9615 21.1041 21.1041 21.2817 21.2817 21.4543 21.4543 k = 0.5000 0.5000 0.1026 ( 5368 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5683 -52.5683 -25.2797 -25.2797 -25.2195 -25.2195 -25.1983 -25.1983 -22.3292 -22.3292 -22.2000 -22.2000 -22.1257 -22.1257 -21.9454 -21.9454 -21.8167 -21.8167 -21.7317 -21.7317 7.1248 7.1248 11.3820 11.3820 11.4270 11.4270 13.0810 13.0810 15.3434 15.3434 15.6970 15.6970 15.7518 15.7518 16.1642 16.1642 16.3487 16.3487 16.4965 16.4965 16.6573 16.6573 16.6802 16.6802 16.7380 16.7380 17.4302 17.4302 17.7486 17.7486 18.4951 18.4951 18.5663 18.5663 20.9538 20.9538 20.9716 20.9716 21.0448 21.0448 21.2884 21.2884 21.4572 21.4572 k = 0.5000 0.5000 0.1154 ( 5368 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2815 -25.2815 -25.2184 -25.2184 -25.1983 -25.1983 -22.3316 -22.3316 -22.1971 -22.1971 -22.1257 -22.1257 -21.9502 -21.9502 -21.8116 -21.8116 -21.7311 -21.7311 7.1502 7.1502 11.3614 11.3614 11.4058 11.4058 13.0257 13.0257 15.2789 15.2789 15.6739 15.6739 15.7267 15.7267 16.1476 16.1476 16.3525 16.3525 16.5124 16.5124 16.7279 16.7279 16.7470 16.7470 16.7885 16.7885 17.3783 17.3783 17.7880 17.7880 18.4615 18.4615 18.6321 18.6321 20.9306 20.9306 20.9820 20.9820 21.0167 21.0167 21.2960 21.2960 21.4604 21.4604 k = 0.5000 0.5000 0.1282 ( 5376 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2835 -25.2835 -25.2172 -25.2172 -25.1983 -25.1983 -22.3342 -22.3342 -22.1941 -22.1941 -22.1257 -22.1257 -21.9550 -21.9550 -21.8064 -21.8064 -21.7304 -21.7304 7.1785 7.1785 11.3391 11.3391 11.3828 11.3828 12.9651 12.9651 15.2152 15.2152 15.6521 15.6521 15.7034 15.7034 16.1280 16.1280 16.3526 16.3526 16.5182 16.5182 16.7951 16.7951 16.8218 16.8218 16.8533 16.8533 17.3272 17.3272 17.8339 17.8339 18.4258 18.4258 18.6982 18.6982 20.8891 20.8891 20.9924 20.9924 21.0161 21.0161 21.3044 21.3044 21.4635 21.4635 k = 0.5000 0.5000 0.1410 ( 5376 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2855 -25.2855 -25.2160 -25.2160 -25.1982 -25.1982 -22.3369 -22.3369 -22.1909 -22.1909 -22.1257 -22.1257 -21.9598 -21.9598 -21.8011 -21.8011 -21.7297 -21.7297 7.2097 7.2097 11.3153 11.3153 11.3584 11.3584 12.8995 12.8995 15.1526 15.1526 15.6315 15.6315 15.6818 15.6818 16.1055 16.1055 16.3505 16.3505 16.5178 16.5178 16.8560 16.8560 16.9028 16.9028 16.9302 16.9302 17.2779 17.2779 17.8861 17.8861 18.3885 18.3885 18.7644 18.7644 20.8482 20.8482 21.0024 21.0024 21.0242 21.0242 21.3134 21.3134 21.4664 21.4664 k = 0.5000 0.5000 0.1538 ( 5384 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2876 -25.2876 -25.2148 -25.2148 -25.1982 -25.1982 -22.3396 -22.3396 -22.1877 -22.1877 -22.1258 -22.1258 -21.9647 -21.9647 -21.7959 -21.7959 -21.7290 -21.7290 7.2436 7.2436 11.2902 11.2902 11.3327 11.3327 12.8293 12.8293 15.0913 15.0913 15.6120 15.6120 15.6617 15.6617 16.0803 16.0803 16.3470 16.3470 16.5138 16.5138 16.9104 16.9104 16.9891 16.9891 17.0153 17.0153 17.2318 17.2318 17.9446 17.9446 18.3499 18.3499 18.8305 18.8305 20.8136 20.8136 21.0118 21.0118 21.0347 21.0347 21.3230 21.3230 21.4688 21.4688 k = 0.5000 0.5000 0.1667 ( 5388 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2898 -25.2898 -25.2137 -25.2137 -25.1982 -25.1982 -22.3424 -22.3424 -22.1843 -22.1843 -22.1258 -22.1258 -21.9695 -21.9695 -21.7906 -21.7906 -21.7281 -21.7281 7.2802 7.2802 11.2640 11.2640 11.3060 11.3060 12.7549 12.7549 15.0314 15.0314 15.5933 15.5933 15.6430 15.6430 16.0525 16.0525 16.3429 16.3429 16.5079 16.5079 16.9567 16.9567 17.0798 17.0798 17.1049 17.1049 17.1925 17.1925 18.0092 18.0092 18.3105 18.3105 18.8961 18.8961 20.7868 20.7868 21.0203 21.0203 21.0459 21.0459 21.3329 21.3329 21.4704 21.4704 k = 0.5000 0.5000 0.1795 ( 5380 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2919 -25.2919 -25.2125 -25.2125 -25.1982 -25.1982 -22.3451 -22.3451 -22.1810 -22.1810 -22.1258 -22.1258 -21.9741 -21.9741 -21.7853 -21.7853 -21.7273 -21.7273 7.3195 7.3195 11.2370 11.2370 11.2783 11.2783 12.6765 12.6765 14.9731 14.9731 15.5754 15.5754 15.6254 15.6254 16.0223 16.0223 16.3386 16.3386 16.5010 16.5010 16.9891 16.9891 17.1575 17.1575 17.1745 17.1745 17.2067 17.2067 18.0798 18.0798 18.2706 18.2706 18.9611 18.9611 20.7680 20.7680 21.0276 21.0276 21.0573 21.0573 21.3429 21.3429 21.4710 21.4710 k = 0.5000 0.5000 0.1923 ( 5384 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2941 -25.2941 -25.2114 -25.2114 -25.1981 -25.1981 -22.3479 -22.3479 -22.1776 -22.1776 -22.1259 -22.1259 -21.9787 -21.9787 -21.7801 -21.7801 -21.7264 -21.7264 7.3613 7.3613 11.2094 11.2094 11.2501 11.2501 12.5946 12.5946 14.9165 14.9165 15.5582 15.5582 15.6088 15.6088 15.9899 15.9899 16.3345 16.3345 16.4937 16.4937 16.9961 16.9961 17.1556 17.1556 17.2726 17.2726 17.3025 17.3025 18.1560 18.1560 18.2305 18.2305 19.0253 19.0253 20.7570 20.7570 21.0336 21.0336 21.0684 21.0684 21.3526 21.3526 21.4702 21.4702 k = 0.5000 0.5000 0.2051 ( 5396 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2963 -25.2963 -25.2103 -25.2103 -25.1981 -25.1981 -22.3506 -22.3506 -22.1743 -22.1743 -22.1259 -22.1259 -21.9832 -21.9832 -21.7751 -21.7751 -21.7255 -21.7255 7.4056 7.4056 11.1814 11.1814 11.2215 11.2215 12.5094 12.5094 14.8617 14.8617 15.5414 15.5414 15.5930 15.5930 15.9557 15.9557 16.3308 16.3308 16.4864 16.4864 16.9769 16.9769 17.1760 17.1760 17.3738 17.3738 17.4037 17.4037 18.1906 18.1906 18.2375 18.2375 19.0885 19.0885 20.7533 20.7533 21.0380 21.0380 21.0789 21.0789 21.3619 21.3619 21.4678 21.4678 k = 0.5000 0.5000 0.2179 ( 5396 PWs) bands (ev): -52.5686 -52.5686 -52.5684 -52.5684 -52.5684 -52.5684 -25.2985 -25.2985 -25.2092 -25.2092 -25.1981 -25.1981 -22.3533 -22.3533 -22.1710 -22.1710 -22.1260 -22.1260 -21.9876 -21.9876 -21.7701 -21.7701 -21.7246 -21.7246 7.4524 7.4524 11.1531 11.1531 11.1926 11.1926 12.4214 12.4214 14.8089 14.8089 15.5249 15.5249 15.5779 15.5779 15.9200 15.9200 16.3279 16.3279 16.4795 16.4795 16.9448 16.9448 17.2079 17.2079 17.4778 17.4778 17.5080 17.5080 18.1512 18.1512 18.3237 18.3237 19.1506 19.1506 20.7566 20.7566 21.0407 21.0407 21.0885 21.0885 21.3703 21.3703 21.4635 21.4635 k = 0.5000 0.5000 0.2308 ( 5396 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5684 -52.5684 -25.3006 -25.3006 -25.2082 -25.2082 -25.1981 -25.1981 -22.3559 -22.3559 -22.1677 -22.1677 -22.1261 -22.1261 -21.9918 -21.9918 -21.7652 -21.7652 -21.7236 -21.7236 7.5013 7.5013 11.1248 11.1248 11.1637 11.1637 12.3310 12.3310 14.7580 14.7580 15.5088 15.5088 15.5634 15.5634 15.8832 15.8832 16.3257 16.3257 16.4730 16.4730 16.9086 16.9086 17.2431 17.2431 17.5841 17.5841 17.6147 17.6147 18.1125 18.1125 18.4143 18.4143 19.2114 19.2114 20.7662 20.7662 21.0414 21.0414 21.0972 21.0972 21.3777 21.3777 21.4570 21.4570 k = 0.5000 0.5000 0.2436 ( 5412 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5684 -52.5684 -25.3028 -25.3028 -25.2072 -25.2072 -25.1981 -25.1981 -22.3585 -22.3585 -22.1645 -22.1645 -22.1262 -22.1262 -21.9959 -21.9959 -21.7606 -21.7606 -21.7227 -21.7227 7.5524 7.5524 11.0966 11.0966 11.1350 11.1350 12.2385 12.2385 14.7091 14.7091 15.4929 15.4929 15.5493 15.5493 15.8456 15.8456 16.3244 16.3244 16.4672 16.4672 16.8715 16.8715 17.2783 17.2783 17.6923 17.6923 17.7236 17.7236 18.0752 18.0752 18.5085 18.5085 19.2707 19.2707 20.7814 20.7814 21.0398 21.0398 21.1044 21.1044 21.3838 21.3838 21.4481 21.4481 k = 0.5000 0.5000 0.2564 ( 5412 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5684 -52.5684 -25.3049 -25.3049 -25.2063 -25.2063 -25.1980 -25.1980 -22.3610 -22.3610 -22.1614 -22.1614 -22.1263 -22.1263 -21.9998 -21.9998 -21.7560 -21.7560 -21.7217 -21.7217 7.6056 7.6056 11.0688 11.0688 11.1066 11.1066 12.1443 12.1443 14.6623 14.6623 15.4772 15.4772 15.5357 15.5357 15.8076 15.8076 16.3241 16.3241 16.4620 16.4620 16.8351 16.8351 17.3126 17.3126 17.8009 17.8009 17.8343 17.8343 18.0405 18.0405 18.6060 18.6060 19.3284 19.3284 20.8016 20.8016 21.0356 21.0356 21.1101 21.1101 21.3884 21.3884 21.4368 21.4368 k = 0.5000 0.5000 0.2692 ( 5412 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3069 -25.3069 -25.2054 -25.2054 -25.1980 -25.1980 -22.3633 -22.3633 -22.1583 -22.1583 -22.1264 -22.1264 -22.0035 -22.0035 -21.7516 -21.7516 -21.7208 -21.7208 7.6605 7.6605 11.0415 11.0415 11.0788 11.0788 12.0488 12.0488 14.6176 14.6176 15.4617 15.4617 15.5224 15.5224 15.7696 15.7696 16.3247 16.3247 16.4575 16.4575 16.8000 16.8000 17.3454 17.3454 17.9032 17.9032 17.9468 17.9468 18.0152 18.0152 18.7061 18.7061 19.3842 19.3842 20.8260 20.8260 21.0285 21.0285 21.1136 21.1136 21.3915 21.3915 21.4231 21.4231 k = 0.5000 0.5000 0.2821 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3088 -25.3088 -25.2045 -25.2045 -25.1980 -25.1980 -22.3656 -22.3656 -22.1553 -22.1553 -22.1266 -22.1266 -22.0070 -22.0070 -21.7473 -21.7473 -21.7198 -21.7198 7.7171 7.7171 11.0148 11.0148 11.0516 11.0516 11.9524 11.9524 14.5752 14.5752 15.4463 15.4463 15.5095 15.5095 15.7320 15.7320 16.3262 16.3262 16.4536 16.4536 16.7666 16.7666 17.3767 17.3767 17.9427 17.9427 18.0555 18.0555 18.0607 18.0607 18.8084 18.8084 19.4381 19.4381 20.8536 20.8536 21.0180 21.0180 21.1146 21.1146 21.3930 21.3930 21.4075 21.4075 k = 0.5000 0.5000 0.2949 ( 5392 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3107 -25.3107 -25.2037 -25.2037 -25.1979 -25.1979 -22.3678 -22.3678 -22.1525 -22.1525 -22.1267 -22.1267 -22.0103 -22.0103 -21.7433 -21.7433 -21.7188 -21.7188 7.7751 7.7751 10.9889 10.9889 11.0253 11.0253 11.8557 11.8557 14.5349 14.5349 15.4311 15.4311 15.4969 15.4969 15.6951 15.6951 16.3286 16.3286 16.4502 16.4502 16.7352 16.7352 17.4064 17.4064 17.9200 17.9200 18.1611 18.1611 18.1758 18.1758 18.9123 18.9123 19.4900 19.4900 20.8835 20.8835 21.0037 21.0037 21.1124 21.1124 21.3906 21.3906 21.3932 21.3932 k = 0.5000 0.5000 0.3077 ( 5408 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3125 -25.3125 -25.2030 -25.2030 -25.1979 -25.1979 -22.3699 -22.3699 -22.1499 -22.1499 -22.1269 -22.1269 -22.0135 -22.0135 -21.7395 -21.7395 -21.7179 -21.7179 7.8342 7.8342 10.9639 10.9639 10.9998 10.9998 11.7590 11.7590 14.4970 14.4970 15.4161 15.4161 15.4846 15.4846 15.6592 15.6592 16.3317 16.3317 16.4472 16.4472 16.7061 16.7061 17.4345 17.4345 17.8906 17.8906 18.2760 18.2760 18.2919 18.2919 19.0172 19.0172 19.5395 19.5395 20.9141 20.9141 20.9849 20.9849 21.1064 21.1064 21.3733 21.3733 21.3923 21.3923 k = 0.5000 0.5000 0.3205 ( 5408 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3143 -25.3143 -25.2023 -25.2023 -25.1979 -25.1979 -22.3719 -22.3719 -22.1473 -22.1473 -22.1271 -22.1271 -22.0164 -22.0164 -21.7358 -21.7358 -21.7171 -21.7171 7.8942 7.8942 10.9400 10.9400 10.9755 10.9755 11.6629 11.6629 14.4613 14.4613 15.4015 15.4015 15.4727 15.4727 15.6247 15.6247 16.3354 16.3354 16.4443 16.4443 16.6794 16.6794 17.4609 17.4609 17.8613 17.8613 18.3936 18.3936 18.4088 18.4088 19.1225 19.1225 19.5867 19.5867 20.9429 20.9429 20.9614 20.9614 21.0972 21.0972 21.3569 21.3569 21.3904 21.3904 k = 0.5000 0.5000 0.3333 ( 5412 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3159 -25.3159 -25.2017 -25.2017 -25.1979 -25.1979 -22.3737 -22.3737 -22.1449 -22.1449 -22.1272 -22.1272 -22.0192 -22.0192 -21.7324 -21.7324 -21.7162 -21.7162 7.9547 7.9547 10.9173 10.9173 10.9523 10.9523 11.5678 11.5678 14.4280 14.4280 15.3871 15.3871 15.4612 15.4612 15.5918 15.5918 16.3397 16.3397 16.4414 16.4414 16.6553 16.6553 17.4858 17.4858 17.8331 17.8331 18.5126 18.5126 18.5262 18.5262 19.2276 19.2276 19.6313 19.6313 20.9324 20.9324 20.9640 20.9640 21.0883 21.0883 21.3428 21.3428 21.3880 21.3880 k = 0.5000 0.5000 0.3462 ( 5408 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3175 -25.3175 -25.2010 -25.2010 -25.1978 -25.1978 -22.3754 -22.3754 -22.1426 -22.1426 -22.1274 -22.1274 -22.0217 -22.0217 -21.7292 -21.7292 -21.7154 -21.7154 8.0153 8.0153 10.8958 10.8958 10.9304 10.9304 11.4745 11.4745 14.3970 14.3970 15.3732 15.3732 15.4502 15.4502 15.5608 15.5608 16.3443 16.3443 16.4382 16.4382 16.6340 16.6340 17.5089 17.5089 17.8065 17.8065 18.6325 18.6325 18.6440 18.6440 19.3318 19.3318 19.6733 19.6733 20.8977 20.8977 20.9661 20.9661 21.0897 21.0897 21.3318 21.3318 21.3853 21.3853 k = 0.5000 0.5000 0.3590 ( 5416 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3189 -25.3189 -25.2005 -25.2005 -25.1978 -25.1978 -22.3770 -22.3770 -22.1405 -22.1405 -22.1276 -22.1276 -22.0240 -22.0240 -21.7262 -21.7262 -21.7146 -21.7146 8.0755 8.0755 10.8757 10.8757 10.9099 10.9099 11.3836 11.3836 14.3684 14.3684 15.3598 15.3598 15.4398 15.4398 15.5318 15.5318 16.3492 16.3492 16.4345 16.4345 16.6157 16.6157 17.5304 17.5304 17.7817 17.7817 18.7529 18.7529 18.7617 18.7617 19.4343 19.4343 19.7125 19.7125 20.8569 20.8569 20.9426 20.9426 21.1069 21.1069 21.3242 21.3242 21.3826 21.3826 k = 0.5000 0.5000 0.3718 ( 5396 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3202 -25.3202 -25.2000 -25.2000 -25.1978 -25.1978 -22.3785 -22.3785 -22.1385 -22.1385 -22.1278 -22.1278 -22.0261 -22.0261 -21.7235 -21.7235 -21.7138 -21.7138 8.1349 8.1349 10.8571 10.8571 10.8908 10.8908 11.2957 11.2957 14.3422 14.3422 15.3469 15.3469 15.4300 15.4300 15.5051 15.5051 16.3543 16.3543 16.4302 16.4302 16.6004 16.6004 17.5501 17.5501 17.7588 17.7588 18.8735 18.8735 18.8793 18.8793 19.5344 19.5344 19.7487 19.7487 20.8100 20.8100 20.8999 20.8999 21.1330 21.1330 21.3199 21.3199 21.3800 21.3800 k = 0.5000 0.5000 0.3846 ( 5404 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3215 -25.3215 -25.1995 -25.1995 -25.1978 -25.1978 -22.3798 -22.3798 -22.1367 -22.1367 -22.1280 -22.1280 -22.0280 -22.0280 -21.7210 -21.7210 -21.7132 -21.7132 8.1927 8.1927 10.8400 10.8400 10.8732 10.8732 11.2117 11.2117 14.3184 14.3184 15.3346 15.3346 15.4208 15.4208 15.4808 15.4808 16.3593 16.3593 16.4251 16.4251 16.5881 16.5881 17.5682 17.5682 17.7379 17.7379 18.9940 18.9940 18.9964 18.9964 19.6309 19.6309 19.7820 19.7820 20.7569 20.7569 20.8446 20.8446 21.1615 21.1615 21.3185 21.3185 21.3777 21.3777 k = 0.5000 0.5000 0.3974 ( 5412 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3226 -25.3226 -25.1992 -25.1992 -25.1978 -25.1978 -22.3811 -22.3811 -22.1351 -22.1351 -22.1282 -22.1282 -22.0297 -22.0297 -21.7187 -21.7187 -21.7126 -21.7126 8.2483 8.2483 10.8245 10.8245 10.8571 10.8571 11.1325 11.1325 14.2971 14.2971 15.3232 15.3232 15.4124 15.4124 15.4591 15.4591 16.3642 16.3642 16.4194 16.4194 16.5786 16.5786 17.5844 17.5844 17.7190 17.7190 19.1127 19.1127 19.1142 19.1142 19.7227 19.7227 19.8124 19.8124 20.6977 20.6977 20.7801 20.7801 21.1889 21.1889 21.3197 21.3197 21.3757 21.3757 k = 0.5000 0.5000 0.4103 ( 5416 PWs) bands (ev): -52.5686 -52.5686 -52.5685 -52.5685 -52.5685 -52.5685 -25.3236 -25.3236 -25.1988 -25.1988 -25.1977 -25.1977 -22.3821 -22.3821 -22.1337 -22.1337 -22.1284 -22.1284 -22.0313 -22.0313 -21.7167 -21.7167 -21.7120 -21.7120 8.3008 8.3008 10.8107 10.8107 10.8425 10.8425 11.0591 11.0591 14.2783 14.2783 15.3125 15.3125 15.4048 15.4048 15.4400 15.4400 16.3688 16.3688 16.4133 16.4133 16.5715 16.5715 17.5989 17.5989 17.7023 17.7023 19.2278 19.2278 19.2338 19.2338 19.8078 19.8078 19.8405 19.8405 20.6328 20.6328 20.7079 20.7079 21.2135 21.2135 21.3233 21.3233 21.3741 21.3741 k = 0.5000 0.5000 0.4231 ( 5424 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5685 -52.5685 -25.3245 -25.3245 -25.1985 -25.1985 -25.1977 -25.1977 -22.3831 -22.3831 -22.1325 -22.1325 -22.1285 -22.1285 -22.0326 -22.0326 -21.7150 -21.7150 -21.7115 -21.7115 8.3493 8.3493 10.7986 10.7986 10.8293 10.8293 10.9927 10.9927 14.2619 14.2619 15.3029 15.3029 15.3981 15.3981 15.4235 15.4235 16.3731 16.3731 16.4072 16.4072 16.5665 16.5665 17.6115 17.6115 17.6877 17.6877 19.3413 19.3413 19.3525 19.3525 19.8600 19.8600 19.8911 19.8911 20.5625 20.5625 20.6294 20.6294 21.2338 21.2338 21.3293 21.3293 21.3729 21.3729 k = 0.5000 0.5000 0.4359 ( 5432 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3253 -25.3253 -25.1983 -25.1983 -25.1977 -25.1977 -22.3839 -22.3839 -22.1315 -22.1315 -22.1287 -22.1287 -22.0337 -22.0337 -21.7135 -21.7135 -21.7111 -21.7111 8.3929 8.3929 10.7883 10.7883 10.8173 10.8173 10.9346 10.9346 14.2481 14.2481 15.2944 15.2944 15.3923 15.3923 15.4097 15.4097 16.3769 16.3769 16.4014 16.4014 16.5630 16.5630 17.6222 17.6222 17.6752 17.6752 19.4526 19.4526 19.4698 19.4698 19.8816 19.8816 19.9605 19.9605 20.4874 20.4874 20.5454 20.5454 21.2493 21.2493 21.3375 21.3375 21.3719 21.3719 k = 0.5000 0.5000 0.4487 ( 5432 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3259 -25.3259 -25.1981 -25.1981 -25.1977 -25.1977 -22.3845 -22.3845 -22.1306 -22.1306 -22.1288 -22.1288 -22.0346 -22.0346 -21.7123 -21.7123 -21.7108 -21.7108 8.4304 8.4304 10.7799 10.7799 10.8058 10.8058 10.8866 10.8866 14.2367 14.2367 15.2872 15.2872 15.3876 15.3876 15.3985 15.3985 16.3801 16.3801 16.3962 16.3962 16.5607 16.5607 17.6310 17.6310 17.6650 17.6650 19.5607 19.5607 19.5852 19.5852 19.8991 19.8991 20.0210 20.0210 20.4083 20.4083 20.4568 20.4568 21.2602 21.2602 21.3469 21.3469 21.3712 21.3712 k = 0.5000 0.5000 0.4615 ( 5408 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3263 -25.3263 -25.1979 -25.1979 -25.1977 -25.1977 -22.3850 -22.3850 -22.1299 -22.1299 -22.1288 -22.1288 -22.0352 -22.0352 -21.7113 -21.7113 -21.7105 -21.7105 8.4610 8.4610 10.7732 10.7732 10.7936 10.7936 10.8512 10.8512 14.2279 14.2279 15.2814 15.2814 15.3838 15.3838 15.3899 15.3899 16.3826 16.3826 16.3919 16.3919 16.5592 16.5592 17.6379 17.6379 17.6571 17.6571 19.6638 19.6638 19.6979 19.6979 19.9136 19.9136 20.0700 20.0700 20.3267 20.3267 20.3647 20.3647 21.2674 21.2674 21.3560 21.3560 21.3707 21.3707 k = 0.5000 0.5000 0.4744 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3266 -25.3266 -25.1977 -25.1977 -25.1977 -25.1977 -22.3853 -22.3853 -22.1293 -22.1293 -22.1289 -22.1289 -22.0357 -22.0357 -21.7106 -21.7106 -21.7102 -21.7102 8.4836 8.4836 10.7685 10.7685 10.7801 10.7801 10.8297 10.8297 14.2216 14.2216 15.2772 15.2772 15.3811 15.3811 15.3837 15.3837 16.3845 16.3845 16.3887 16.3887 16.5583 16.5583 17.6428 17.6428 17.6514 17.6514 19.7575 19.7575 19.8061 19.8061 19.9268 19.9268 20.1062 20.1062 20.2454 20.2454 20.2711 20.2711 21.2718 21.2718 21.3635 21.3635 21.3703 21.3703 k = 0.5000 0.5000 0.4872 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3268 -25.3268 -25.1977 -25.1977 -25.1977 -25.1977 -22.3855 -22.3855 -22.1290 -22.1290 -22.1289 -22.1289 -22.0360 -22.0360 -21.7102 -21.7102 -21.7101 -21.7101 8.4976 8.4976 10.7656 10.7656 10.7690 10.7690 10.8195 10.8195 14.2178 14.2178 15.2746 15.2746 15.3794 15.3794 15.3801 15.3801 16.3857 16.3857 16.3867 16.3867 16.5579 16.5579 17.6458 17.6458 17.6479 17.6479 19.8296 19.8296 19.9033 19.9033 19.9425 19.9425 20.1283 20.1283 20.1732 20.1732 20.1826 20.1826 21.2742 21.2742 21.3684 21.3684 21.3701 21.3701 k = 0.5000 0.5000 0.5000 ( 5400 PWs) bands (ev): -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -52.5686 -25.3269 -25.3269 -25.1976 -25.1976 -25.1976 -25.1976 -22.3856 -22.3856 -22.1289 -22.1289 -22.1289 -22.1289 -22.0361 -22.0361 -21.7101 -21.7101 -21.7101 -21.7101 8.5023 8.5023 10.7647 10.7647 10.7647 10.7647 10.8166 10.8166 14.2165 14.2165 15.2738 15.2738 15.3789 15.3789 15.3789 15.3789 16.3861 16.3861 16.3861 16.3861 16.5578 16.5578 17.6468 17.6468 17.6468 17.6468 19.8569 19.8569 19.9554 19.9554 19.9554 19.9554 20.1335 20.1335 20.1335 20.1335 20.1405 20.1405 21.2750 21.2750 21.3701 21.3701 21.3701 21.3701 Writing output data file ZrRu3C.save init_run : 0.12s CPU 0.32s WALL ( 1 calls) electrons : 207.00s CPU 211.71s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.06s WALL ( 1 calls) potinit : 0.01s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 207.00s CPU 211.70s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.03s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.08s WALL ( 301 calls) cegterg : 189.79s CPU 193.13s WALL ( 365 calls) Called by sum_band: Called by *egterg: h_psi : 109.80s CPU 111.81s WALL ( 6393 calls) s_psi : 2.36s CPU 2.48s WALL ( 6393 calls) g_psi : 0.30s CPU 0.33s WALL ( 5727 calls) cdiaghg : 67.13s CPU 68.13s WALL ( 6028 calls) cegterg:over : 9.30s CPU 9.42s WALL ( 5727 calls) cegterg:upda : 7.87s CPU 7.84s WALL ( 5727 calls) cegterg:last : 4.30s CPU 4.31s WALL ( 967 calls) cdiaghg:chol : 3.76s CPU 3.86s WALL ( 6028 calls) cdiaghg:inve : 2.88s CPU 2.82s WALL ( 6028 calls) cdiaghg:para : 4.35s CPU 4.70s WALL ( 12056 calls) Called by h_psi: h_psi:vloc : 97.28s CPU 99.08s WALL ( 6393 calls) h_psi:vnl : 12.26s CPU 12.43s WALL ( 6393 calls) add_vuspsi : 6.53s CPU 6.47s WALL ( 6393 calls) General routines calbec : 5.70s CPU 5.94s WALL ( 6393 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 92.58s CPU 94.24s WALL ( 882924 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.10s CPU 0.20s WALL ( 602 calls) Parallel routines fft_scatter : 32.30s CPU 32.63s WALL ( 882947 calls) PWSCF : 3m47.86s CPU 4m10.55s WALL This run was terminated on: 17:40:31 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=