Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:55:41 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 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: ./ZnFe3C.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 37 21 6 1035 427 74 Max 38 22 7 1040 443 77 Sum 1353 757 241 37385 15659 2721 bravais-lattice index = 14 lattice parameter (alat) = 7.1999 a.u. unit-cell volume = 373.2256 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.199856 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 Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Zn read from file: /users/gautes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8d14e5a70806ad8c3d477ea097862760 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1201 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients 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 Fe 8.00 55.84500 Fe( 1.00) Zn 12.00 65.40900 Zn( 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= 322 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031056 k( 2) = ( 0.0000000 0.0119048 -0.0000000), wk = 0.0031056 k( 3) = ( 0.0000000 0.0238095 -0.0000000), wk = 0.0031056 k( 4) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0031056 k( 5) = ( 0.0000000 0.0476191 -0.0000000), wk = 0.0031056 k( 6) = ( 0.0000000 0.0595238 -0.0000000), wk = 0.0031056 k( 7) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0031056 k( 8) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0031056 k( 9) = ( 0.0000000 0.0952381 -0.0000000), wk = 0.0031056 k( 10) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0031056 k( 11) = ( 0.0000000 0.1190476 -0.0000000), wk = 0.0031056 k( 12) = ( 0.0000000 0.1309524 -0.0000000), wk = 0.0031056 k( 13) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0031056 k( 14) = ( 0.0000000 0.1547619 -0.0000000), wk = 0.0031056 k( 15) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0031056 k( 16) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0031056 k( 17) = ( 0.0000000 0.1904762 -0.0000000), wk = 0.0031056 k( 18) = ( 0.0000000 0.2023810 -0.0000000), wk = 0.0031056 k( 19) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0031056 k( 20) = ( 0.0000000 0.2261905 -0.0000000), wk = 0.0031056 k( 21) = ( 0.0000000 0.2380952 -0.0000000), wk = 0.0031056 k( 22) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0031056 k( 23) = ( 0.0000000 0.2619048 -0.0000000), wk = 0.0031056 k( 24) = ( 0.0000000 0.2738095 -0.0000000), wk = 0.0031056 k( 25) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0031056 k( 26) = ( 0.0000000 0.2976190 -0.0000000), wk = 0.0031056 k( 27) = ( 0.0000000 0.3095238 -0.0000000), wk = 0.0031056 k( 28) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0031056 k( 29) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0031056 k( 30) = ( 0.0000000 0.3452381 -0.0000000), wk = 0.0031056 k( 31) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0031056 k( 32) = ( 0.0000000 0.3690476 -0.0000000), wk = 0.0031056 k( 33) = ( 0.0000000 0.3809524 -0.0000000), wk = 0.0031056 k( 34) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0031056 k( 35) = ( 0.0000000 0.4047619 -0.0000000), wk = 0.0031056 k( 36) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0031056 k( 37) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0031056 k( 38) = ( 0.0000000 0.4404762 -0.0000000), wk = 0.0031056 k( 39) = ( 0.0000000 0.4523810 -0.0000000), wk = 0.0031056 k( 40) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0031056 k( 41) = ( 0.0000000 0.4761905 -0.0000000), wk = 0.0031056 k( 42) = ( 0.0000000 0.4880952 -0.0000000), wk = 0.0031056 k( 43) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031056 k( 44) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031056 k( 45) = ( 0.0119048 0.5000000 -0.0000000), wk = 0.0031056 k( 46) = ( 0.0238095 0.5000000 -0.0000000), wk = 0.0031056 k( 47) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0031056 k( 48) = ( 0.0476191 0.5000000 -0.0000000), wk = 0.0031056 k( 49) = ( 0.0595238 0.5000000 -0.0000000), wk = 0.0031056 k( 50) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0031056 k( 51) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0031056 k( 52) = ( 0.0952381 0.5000000 -0.0000000), wk = 0.0031056 k( 53) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0031056 k( 54) = ( 0.1190476 0.5000000 -0.0000000), wk = 0.0031056 k( 55) = ( 0.1309524 0.5000000 -0.0000000), wk = 0.0031056 k( 56) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0031056 k( 57) = ( 0.1547619 0.5000000 -0.0000000), wk = 0.0031056 k( 58) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0031056 k( 59) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0031056 k( 60) = ( 0.1904762 0.5000000 -0.0000000), wk = 0.0031056 k( 61) = ( 0.2023810 0.5000000 -0.0000000), wk = 0.0031056 k( 62) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0031056 k( 63) = ( 0.2261905 0.5000000 -0.0000000), wk = 0.0031056 k( 64) = ( 0.2380952 0.5000000 -0.0000000), wk = 0.0031056 k( 65) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0031056 k( 66) = ( 0.2619048 0.5000000 -0.0000000), wk = 0.0031056 k( 67) = ( 0.2738095 0.5000000 -0.0000000), wk = 0.0031056 k( 68) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0031056 k( 69) = ( 0.2976190 0.5000000 -0.0000000), wk = 0.0031056 k( 70) = ( 0.3095238 0.5000000 -0.0000000), wk = 0.0031056 k( 71) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0031056 k( 72) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0031056 k( 73) = ( 0.3452381 0.5000000 -0.0000000), wk = 0.0031056 k( 74) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0031056 k( 75) = ( 0.3690476 0.5000000 -0.0000000), wk = 0.0031056 k( 76) = ( 0.3809524 0.5000000 -0.0000000), wk = 0.0031056 k( 77) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0031056 k( 78) = ( 0.4047619 0.5000000 -0.0000000), wk = 0.0031056 k( 79) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0031056 k( 80) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0031056 k( 81) = ( 0.4404762 0.5000000 -0.0000000), wk = 0.0031056 k( 82) = ( 0.4523810 0.5000000 -0.0000000), wk = 0.0031056 k( 83) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0031056 k( 84) = ( 0.4761905 0.5000000 -0.0000000), wk = 0.0031056 k( 85) = ( 0.4880952 0.5000000 -0.0000000), wk = 0.0031056 k( 86) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031056 k( 87) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031056 k( 88) = ( 0.4915254 0.4915254 -0.0000000), wk = 0.0031056 k( 89) = ( 0.4830508 0.4830508 -0.0000000), wk = 0.0031056 k( 90) = ( 0.4745763 0.4745763 -0.0000000), wk = 0.0031056 k( 91) = ( 0.4661017 0.4661017 -0.0000000), wk = 0.0031056 k( 92) = ( 0.4576271 0.4576271 -0.0000000), wk = 0.0031056 k( 93) = ( 0.4491525 0.4491525 -0.0000000), wk = 0.0031056 k( 94) = ( 0.4406780 0.4406780 -0.0000000), wk = 0.0031056 k( 95) = ( 0.4322034 0.4322034 -0.0000000), wk = 0.0031056 k( 96) = ( 0.4237288 0.4237288 -0.0000000), wk = 0.0031056 k( 97) = ( 0.4152542 0.4152542 -0.0000000), wk = 0.0031056 k( 98) = ( 0.4067797 0.4067797 -0.0000000), wk = 0.0031056 k( 99) = ( 0.3983051 0.3983051 -0.0000000), wk = 0.0031056 k( 100) = ( 0.3898305 0.3898305 -0.0000000), wk = 0.0031056 k( 101) = ( 0.3813559 0.3813559 -0.0000000), wk = 0.0031056 k( 102) = ( 0.3728814 0.3728814 -0.0000000), wk = 0.0031056 k( 103) = ( 0.3644068 0.3644068 -0.0000000), wk = 0.0031056 k( 104) = ( 0.3559322 0.3559322 -0.0000000), wk = 0.0031056 k( 105) = ( 0.3474576 0.3474576 -0.0000000), wk = 0.0031056 k( 106) = ( 0.3389831 0.3389830 -0.0000000), wk = 0.0031056 k( 107) = ( 0.3305085 0.3305085 -0.0000000), wk = 0.0031056 k( 108) = ( 0.3220339 0.3220339 -0.0000000), wk = 0.0031056 k( 109) = ( 0.3135593 0.3135593 -0.0000000), wk = 0.0031056 k( 110) = ( 0.3050848 0.3050847 -0.0000000), wk = 0.0031056 k( 111) = ( 0.2966102 0.2966102 -0.0000000), wk = 0.0031056 k( 112) = ( 0.2881356 0.2881356 -0.0000000), wk = 0.0031056 k( 113) = ( 0.2796610 0.2796610 -0.0000000), wk = 0.0031056 k( 114) = ( 0.2711864 0.2711864 -0.0000000), wk = 0.0031056 k( 115) = ( 0.2627119 0.2627119 -0.0000000), wk = 0.0031056 k( 116) = ( 0.2542373 0.2542373 -0.0000000), wk = 0.0031056 k( 117) = ( 0.2457627 0.2457627 -0.0000000), wk = 0.0031056 k( 118) = ( 0.2372881 0.2372881 -0.0000000), wk = 0.0031056 k( 119) = ( 0.2288136 0.2288136 -0.0000000), wk = 0.0031056 k( 120) = ( 0.2203390 0.2203390 -0.0000000), wk = 0.0031056 k( 121) = ( 0.2118644 0.2118644 -0.0000000), wk = 0.0031056 k( 122) = ( 0.2033898 0.2033898 -0.0000000), wk = 0.0031056 k( 123) = ( 0.1949153 0.1949152 -0.0000000), wk = 0.0031056 k( 124) = ( 0.1864407 0.1864407 -0.0000000), wk = 0.0031056 k( 125) = ( 0.1779661 0.1779661 -0.0000000), wk = 0.0031056 k( 126) = ( 0.1694915 0.1694915 -0.0000000), wk = 0.0031056 k( 127) = ( 0.1610169 0.1610169 -0.0000000), wk = 0.0031056 k( 128) = ( 0.1525424 0.1525424 -0.0000000), wk = 0.0031056 k( 129) = ( 0.1440678 0.1440678 -0.0000000), wk = 0.0031056 k( 130) = ( 0.1355932 0.1355932 -0.0000000), wk = 0.0031056 k( 131) = ( 0.1271186 0.1271186 -0.0000000), wk = 0.0031056 k( 132) = ( 0.1186441 0.1186441 -0.0000000), wk = 0.0031056 k( 133) = ( 0.1101695 0.1101695 -0.0000000), wk = 0.0031056 k( 134) = ( 0.1016949 0.1016949 -0.0000000), wk = 0.0031056 k( 135) = ( 0.0932203 0.0932203 -0.0000000), wk = 0.0031056 k( 136) = ( 0.0847458 0.0847458 -0.0000000), wk = 0.0031056 k( 137) = ( 0.0762712 0.0762712 -0.0000000), wk = 0.0031056 k( 138) = ( 0.0677966 0.0677966 -0.0000000), wk = 0.0031056 k( 139) = ( 0.0593220 0.0593220 -0.0000000), wk = 0.0031056 k( 140) = ( 0.0508475 0.0508475 -0.0000000), wk = 0.0031056 k( 141) = ( 0.0423729 0.0423729 -0.0000000), wk = 0.0031056 k( 142) = ( 0.0338983 0.0338983 -0.0000000), wk = 0.0031056 k( 143) = ( 0.0254237 0.0254237 -0.0000000), wk = 0.0031056 k( 144) = ( 0.0169491 0.0169491 -0.0000000), wk = 0.0031056 k( 145) = ( 0.0084746 0.0084746 -0.0000000), wk = 0.0031056 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031056 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031056 k( 148) = ( 0.0069444 0.0069444 0.0069444), wk = 0.0031056 k( 149) = ( 0.0138889 0.0138889 0.0138889), wk = 0.0031056 k( 150) = ( 0.0208333 0.0208333 0.0208333), wk = 0.0031056 k( 151) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0031056 k( 152) = ( 0.0347222 0.0347222 0.0347222), wk = 0.0031056 k( 153) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0031056 k( 154) = ( 0.0486111 0.0486111 0.0486111), wk = 0.0031056 k( 155) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0031056 k( 156) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0031056 k( 157) = ( 0.0694444 0.0694444 0.0694444), wk = 0.0031056 k( 158) = ( 0.0763889 0.0763889 0.0763889), wk = 0.0031056 k( 159) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0031056 k( 160) = ( 0.0902778 0.0902778 0.0902778), wk = 0.0031056 k( 161) = ( 0.0972222 0.0972222 0.0972222), wk = 0.0031056 k( 162) = ( 0.1041667 0.1041667 0.1041667), wk = 0.0031056 k( 163) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0031056 k( 164) = ( 0.1180556 0.1180556 0.1180556), wk = 0.0031056 k( 165) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0031056 k( 166) = ( 0.1319444 0.1319444 0.1319444), wk = 0.0031056 k( 167) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0031056 k( 168) = ( 0.1458333 0.1458333 0.1458333), wk = 0.0031056 k( 169) = ( 0.1527778 0.1527778 0.1527778), wk = 0.0031056 k( 170) = ( 0.1597222 0.1597222 0.1597222), wk = 0.0031056 k( 171) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0031056 k( 172) = ( 0.1736111 0.1736111 0.1736111), wk = 0.0031056 k( 173) = ( 0.1805556 0.1805556 0.1805556), wk = 0.0031056 k( 174) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0031056 k( 175) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0031056 k( 176) = ( 0.2013889 0.2013889 0.2013889), wk = 0.0031056 k( 177) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0031056 k( 178) = ( 0.2152778 0.2152778 0.2152778), wk = 0.0031056 k( 179) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0031056 k( 180) = ( 0.2291667 0.2291667 0.2291667), wk = 0.0031056 k( 181) = ( 0.2361111 0.2361111 0.2361111), wk = 0.0031056 k( 182) = ( 0.2430556 0.2430556 0.2430556), wk = 0.0031056 k( 183) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0031056 k( 184) = ( 0.2569444 0.2569444 0.2569444), wk = 0.0031056 k( 185) = ( 0.2638889 0.2638889 0.2638889), wk = 0.0031056 k( 186) = ( 0.2708333 0.2708333 0.2708333), wk = 0.0031056 k( 187) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0031056 k( 188) = ( 0.2847222 0.2847222 0.2847222), wk = 0.0031056 k( 189) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0031056 k( 190) = ( 0.2986111 0.2986111 0.2986111), wk = 0.0031056 k( 191) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0031056 k( 192) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0031056 k( 193) = ( 0.3194444 0.3194444 0.3194444), wk = 0.0031056 k( 194) = ( 0.3263889 0.3263889 0.3263889), wk = 0.0031056 k( 195) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0031056 k( 196) = ( 0.3402778 0.3402778 0.3402778), wk = 0.0031056 k( 197) = ( 0.3472222 0.3472222 0.3472222), wk = 0.0031056 k( 198) = ( 0.3541667 0.3541667 0.3541667), wk = 0.0031056 k( 199) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0031056 k( 200) = ( 0.3680556 0.3680556 0.3680556), wk = 0.0031056 k( 201) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0031056 k( 202) = ( 0.3819444 0.3819444 0.3819444), wk = 0.0031056 k( 203) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0031056 k( 204) = ( 0.3958333 0.3958333 0.3958333), wk = 0.0031056 k( 205) = ( 0.4027778 0.4027778 0.4027778), wk = 0.0031056 k( 206) = ( 0.4097222 0.4097222 0.4097222), wk = 0.0031056 k( 207) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0031056 k( 208) = ( 0.4236111 0.4236111 0.4236111), wk = 0.0031056 k( 209) = ( 0.4305556 0.4305556 0.4305556), wk = 0.0031056 k( 210) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0031056 k( 211) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0031056 k( 212) = ( 0.4513889 0.4513889 0.4513889), wk = 0.0031056 k( 213) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0031056 k( 214) = ( 0.4652778 0.4652778 0.4652778), wk = 0.0031056 k( 215) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0031056 k( 216) = ( 0.4791667 0.4791667 0.4791667), wk = 0.0031056 k( 217) = ( 0.4861111 0.4861111 0.4861111), wk = 0.0031056 k( 218) = ( 0.4930556 0.4930556 0.4930556), wk = 0.0031056 k( 219) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031056 k( 220) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031056 k( 221) = ( 0.4915254 0.5000000 0.4915254), wk = 0.0031056 k( 222) = ( 0.4830508 0.5000000 0.4830508), wk = 0.0031056 k( 223) = ( 0.4745763 0.5000000 0.4745763), wk = 0.0031056 k( 224) = ( 0.4661017 0.5000000 0.4661017), wk = 0.0031056 k( 225) = ( 0.4576271 0.5000000 0.4576271), wk = 0.0031056 k( 226) = ( 0.4491525 0.5000000 0.4491525), wk = 0.0031056 k( 227) = ( 0.4406780 0.5000000 0.4406780), wk = 0.0031056 k( 228) = ( 0.4322034 0.5000000 0.4322034), wk = 0.0031056 k( 229) = ( 0.4237288 0.5000000 0.4237288), wk = 0.0031056 k( 230) = ( 0.4152542 0.5000000 0.4152542), wk = 0.0031056 k( 231) = ( 0.4067797 0.5000000 0.4067797), wk = 0.0031056 k( 232) = ( 0.3983051 0.5000000 0.3983051), wk = 0.0031056 k( 233) = ( 0.3898305 0.5000000 0.3898305), wk = 0.0031056 k( 234) = ( 0.3813559 0.5000000 0.3813559), wk = 0.0031056 k( 235) = ( 0.3728814 0.5000000 0.3728814), wk = 0.0031056 k( 236) = ( 0.3644068 0.5000000 0.3644068), wk = 0.0031056 k( 237) = ( 0.3559322 0.5000000 0.3559322), wk = 0.0031056 k( 238) = ( 0.3474576 0.5000000 0.3474576), wk = 0.0031056 k( 239) = ( 0.3389831 0.5000000 0.3389830), wk = 0.0031056 k( 240) = ( 0.3305085 0.5000000 0.3305085), wk = 0.0031056 k( 241) = ( 0.3220339 0.5000000 0.3220339), wk = 0.0031056 k( 242) = ( 0.3135593 0.5000000 0.3135593), wk = 0.0031056 k( 243) = ( 0.3050848 0.5000000 0.3050847), wk = 0.0031056 k( 244) = ( 0.2966102 0.5000000 0.2966102), wk = 0.0031056 k( 245) = ( 0.2881356 0.5000000 0.2881356), wk = 0.0031056 k( 246) = ( 0.2796610 0.5000000 0.2796610), wk = 0.0031056 k( 247) = ( 0.2711864 0.5000000 0.2711864), wk = 0.0031056 k( 248) = ( 0.2627119 0.5000000 0.2627119), wk = 0.0031056 k( 249) = ( 0.2542373 0.5000000 0.2542373), wk = 0.0031056 k( 250) = ( 0.2457627 0.5000000 0.2457627), wk = 0.0031056 k( 251) = ( 0.2372881 0.5000000 0.2372881), wk = 0.0031056 k( 252) = ( 0.2288136 0.5000000 0.2288136), wk = 0.0031056 k( 253) = ( 0.2203390 0.5000000 0.2203390), wk = 0.0031056 k( 254) = ( 0.2118644 0.5000000 0.2118644), wk = 0.0031056 k( 255) = ( 0.2033898 0.5000000 0.2033898), wk = 0.0031056 k( 256) = ( 0.1949153 0.5000000 0.1949152), wk = 0.0031056 k( 257) = ( 0.1864407 0.5000000 0.1864407), wk = 0.0031056 k( 258) = ( 0.1779661 0.5000000 0.1779661), wk = 0.0031056 k( 259) = ( 0.1694915 0.5000000 0.1694915), wk = 0.0031056 k( 260) = ( 0.1610169 0.5000000 0.1610169), wk = 0.0031056 k( 261) = ( 0.1525424 0.5000000 0.1525424), wk = 0.0031056 k( 262) = ( 0.1440678 0.5000000 0.1440678), wk = 0.0031056 k( 263) = ( 0.1355932 0.5000000 0.1355932), wk = 0.0031056 k( 264) = ( 0.1271186 0.5000000 0.1271186), wk = 0.0031056 k( 265) = ( 0.1186441 0.5000000 0.1186441), wk = 0.0031056 k( 266) = ( 0.1101695 0.5000000 0.1101695), wk = 0.0031056 k( 267) = ( 0.1016949 0.5000000 0.1016949), wk = 0.0031056 k( 268) = ( 0.0932203 0.5000000 0.0932203), wk = 0.0031056 k( 269) = ( 0.0847458 0.5000000 0.0847458), wk = 0.0031056 k( 270) = ( 0.0762712 0.5000000 0.0762712), wk = 0.0031056 k( 271) = ( 0.0677966 0.5000000 0.0677966), wk = 0.0031056 k( 272) = ( 0.0593220 0.5000000 0.0593220), wk = 0.0031056 k( 273) = ( 0.0508475 0.5000000 0.0508475), wk = 0.0031056 k( 274) = ( 0.0423729 0.5000000 0.0423729), wk = 0.0031056 k( 275) = ( 0.0338983 0.5000000 0.0338983), wk = 0.0031056 k( 276) = ( 0.0254237 0.5000000 0.0254237), wk = 0.0031056 k( 277) = ( 0.0169491 0.5000000 0.0169491), wk = 0.0031056 k( 278) = ( 0.0084746 0.5000000 0.0084746), wk = 0.0031056 k( 279) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031056 k( 280) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031056 k( 281) = ( 0.5000000 0.5000000 0.0119048), wk = 0.0031056 k( 282) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0031056 k( 283) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0031056 k( 284) = ( 0.5000000 0.5000000 0.0476190), wk = 0.0031056 k( 285) = ( 0.5000000 0.5000000 0.0595238), wk = 0.0031056 k( 286) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0031056 k( 287) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0031056 k( 288) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0031056 k( 289) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0031056 k( 290) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0031056 k( 291) = ( 0.5000000 0.5000000 0.1309524), wk = 0.0031056 k( 292) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0031056 k( 293) = ( 0.5000000 0.5000000 0.1547619), wk = 0.0031056 k( 294) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0031056 k( 295) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0031056 k( 296) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0031056 k( 297) = ( 0.5000000 0.5000000 0.2023809), wk = 0.0031056 k( 298) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0031056 k( 299) = ( 0.5000000 0.5000000 0.2261905), wk = 0.0031056 k( 300) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0031056 k( 301) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0031056 k( 302) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0031056 k( 303) = ( 0.5000000 0.5000000 0.2738095), wk = 0.0031056 k( 304) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0031056 k( 305) = ( 0.5000000 0.5000000 0.2976190), wk = 0.0031056 k( 306) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0031056 k( 307) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0031056 k( 308) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0031056 k( 309) = ( 0.5000000 0.5000000 0.3452381), wk = 0.0031056 k( 310) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0031056 k( 311) = ( 0.5000000 0.5000000 0.3690476), wk = 0.0031056 k( 312) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0031056 k( 313) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0031056 k( 314) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0031056 k( 315) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0031056 k( 316) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0031056 k( 317) = ( 0.5000000 0.5000000 0.4404762), wk = 0.0031056 k( 318) = ( 0.5000000 0.5000000 0.4523809), wk = 0.0031056 k( 319) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0031056 k( 320) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0031056 k( 321) = ( 0.5000000 0.5000000 0.4880952), wk = 0.0031056 k( 322) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031056 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031056 k( 2) = ( 0.0000000 0.0119048 0.0000000), wk = 0.0031056 k( 3) = ( 0.0000000 0.0238095 0.0000000), wk = 0.0031056 k( 4) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0031056 k( 5) = ( 0.0000000 0.0476191 0.0000000), wk = 0.0031056 k( 6) = ( 0.0000000 0.0595238 0.0000000), wk = 0.0031056 k( 7) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0031056 k( 8) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0031056 k( 9) = ( 0.0000000 0.0952381 0.0000000), wk = 0.0031056 k( 10) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0031056 k( 11) = ( 0.0000000 0.1190476 0.0000000), wk = 0.0031056 k( 12) = ( 0.0000000 0.1309524 0.0000000), wk = 0.0031056 k( 13) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0031056 k( 14) = ( 0.0000000 0.1547619 0.0000000), wk = 0.0031056 k( 15) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0031056 k( 16) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0031056 k( 17) = ( 0.0000000 0.1904762 0.0000000), wk = 0.0031056 k( 18) = ( 0.0000000 0.2023810 0.0000000), wk = 0.0031056 k( 19) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0031056 k( 20) = ( 0.0000000 0.2261905 0.0000000), wk = 0.0031056 k( 21) = ( 0.0000000 0.2380952 0.0000000), wk = 0.0031056 k( 22) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0031056 k( 23) = ( 0.0000000 0.2619048 0.0000000), wk = 0.0031056 k( 24) = ( 0.0000000 0.2738095 0.0000000), wk = 0.0031056 k( 25) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0031056 k( 26) = ( 0.0000000 0.2976190 0.0000000), wk = 0.0031056 k( 27) = ( 0.0000000 0.3095238 0.0000000), wk = 0.0031056 k( 28) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0031056 k( 29) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0031056 k( 30) = ( 0.0000000 0.3452381 0.0000000), wk = 0.0031056 k( 31) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0031056 k( 32) = ( 0.0000000 0.3690476 0.0000000), wk = 0.0031056 k( 33) = ( 0.0000000 0.3809524 0.0000000), wk = 0.0031056 k( 34) = ( 0.0000000 0.3928571 0.0000000), wk = 0.0031056 k( 35) = ( 0.0000000 0.4047619 0.0000000), wk = 0.0031056 k( 36) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0031056 k( 37) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0031056 k( 38) = ( 0.0000000 0.4404762 0.0000000), wk = 0.0031056 k( 39) = ( 0.0000000 0.4523810 0.0000000), wk = 0.0031056 k( 40) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0031056 k( 41) = ( 0.0000000 0.4761905 0.0000000), wk = 0.0031056 k( 42) = ( 0.0000000 0.4880952 0.0000000), wk = 0.0031056 k( 43) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031056 k( 44) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031056 k( 45) = ( 0.0119048 0.5000000 0.0000000), wk = 0.0031056 k( 46) = ( 0.0238095 0.5000000 0.0000000), wk = 0.0031056 k( 47) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0031056 k( 48) = ( 0.0476191 0.5000000 0.0000000), wk = 0.0031056 k( 49) = ( 0.0595238 0.5000000 0.0000000), wk = 0.0031056 k( 50) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0031056 k( 51) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0031056 k( 52) = ( 0.0952381 0.5000000 0.0000000), wk = 0.0031056 k( 53) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0031056 k( 54) = ( 0.1190476 0.5000000 0.0000000), wk = 0.0031056 k( 55) = ( 0.1309524 0.5000000 0.0000000), wk = 0.0031056 k( 56) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0031056 k( 57) = ( 0.1547619 0.5000000 0.0000000), wk = 0.0031056 k( 58) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0031056 k( 59) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0031056 k( 60) = ( 0.1904762 0.5000000 0.0000000), wk = 0.0031056 k( 61) = ( 0.2023810 0.5000000 0.0000000), wk = 0.0031056 k( 62) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0031056 k( 63) = ( 0.2261905 0.5000000 0.0000000), wk = 0.0031056 k( 64) = ( 0.2380952 0.5000000 0.0000000), wk = 0.0031056 k( 65) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0031056 k( 66) = ( 0.2619048 0.5000000 0.0000000), wk = 0.0031056 k( 67) = ( 0.2738095 0.5000000 0.0000000), wk = 0.0031056 k( 68) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0031056 k( 69) = ( 0.2976190 0.5000000 0.0000000), wk = 0.0031056 k( 70) = ( 0.3095238 0.5000000 0.0000000), wk = 0.0031056 k( 71) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0031056 k( 72) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0031056 k( 73) = ( 0.3452381 0.5000000 0.0000000), wk = 0.0031056 k( 74) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0031056 k( 75) = ( 0.3690476 0.5000000 0.0000000), wk = 0.0031056 k( 76) = ( 0.3809524 0.5000000 0.0000000), wk = 0.0031056 k( 77) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0031056 k( 78) = ( 0.4047619 0.5000000 0.0000000), wk = 0.0031056 k( 79) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0031056 k( 80) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0031056 k( 81) = ( 0.4404762 0.5000000 0.0000000), wk = 0.0031056 k( 82) = ( 0.4523810 0.5000000 0.0000000), wk = 0.0031056 k( 83) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0031056 k( 84) = ( 0.4761905 0.5000000 0.0000000), wk = 0.0031056 k( 85) = ( 0.4880952 0.5000000 0.0000000), wk = 0.0031056 k( 86) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031056 k( 87) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031056 k( 88) = ( 0.4915254 0.4915254 0.0000000), wk = 0.0031056 k( 89) = ( 0.4830508 0.4830508 0.0000000), wk = 0.0031056 k( 90) = ( 0.4745763 0.4745763 0.0000000), wk = 0.0031056 k( 91) = ( 0.4661017 0.4661017 0.0000000), wk = 0.0031056 k( 92) = ( 0.4576271 0.4576271 0.0000000), wk = 0.0031056 k( 93) = ( 0.4491525 0.4491525 0.0000000), wk = 0.0031056 k( 94) = ( 0.4406780 0.4406780 0.0000000), wk = 0.0031056 k( 95) = ( 0.4322034 0.4322034 0.0000000), wk = 0.0031056 k( 96) = ( 0.4237288 0.4237288 0.0000000), wk = 0.0031056 k( 97) = ( 0.4152542 0.4152542 0.0000000), wk = 0.0031056 k( 98) = ( 0.4067797 0.4067797 0.0000000), wk = 0.0031056 k( 99) = ( 0.3983051 0.3983051 0.0000000), wk = 0.0031056 k( 100) = ( 0.3898305 0.3898305 0.0000000), wk = 0.0031056 k( 101) = ( 0.3813559 0.3813559 0.0000000), wk = 0.0031056 k( 102) = ( 0.3728814 0.3728814 0.0000000), wk = 0.0031056 k( 103) = ( 0.3644068 0.3644068 0.0000000), wk = 0.0031056 k( 104) = ( 0.3559322 0.3559322 0.0000000), wk = 0.0031056 k( 105) = ( 0.3474576 0.3474576 0.0000000), wk = 0.0031056 k( 106) = ( 0.3389831 0.3389831 0.0000000), wk = 0.0031056 k( 107) = ( 0.3305085 0.3305085 0.0000000), wk = 0.0031056 k( 108) = ( 0.3220339 0.3220339 0.0000000), wk = 0.0031056 k( 109) = ( 0.3135593 0.3135593 0.0000000), wk = 0.0031056 k( 110) = ( 0.3050848 0.3050848 0.0000000), wk = 0.0031056 k( 111) = ( 0.2966102 0.2966102 0.0000000), wk = 0.0031056 k( 112) = ( 0.2881356 0.2881356 0.0000000), wk = 0.0031056 k( 113) = ( 0.2796610 0.2796610 0.0000000), wk = 0.0031056 k( 114) = ( 0.2711864 0.2711864 0.0000000), wk = 0.0031056 k( 115) = ( 0.2627119 0.2627119 0.0000000), wk = 0.0031056 k( 116) = ( 0.2542373 0.2542373 0.0000000), wk = 0.0031056 k( 117) = ( 0.2457627 0.2457627 0.0000000), wk = 0.0031056 k( 118) = ( 0.2372881 0.2372881 0.0000000), wk = 0.0031056 k( 119) = ( 0.2288136 0.2288136 0.0000000), wk = 0.0031056 k( 120) = ( 0.2203390 0.2203390 0.0000000), wk = 0.0031056 k( 121) = ( 0.2118644 0.2118644 0.0000000), wk = 0.0031056 k( 122) = ( 0.2033898 0.2033898 0.0000000), wk = 0.0031056 k( 123) = ( 0.1949153 0.1949153 0.0000000), wk = 0.0031056 k( 124) = ( 0.1864407 0.1864407 0.0000000), wk = 0.0031056 k( 125) = ( 0.1779661 0.1779661 0.0000000), wk = 0.0031056 k( 126) = ( 0.1694915 0.1694915 0.0000000), wk = 0.0031056 k( 127) = ( 0.1610169 0.1610169 0.0000000), wk = 0.0031056 k( 128) = ( 0.1525424 0.1525424 0.0000000), wk = 0.0031056 k( 129) = ( 0.1440678 0.1440678 0.0000000), wk = 0.0031056 k( 130) = ( 0.1355932 0.1355932 0.0000000), wk = 0.0031056 k( 131) = ( 0.1271186 0.1271186 0.0000000), wk = 0.0031056 k( 132) = ( 0.1186441 0.1186441 0.0000000), wk = 0.0031056 k( 133) = ( 0.1101695 0.1101695 0.0000000), wk = 0.0031056 k( 134) = ( 0.1016949 0.1016949 0.0000000), wk = 0.0031056 k( 135) = ( 0.0932203 0.0932203 0.0000000), wk = 0.0031056 k( 136) = ( 0.0847458 0.0847458 0.0000000), wk = 0.0031056 k( 137) = ( 0.0762712 0.0762712 0.0000000), wk = 0.0031056 k( 138) = ( 0.0677966 0.0677966 0.0000000), wk = 0.0031056 k( 139) = ( 0.0593220 0.0593220 0.0000000), wk = 0.0031056 k( 140) = ( 0.0508475 0.0508475 0.0000000), wk = 0.0031056 k( 141) = ( 0.0423729 0.0423729 0.0000000), wk = 0.0031056 k( 142) = ( 0.0338983 0.0338983 0.0000000), wk = 0.0031056 k( 143) = ( 0.0254237 0.0254237 0.0000000), wk = 0.0031056 k( 144) = ( 0.0169491 0.0169491 0.0000000), wk = 0.0031056 k( 145) = ( 0.0084746 0.0084746 0.0000000), wk = 0.0031056 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031056 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031056 k( 148) = ( 0.0069444 0.0069444 0.0069444), wk = 0.0031056 k( 149) = ( 0.0138889 0.0138889 0.0138889), wk = 0.0031056 k( 150) = ( 0.0208333 0.0208333 0.0208333), wk = 0.0031056 k( 151) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0031056 k( 152) = ( 0.0347222 0.0347222 0.0347222), wk = 0.0031056 k( 153) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0031056 k( 154) = ( 0.0486111 0.0486111 0.0486111), wk = 0.0031056 k( 155) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0031056 k( 156) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0031056 k( 157) = ( 0.0694444 0.0694444 0.0694444), wk = 0.0031056 k( 158) = ( 0.0763889 0.0763889 0.0763889), wk = 0.0031056 k( 159) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0031056 k( 160) = ( 0.0902778 0.0902778 0.0902778), wk = 0.0031056 k( 161) = ( 0.0972222 0.0972222 0.0972222), wk = 0.0031056 k( 162) = ( 0.1041667 0.1041667 0.1041667), wk = 0.0031056 k( 163) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0031056 k( 164) = ( 0.1180556 0.1180556 0.1180556), wk = 0.0031056 k( 165) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0031056 k( 166) = ( 0.1319444 0.1319444 0.1319444), wk = 0.0031056 k( 167) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0031056 k( 168) = ( 0.1458333 0.1458333 0.1458333), wk = 0.0031056 k( 169) = ( 0.1527778 0.1527778 0.1527778), wk = 0.0031056 k( 170) = ( 0.1597222 0.1597222 0.1597222), wk = 0.0031056 k( 171) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0031056 k( 172) = ( 0.1736111 0.1736111 0.1736111), wk = 0.0031056 k( 173) = ( 0.1805556 0.1805556 0.1805556), wk = 0.0031056 k( 174) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0031056 k( 175) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0031056 k( 176) = ( 0.2013889 0.2013889 0.2013889), wk = 0.0031056 k( 177) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0031056 k( 178) = ( 0.2152778 0.2152778 0.2152778), wk = 0.0031056 k( 179) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0031056 k( 180) = ( 0.2291667 0.2291667 0.2291667), wk = 0.0031056 k( 181) = ( 0.2361111 0.2361111 0.2361111), wk = 0.0031056 k( 182) = ( 0.2430556 0.2430556 0.2430556), wk = 0.0031056 k( 183) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0031056 k( 184) = ( 0.2569444 0.2569444 0.2569444), wk = 0.0031056 k( 185) = ( 0.2638889 0.2638889 0.2638889), wk = 0.0031056 k( 186) = ( 0.2708333 0.2708333 0.2708333), wk = 0.0031056 k( 187) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0031056 k( 188) = ( 0.2847222 0.2847222 0.2847222), wk = 0.0031056 k( 189) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0031056 k( 190) = ( 0.2986111 0.2986111 0.2986111), wk = 0.0031056 k( 191) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0031056 k( 192) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0031056 k( 193) = ( 0.3194444 0.3194444 0.3194444), wk = 0.0031056 k( 194) = ( 0.3263889 0.3263889 0.3263889), wk = 0.0031056 k( 195) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0031056 k( 196) = ( 0.3402778 0.3402778 0.3402778), wk = 0.0031056 k( 197) = ( 0.3472222 0.3472222 0.3472222), wk = 0.0031056 k( 198) = ( 0.3541667 0.3541667 0.3541667), wk = 0.0031056 k( 199) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0031056 k( 200) = ( 0.3680556 0.3680556 0.3680556), wk = 0.0031056 k( 201) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0031056 k( 202) = ( 0.3819444 0.3819444 0.3819444), wk = 0.0031056 k( 203) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0031056 k( 204) = ( 0.3958333 0.3958333 0.3958333), wk = 0.0031056 k( 205) = ( 0.4027778 0.4027778 0.4027778), wk = 0.0031056 k( 206) = ( 0.4097222 0.4097222 0.4097222), wk = 0.0031056 k( 207) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0031056 k( 208) = ( 0.4236111 0.4236111 0.4236111), wk = 0.0031056 k( 209) = ( 0.4305556 0.4305556 0.4305556), wk = 0.0031056 k( 210) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0031056 k( 211) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0031056 k( 212) = ( 0.4513889 0.4513889 0.4513889), wk = 0.0031056 k( 213) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0031056 k( 214) = ( 0.4652778 0.4652778 0.4652778), wk = 0.0031056 k( 215) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0031056 k( 216) = ( 0.4791667 0.4791667 0.4791667), wk = 0.0031056 k( 217) = ( 0.4861111 0.4861111 0.4861111), wk = 0.0031056 k( 218) = ( 0.4930556 0.4930556 0.4930556), wk = 0.0031056 k( 219) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031056 k( 220) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031056 k( 221) = ( 0.4915254 0.5000000 0.4915254), wk = 0.0031056 k( 222) = ( 0.4830508 0.5000000 0.4830508), wk = 0.0031056 k( 223) = ( 0.4745763 0.5000000 0.4745763), wk = 0.0031056 k( 224) = ( 0.4661017 0.5000000 0.4661017), wk = 0.0031056 k( 225) = ( 0.4576271 0.5000000 0.4576271), wk = 0.0031056 k( 226) = ( 0.4491525 0.5000000 0.4491525), wk = 0.0031056 k( 227) = ( 0.4406780 0.5000000 0.4406780), wk = 0.0031056 k( 228) = ( 0.4322034 0.5000000 0.4322034), wk = 0.0031056 k( 229) = ( 0.4237288 0.5000000 0.4237288), wk = 0.0031056 k( 230) = ( 0.4152542 0.5000000 0.4152542), wk = 0.0031056 k( 231) = ( 0.4067797 0.5000000 0.4067797), wk = 0.0031056 k( 232) = ( 0.3983051 0.5000000 0.3983051), wk = 0.0031056 k( 233) = ( 0.3898305 0.5000000 0.3898305), wk = 0.0031056 k( 234) = ( 0.3813559 0.5000000 0.3813559), wk = 0.0031056 k( 235) = ( 0.3728814 0.5000000 0.3728814), wk = 0.0031056 k( 236) = ( 0.3644068 0.5000000 0.3644068), wk = 0.0031056 k( 237) = ( 0.3559322 0.5000000 0.3559322), wk = 0.0031056 k( 238) = ( 0.3474576 0.5000000 0.3474576), wk = 0.0031056 k( 239) = ( 0.3389831 0.5000000 0.3389831), wk = 0.0031056 k( 240) = ( 0.3305085 0.5000000 0.3305085), wk = 0.0031056 k( 241) = ( 0.3220339 0.5000000 0.3220339), wk = 0.0031056 k( 242) = ( 0.3135593 0.5000000 0.3135593), wk = 0.0031056 k( 243) = ( 0.3050848 0.5000000 0.3050848), wk = 0.0031056 k( 244) = ( 0.2966102 0.5000000 0.2966102), wk = 0.0031056 k( 245) = ( 0.2881356 0.5000000 0.2881356), wk = 0.0031056 k( 246) = ( 0.2796610 0.5000000 0.2796610), wk = 0.0031056 k( 247) = ( 0.2711864 0.5000000 0.2711864), wk = 0.0031056 k( 248) = ( 0.2627119 0.5000000 0.2627119), wk = 0.0031056 k( 249) = ( 0.2542373 0.5000000 0.2542373), wk = 0.0031056 k( 250) = ( 0.2457627 0.5000000 0.2457627), wk = 0.0031056 k( 251) = ( 0.2372881 0.5000000 0.2372881), wk = 0.0031056 k( 252) = ( 0.2288136 0.5000000 0.2288136), wk = 0.0031056 k( 253) = ( 0.2203390 0.5000000 0.2203390), wk = 0.0031056 k( 254) = ( 0.2118644 0.5000000 0.2118644), wk = 0.0031056 k( 255) = ( 0.2033898 0.5000000 0.2033898), wk = 0.0031056 k( 256) = ( 0.1949153 0.5000000 0.1949153), wk = 0.0031056 k( 257) = ( 0.1864407 0.5000000 0.1864407), wk = 0.0031056 k( 258) = ( 0.1779661 0.5000000 0.1779661), wk = 0.0031056 k( 259) = ( 0.1694915 0.5000000 0.1694915), wk = 0.0031056 k( 260) = ( 0.1610169 0.5000000 0.1610169), wk = 0.0031056 k( 261) = ( 0.1525424 0.5000000 0.1525424), wk = 0.0031056 k( 262) = ( 0.1440678 0.5000000 0.1440678), wk = 0.0031056 k( 263) = ( 0.1355932 0.5000000 0.1355932), wk = 0.0031056 k( 264) = ( 0.1271186 0.5000000 0.1271186), wk = 0.0031056 k( 265) = ( 0.1186441 0.5000000 0.1186441), wk = 0.0031056 k( 266) = ( 0.1101695 0.5000000 0.1101695), wk = 0.0031056 k( 267) = ( 0.1016949 0.5000000 0.1016949), wk = 0.0031056 k( 268) = ( 0.0932203 0.5000000 0.0932203), wk = 0.0031056 k( 269) = ( 0.0847458 0.5000000 0.0847458), wk = 0.0031056 k( 270) = ( 0.0762712 0.5000000 0.0762712), wk = 0.0031056 k( 271) = ( 0.0677966 0.5000000 0.0677966), wk = 0.0031056 k( 272) = ( 0.0593220 0.5000000 0.0593220), wk = 0.0031056 k( 273) = ( 0.0508475 0.5000000 0.0508475), wk = 0.0031056 k( 274) = ( 0.0423729 0.5000000 0.0423729), wk = 0.0031056 k( 275) = ( 0.0338983 0.5000000 0.0338983), wk = 0.0031056 k( 276) = ( 0.0254237 0.5000000 0.0254237), wk = 0.0031056 k( 277) = ( 0.0169491 0.5000000 0.0169491), wk = 0.0031056 k( 278) = ( 0.0084746 0.5000000 0.0084746), wk = 0.0031056 k( 279) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031056 k( 280) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031056 k( 281) = ( 0.5000000 0.5000000 0.0119048), wk = 0.0031056 k( 282) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0031056 k( 283) = ( 0.5000000 0.5000000 0.0357143), wk = 0.0031056 k( 284) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0031056 k( 285) = ( 0.5000000 0.5000000 0.0595238), wk = 0.0031056 k( 286) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0031056 k( 287) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0031056 k( 288) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0031056 k( 289) = ( 0.5000000 0.5000000 0.1071429), wk = 0.0031056 k( 290) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0031056 k( 291) = ( 0.5000000 0.5000000 0.1309524), wk = 0.0031056 k( 292) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0031056 k( 293) = ( 0.5000000 0.5000000 0.1547619), wk = 0.0031056 k( 294) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0031056 k( 295) = ( 0.5000000 0.5000000 0.1785714), wk = 0.0031056 k( 296) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0031056 k( 297) = ( 0.5000000 0.5000000 0.2023810), wk = 0.0031056 k( 298) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0031056 k( 299) = ( 0.5000000 0.5000000 0.2261905), wk = 0.0031056 k( 300) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0031056 k( 301) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0031056 k( 302) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0031056 k( 303) = ( 0.5000000 0.5000000 0.2738095), wk = 0.0031056 k( 304) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0031056 k( 305) = ( 0.5000000 0.5000000 0.2976190), wk = 0.0031056 k( 306) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0031056 k( 307) = ( 0.5000000 0.5000000 0.3214286), wk = 0.0031056 k( 308) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0031056 k( 309) = ( 0.5000000 0.5000000 0.3452381), wk = 0.0031056 k( 310) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0031056 k( 311) = ( 0.5000000 0.5000000 0.3690476), wk = 0.0031056 k( 312) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0031056 k( 313) = ( 0.5000000 0.5000000 0.3928571), wk = 0.0031056 k( 314) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0031056 k( 315) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0031056 k( 316) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0031056 k( 317) = ( 0.5000000 0.5000000 0.4404762), wk = 0.0031056 k( 318) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0031056 k( 319) = ( 0.5000000 0.5000000 0.4642857), wk = 0.0031056 k( 320) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0031056 k( 321) = ( 0.5000000 0.5000000 0.4880952), wk = 0.0031056 k( 322) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031056 Dense grid: 37385 G-vectors FFT dimensions: ( 45, 45, 45) Smooth grid: 15659 G-vectors FFT dimensions: ( 32, 32, 32) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.08 Mb ( 110, 48) NL pseudopotentials 0.13 Mb ( 55, 150) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 1037) G-vector shells 0.00 Mb ( 277) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.32 Mb ( 110, 192) Each subspace H/S matrix 0.04 Mb ( 48, 48) Each matrix 0.22 Mb ( 150, 2, 48) The potential is recalculated from file : ./ZnFe3C.save/charge-density.dat Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.5 secs Computing kpt #: 2 total cpu time spent up to now is 3.7 secs Computing kpt #: 3 total cpu time spent up to now is 3.9 secs Computing kpt #: 4 total cpu time spent up to now is 4.1 secs Computing kpt #: 5 total cpu time spent up to now is 4.3 secs Computing kpt #: 6 total cpu time spent up to now is 4.5 secs Computing kpt #: 7 total cpu time spent up to now is 4.7 secs Computing kpt #: 8 total cpu time spent up to now is 4.9 secs Computing kpt #: 9 total cpu time spent up to now is 5.1 secs Computing kpt #: 10 total cpu time spent up to now is 5.3 secs Computing kpt #: 11 total cpu time spent up to now is 5.5 secs Computing kpt #: 12 total cpu time spent up to now is 5.7 secs Computing kpt #: 13 total cpu time spent up to now is 5.9 secs Computing kpt #: 14 total cpu time spent up to now is 6.1 secs Computing kpt #: 15 total cpu time spent up to now is 6.3 secs Computing kpt #: 16 total cpu time spent up to now is 6.5 secs Computing kpt #: 17 total cpu time spent up to now is 6.7 secs Computing kpt #: 18 total cpu time spent up to now is 6.9 secs Computing kpt #: 19 total cpu time spent up to now is 7.1 secs Computing kpt #: 20 total cpu time spent up to now is 7.3 secs Computing kpt #: 21 total cpu time spent up to now is 7.5 secs Computing kpt #: 22 total cpu time spent up to now is 7.7 secs Computing kpt #: 23 total cpu time spent up to now is 7.9 secs Computing kpt #: 24 total cpu time spent up to now is 8.1 secs Computing kpt #: 25 total cpu time spent up to now is 8.3 secs Computing kpt #: 26 total cpu time spent up to now is 8.5 secs Computing kpt #: 27 total cpu time spent up to now is 8.7 secs Computing kpt #: 28 total cpu time spent up to now is 8.9 secs Computing kpt #: 29 total cpu time spent up to now is 9.1 secs Computing kpt #: 30 total cpu time spent up to now is 9.3 secs Computing kpt #: 31 total cpu time spent up to now is 9.5 secs Computing kpt #: 32 total cpu time spent up to now is 9.7 secs Computing kpt #: 33 total cpu time spent up to now is 9.9 secs Computing kpt #: 34 total cpu time spent up to now is 10.1 secs Computing kpt #: 35 total cpu time spent up to now is 10.3 secs Computing kpt #: 36 total cpu time spent up to now is 10.5 secs Computing kpt #: 37 total cpu time spent up to now is 10.7 secs Computing kpt #: 38 total cpu time spent up to now is 10.9 secs Computing kpt #: 39 total cpu time spent up to now is 11.1 secs Computing kpt #: 40 total cpu time spent up to now is 11.2 secs Computing kpt #: 41 total cpu time spent up to now is 11.4 secs Computing kpt #: 42 total cpu time spent up to now is 11.6 secs Computing kpt #: 43 total cpu time spent up to now is 11.8 secs Computing kpt #: 44 total cpu time spent up to now is 12.0 secs Computing kpt #: 45 total cpu time spent up to now is 12.2 secs Computing kpt #: 46 total cpu time spent up to now is 12.4 secs Computing kpt #: 47 total cpu time spent up to now is 12.6 secs Computing kpt #: 48 total cpu time spent up to now is 12.8 secs Computing kpt #: 49 total cpu time spent up to now is 13.0 secs Computing kpt #: 50 total cpu time spent up to now is 13.2 secs Computing kpt #: 51 total cpu time spent up to now is 13.4 secs Computing kpt #: 52 total cpu time spent up to now is 13.6 secs Computing kpt #: 53 total cpu time spent up to now is 13.8 secs Computing kpt #: 54 total cpu time spent up to now is 14.0 secs Computing kpt #: 55 total cpu time spent up to now is 14.2 secs Computing kpt #: 56 total cpu time spent up to now is 14.4 secs Computing kpt #: 57 total cpu time spent up to now is 14.6 secs Computing kpt #: 58 total cpu time spent up to now is 14.8 secs Computing kpt #: 59 total cpu time spent up to now is 15.0 secs Computing kpt #: 60 total cpu time spent up to now is 15.2 secs Computing kpt #: 61 total cpu time spent up to now is 15.4 secs Computing kpt #: 62 total cpu time spent up to now is 15.6 secs Computing kpt #: 63 total cpu time spent up to now is 15.8 secs Computing kpt #: 64 total cpu time spent up to now is 16.0 secs Computing kpt #: 65 total cpu time spent up to now is 16.2 secs Computing kpt #: 66 total cpu time spent up to now is 16.4 secs Computing kpt #: 67 total cpu time spent up to now is 16.7 secs Computing kpt #: 68 total cpu time spent up to now is 17.0 secs Computing kpt #: 69 total cpu time spent up to now is 17.3 secs Computing kpt #: 70 total cpu time spent up to now is 17.6 secs Computing kpt #: 71 total cpu time spent up to now is 17.9 secs Computing kpt #: 72 total cpu time spent up to now is 18.1 secs Computing kpt #: 73 total cpu time spent up to now is 18.3 secs Computing kpt #: 74 total cpu time spent up to now is 18.6 secs Computing kpt #: 75 total cpu time spent up to now is 18.8 secs Computing kpt #: 76 total cpu time spent up to now is 19.0 secs Computing kpt #: 77 total cpu time spent up to now is 19.3 secs Computing kpt #: 78 total cpu time spent up to now is 19.5 secs Computing kpt #: 79 total cpu time spent up to now is 19.8 secs Computing kpt #: 80 total cpu time spent up to now is 20.0 secs Computing kpt #: 81 total cpu time spent up to now is 20.2 secs Computing kpt #: 82 total cpu time spent up to now is 20.5 secs Computing kpt #: 83 total cpu time spent up to now is 20.7 secs Computing kpt #: 84 total cpu time spent up to now is 20.9 secs Computing kpt #: 85 total cpu time spent up to now is 21.2 secs Computing kpt #: 86 total cpu time spent up to now is 21.4 secs Computing kpt #: 87 total cpu time spent up to now is 21.6 secs Computing kpt #: 88 total cpu time spent up to now is 21.8 secs Computing kpt #: 89 total cpu time spent up to now is 22.1 secs Computing kpt #: 90 total cpu time spent up to now is 22.3 secs Computing kpt #: 91 total cpu time spent up to now is 22.5 secs Computing kpt #: 92 total cpu time spent up to now is 22.8 secs Computing kpt #: 93 total cpu time spent up to now is 23.0 secs Computing kpt #: 94 total cpu time spent up to now is 23.2 secs Computing kpt #: 95 total cpu time spent up to now is 23.5 secs Computing kpt #: 96 total cpu time spent up to now is 23.7 secs Computing kpt #: 97 total cpu time spent up to now is 23.9 secs Computing kpt #: 98 total cpu time spent up to now is 24.2 secs Computing kpt #: 99 total cpu time spent up to now is 24.4 secs Computing kpt #: 100 total cpu time spent up to now is 24.6 secs Computing kpt #: 101 total cpu time spent up to now is 24.9 secs Computing kpt #: 102 total cpu time spent up to now is 25.1 secs Computing kpt #: 103 total cpu time spent up to now is 25.4 secs Computing kpt #: 104 total cpu time spent up to now is 25.8 secs Computing kpt #: 105 total cpu time spent up to now is 26.0 secs Computing kpt #: 106 total cpu time spent up to now is 26.3 secs Computing kpt #: 107 total cpu time spent up to now is 26.6 secs Computing kpt #: 108 total cpu time spent up to now is 26.8 secs Computing kpt #: 109 total cpu time spent up to now is 27.0 secs Computing kpt #: 110 total cpu time spent up to now is 27.3 secs Computing kpt #: 111 total cpu time spent up to now is 27.5 secs Computing kpt #: 112 total cpu time spent up to now is 27.7 secs Computing kpt #: 113 total cpu time spent up to now is 27.9 secs Computing kpt #: 114 total cpu time spent up to now is 28.1 secs Computing kpt #: 115 total cpu time spent up to now is 28.3 secs Computing kpt #: 116 total cpu time spent up to now is 28.5 secs Computing kpt #: 117 total cpu time spent up to now is 28.7 secs Computing kpt #: 118 total cpu time spent up to now is 28.9 secs Computing kpt #: 119 total cpu time spent up to now is 29.1 secs Computing kpt #: 120 total cpu time spent up to now is 29.4 secs Computing kpt #: 121 total cpu time spent up to now is 29.6 secs Computing kpt #: 122 total cpu time spent up to now is 29.8 secs Computing kpt #: 123 total cpu time spent up to now is 30.0 secs Computing kpt #: 124 total cpu time spent up to now is 30.2 secs Computing kpt #: 125 total cpu time spent up to now is 30.4 secs Computing kpt #: 126 total cpu time spent up to now is 30.6 secs Computing kpt #: 127 total cpu time spent up to now is 30.8 secs Computing kpt #: 128 total cpu time spent up to now is 31.0 secs Computing kpt #: 129 total cpu time spent up to now is 31.2 secs Computing kpt #: 130 total cpu time spent up to now is 31.4 secs Computing kpt #: 131 total cpu time spent up to now is 31.6 secs Computing kpt #: 132 total cpu time spent up to now is 31.8 secs Computing kpt #: 133 total cpu time spent up to now is 32.0 secs Computing kpt #: 134 total cpu time spent up to now is 32.2 secs Computing kpt #: 135 total cpu time spent up to now is 32.5 secs Computing kpt #: 136 total cpu time spent up to now is 32.7 secs Computing kpt #: 137 total cpu time spent up to now is 33.0 secs Computing kpt #: 138 total cpu time spent up to now is 33.3 secs Computing kpt #: 139 total cpu time spent up to now is 33.5 secs Computing kpt #: 140 total cpu time spent up to now is 33.8 secs Computing kpt #: 141 total cpu time spent up to now is 34.0 secs Computing kpt #: 142 total cpu time spent up to now is 34.2 secs Computing kpt #: 143 total cpu time spent up to now is 34.4 secs Computing kpt #: 144 total cpu time spent up to now is 34.5 secs Computing kpt #: 145 total cpu time spent up to now is 34.7 secs Computing kpt #: 146 total cpu time spent up to now is 34.9 secs Computing kpt #: 147 total cpu time spent up to now is 35.1 secs Computing kpt #: 148 total cpu time spent up to now is 35.3 secs Computing kpt #: 149 total cpu time spent up to now is 35.5 secs Computing kpt #: 150 total cpu time spent up to now is 35.7 secs Computing kpt #: 151 total cpu time spent up to now is 35.9 secs Computing kpt #: 152 total cpu time spent up to now is 36.1 secs Computing kpt #: 153 total cpu time spent up to now is 36.3 secs Computing kpt #: 154 total cpu time spent up to now is 36.4 secs Computing kpt #: 155 total cpu time spent up to now is 36.6 secs Computing kpt #: 156 total cpu time spent up to now is 36.8 secs Computing kpt #: 157 total cpu time spent up to now is 37.0 secs Computing kpt #: 158 total cpu time spent up to now is 37.2 secs Computing kpt #: 159 total cpu time spent up to now is 37.4 secs Computing kpt #: 160 total cpu time spent up to now is 37.6 secs Computing kpt #: 161 total cpu time spent up to now is 37.8 secs Computing kpt #: 162 total cpu time spent up to now is 38.0 secs Computing kpt #: 163 total cpu time spent up to now is 38.2 secs Computing kpt #: 164 total cpu time spent up to now is 38.4 secs Computing kpt #: 165 total cpu time spent up to now is 38.6 secs Computing kpt #: 166 total cpu time spent up to now is 38.8 secs Computing kpt #: 167 total cpu time spent up to now is 39.0 secs Computing kpt #: 168 total cpu time spent up to now is 39.2 secs Computing kpt #: 169 total cpu time spent up to now is 39.4 secs Computing kpt #: 170 total cpu time spent up to now is 39.6 secs Computing kpt #: 171 total cpu time spent up to now is 39.8 secs Computing kpt #: 172 total cpu time spent up to now is 40.1 secs Computing kpt #: 173 total cpu time spent up to now is 40.3 secs Computing kpt #: 174 total cpu time spent up to now is 40.5 secs Computing kpt #: 175 total cpu time spent up to now is 40.7 secs Computing kpt #: 176 total cpu time spent up to now is 40.9 secs Computing kpt #: 177 total cpu time spent up to now is 41.1 secs Computing kpt #: 178 total cpu time spent up to now is 41.3 secs Computing kpt #: 179 total cpu time spent up to now is 41.6 secs Computing kpt #: 180 total cpu time spent up to now is 41.8 secs Computing kpt #: 181 total cpu time spent up to now is 42.0 secs Computing kpt #: 182 total cpu time spent up to now is 42.2 secs Computing kpt #: 183 total cpu time spent up to now is 42.4 secs Computing kpt #: 184 total cpu time spent up to now is 42.6 secs Computing kpt #: 185 total cpu time spent up to now is 42.8 secs Computing kpt #: 186 total cpu time spent up to now is 43.0 secs Computing kpt #: 187 total cpu time spent up to now is 43.2 secs Computing kpt #: 188 total cpu time spent up to now is 43.5 secs Computing kpt #: 189 total cpu time spent up to now is 43.7 secs Computing kpt #: 190 total cpu time spent up to now is 43.9 secs Computing kpt #: 191 total cpu time spent up to now is 44.2 secs Computing kpt #: 192 total cpu time spent up to now is 44.4 secs Computing kpt #: 193 total cpu time spent up to now is 44.7 secs Computing kpt #: 194 total cpu time spent up to now is 44.9 secs Computing kpt #: 195 total cpu time spent up to now is 45.2 secs Computing kpt #: 196 total cpu time spent up to now is 45.4 secs Computing kpt #: 197 total cpu time spent up to now is 45.6 secs Computing kpt #: 198 total cpu time spent up to now is 45.9 secs Computing kpt #: 199 total cpu time spent up to now is 46.2 secs Computing kpt #: 200 total cpu time spent up to now is 46.4 secs Computing kpt #: 201 total cpu time spent up to now is 46.7 secs Computing kpt #: 202 total cpu time spent up to now is 46.9 secs Computing kpt #: 203 total cpu time spent up to now is 47.2 secs Computing kpt #: 204 total cpu time spent up to now is 47.4 secs Computing kpt #: 205 total cpu time spent up to now is 47.6 secs Computing kpt #: 206 total cpu time spent up to now is 47.9 secs Computing kpt #: 207 total cpu time spent up to now is 48.1 secs Computing kpt #: 208 total cpu time spent up to now is 48.3 secs Computing kpt #: 209 total cpu time spent up to now is 48.6 secs Computing kpt #: 210 total cpu time spent up to now is 48.8 secs Computing kpt #: 211 total cpu time spent up to now is 49.0 secs Computing kpt #: 212 total cpu time spent up to now is 49.2 secs Computing kpt #: 213 total cpu time spent up to now is 49.4 secs Computing kpt #: 214 total cpu time spent up to now is 49.6 secs Computing kpt #: 215 total cpu time spent up to now is 49.8 secs Computing kpt #: 216 total cpu time spent up to now is 50.0 secs Computing kpt #: 217 total cpu time spent up to now is 50.2 secs Computing kpt #: 218 total cpu time spent up to now is 50.4 secs Computing kpt #: 219 total cpu time spent up to now is 50.6 secs Computing kpt #: 220 total cpu time spent up to now is 50.8 secs Computing kpt #: 221 total cpu time spent up to now is 51.0 secs Computing kpt #: 222 total cpu time spent up to now is 51.2 secs Computing kpt #: 223 total cpu time spent up to now is 51.4 secs Computing kpt #: 224 total cpu time spent up to now is 51.6 secs Computing kpt #: 225 total cpu time spent up to now is 51.8 secs Computing kpt #: 226 total cpu time spent up to now is 52.0 secs Computing kpt #: 227 total cpu time spent up to now is 52.2 secs Computing kpt #: 228 total cpu time spent up to now is 52.4 secs Computing kpt #: 229 total cpu time spent up to now is 52.6 secs Computing kpt #: 230 total cpu time spent up to now is 52.8 secs Computing kpt #: 231 total cpu time spent up to now is 53.1 secs Computing kpt #: 232 total cpu time spent up to now is 53.3 secs Computing kpt #: 233 total cpu time spent up to now is 53.5 secs Computing kpt #: 234 total cpu time spent up to now is 53.8 secs Computing kpt #: 235 total cpu time spent up to now is 54.0 secs Computing kpt #: 236 total cpu time spent up to now is 54.2 secs Computing kpt #: 237 total cpu time spent up to now is 54.5 secs Computing kpt #: 238 total cpu time spent up to now is 54.7 secs Computing kpt #: 239 total cpu time spent up to now is 55.0 secs Computing kpt #: 240 total cpu time spent up to now is 55.2 secs Computing kpt #: 241 total cpu time spent up to now is 55.5 secs Computing kpt #: 242 total cpu time spent up to now is 55.7 secs Computing kpt #: 243 total cpu time spent up to now is 55.9 secs Computing kpt #: 244 total cpu time spent up to now is 56.1 secs Computing kpt #: 245 total cpu time spent up to now is 56.4 secs Computing kpt #: 246 total cpu time spent up to now is 56.7 secs Computing kpt #: 247 total cpu time spent up to now is 57.0 secs Computing kpt #: 248 total cpu time spent up to now is 57.3 secs Computing kpt #: 249 total cpu time spent up to now is 57.8 secs Computing kpt #: 250 total cpu time spent up to now is 58.1 secs Computing kpt #: 251 total cpu time spent up to now is 58.4 secs Computing kpt #: 252 total cpu time spent up to now is 58.6 secs Computing kpt #: 253 total cpu time spent up to now is 58.9 secs Computing kpt #: 254 total cpu time spent up to now is 59.1 secs Computing kpt #: 255 total cpu time spent up to now is 59.4 secs Computing kpt #: 256 total cpu time spent up to now is 59.6 secs Computing kpt #: 257 total cpu time spent up to now is 59.8 secs Computing kpt #: 258 total cpu time spent up to now is 60.0 secs Computing kpt #: 259 total cpu time spent up to now is 60.2 secs Computing kpt #: 260 total cpu time spent up to now is 60.5 secs Computing kpt #: 261 total cpu time spent up to now is 60.7 secs Computing kpt #: 262 total cpu time spent up to now is 60.9 secs Computing kpt #: 263 total cpu time spent up to now is 61.1 secs Computing kpt #: 264 total cpu time spent up to now is 61.3 secs Computing kpt #: 265 total cpu time spent up to now is 61.5 secs Computing kpt #: 266 total cpu time spent up to now is 61.7 secs Computing kpt #: 267 total cpu time spent up to now is 61.9 secs Computing kpt #: 268 total cpu time spent up to now is 62.1 secs Computing kpt #: 269 total cpu time spent up to now is 62.3 secs Computing kpt #: 270 total cpu time spent up to now is 62.5 secs Computing kpt #: 271 total cpu time spent up to now is 62.7 secs Computing kpt #: 272 total cpu time spent up to now is 62.9 secs Computing kpt #: 273 total cpu time spent up to now is 63.1 secs Computing kpt #: 274 total cpu time spent up to now is 63.3 secs Computing kpt #: 275 total cpu time spent up to now is 63.4 secs Computing kpt #: 276 total cpu time spent up to now is 63.6 secs Computing kpt #: 277 total cpu time spent up to now is 63.8 secs Computing kpt #: 278 total cpu time spent up to now is 64.0 secs Computing kpt #: 279 total cpu time spent up to now is 64.2 secs Computing kpt #: 280 total cpu time spent up to now is 64.4 secs Computing kpt #: 281 total cpu time spent up to now is 64.6 secs Computing kpt #: 282 total cpu time spent up to now is 64.9 secs Computing kpt #: 283 total cpu time spent up to now is 65.1 secs Computing kpt #: 284 total cpu time spent up to now is 65.3 secs Computing kpt #: 285 total cpu time spent up to now is 65.5 secs Computing kpt #: 286 total cpu time spent up to now is 65.8 secs Computing kpt #: 287 total cpu time spent up to now is 66.0 secs Computing kpt #: 288 total cpu time spent up to now is 66.2 secs Computing kpt #: 289 total cpu time spent up to now is 66.4 secs Computing kpt #: 290 total cpu time spent up to now is 66.7 secs Computing kpt #: 291 total cpu time spent up to now is 66.9 secs Computing kpt #: 292 total cpu time spent up to now is 67.1 secs Computing kpt #: 293 total cpu time spent up to now is 67.4 secs Computing kpt #: 294 total cpu time spent up to now is 67.6 secs Computing kpt #: 295 total cpu time spent up to now is 67.9 secs Computing kpt #: 296 total cpu time spent up to now is 68.1 secs Computing kpt #: 297 total cpu time spent up to now is 68.3 secs Computing kpt #: 298 total cpu time spent up to now is 68.6 secs Computing kpt #: 299 total cpu time spent up to now is 68.8 secs Computing kpt #: 300 total cpu time spent up to now is 69.1 secs Computing kpt #: 301 total cpu time spent up to now is 69.3 secs Computing kpt #: 302 total cpu time spent up to now is 69.6 secs Computing kpt #: 303 total cpu time spent up to now is 69.8 secs Computing kpt #: 304 total cpu time spent up to now is 70.1 secs Computing kpt #: 305 total cpu time spent up to now is 70.4 secs Computing kpt #: 306 total cpu time spent up to now is 70.6 secs Computing kpt #: 307 total cpu time spent up to now is 70.9 secs Computing kpt #: 308 total cpu time spent up to now is 71.1 secs Computing kpt #: 309 total cpu time spent up to now is 71.4 secs Computing kpt #: 310 total cpu time spent up to now is 71.6 secs Computing kpt #: 311 total cpu time spent up to now is 71.8 secs Computing kpt #: 312 total cpu time spent up to now is 72.1 secs Computing kpt #: 313 total cpu time spent up to now is 72.3 secs Computing kpt #: 314 total cpu time spent up to now is 72.5 secs Computing kpt #: 315 total cpu time spent up to now is 72.7 secs Computing kpt #: 316 total cpu time spent up to now is 72.9 secs Computing kpt #: 317 total cpu time spent up to now is 73.1 secs Computing kpt #: 318 total cpu time spent up to now is 73.3 secs Computing kpt #: 319 total cpu time spent up to now is 73.5 secs Computing kpt #: 320 total cpu time spent up to now is 73.8 secs Computing kpt #: 321 total cpu time spent up to now is 74.0 secs Computing kpt #: 322 total cpu time spent up to now is 74.2 secs ethr = 2.50E-08, avg # of iterations = 11.4 total cpu time spent up to now is 74.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1935 PWs) bands (ev): -1.1295 -1.1295 5.2964 5.2964 5.3833 5.3833 5.3833 5.3833 5.7162 5.7162 5.7162 5.7162 5.8015 5.8015 9.2374 9.2374 9.2374 9.2374 9.2840 9.2840 9.5257 9.5257 9.5257 9.5257 9.5442 9.5442 10.1312 10.1312 10.1312 10.1312 11.7308 11.7308 11.7308 11.7308 11.8653 11.8653 11.8653 11.8653 11.9018 11.9018 12.7518 12.7518 12.8078 12.8078 12.8078 12.8078 12.8223 12.8223 k = 0.0000 0.0119-0.0000 ( 1935 PWs) bands (ev): -1.1286 -1.1286 5.2972 5.2972 5.3834 5.3834 5.3834 5.3834 5.7163 5.7163 5.7163 5.7163 5.8015 5.8015 9.2310 9.2310 9.2334 9.2334 9.2786 9.2786 9.5268 9.5268 9.5298 9.5298 9.5466 9.5466 10.1317 10.1317 10.1320 10.1320 11.7307 11.7307 11.7322 11.7322 11.8651 11.8651 11.8652 11.8652 11.9015 11.9015 12.7523 12.7523 12.8081 12.8081 12.8086 12.8086 12.8216 12.8216 k = 0.0000 0.0238-0.0000 ( 1935 PWs) bands (ev): -1.1256 -1.1256 5.2994 5.2994 5.3837 5.3837 5.3839 5.3839 5.7166 5.7166 5.7166 5.7166 5.8016 5.8016 9.2118 9.2118 9.2222 9.2222 9.2635 9.2635 9.5290 9.5290 9.5413 9.5413 9.5544 9.5544 10.1330 10.1330 10.1343 10.1343 11.7307 11.7307 11.7364 11.7364 11.8644 11.8644 11.8649 11.8649 11.9008 11.9008 12.7538 12.7538 12.8089 12.8089 12.8107 12.8107 12.8197 12.8197 k = 0.0000 0.0357-0.0000 ( 1935 PWs) bands (ev): -1.1208 -1.1208 5.3030 5.3030 5.3842 5.3842 5.3848 5.3848 5.7170 5.7170 5.7171 5.7171 5.8017 5.8017 9.1802 9.1802 9.2048 9.2048 9.2412 9.2412 9.5309 9.5309 9.5583 9.5583 9.5677 9.5677 10.1347 10.1347 10.1381 10.1381 11.7305 11.7305 11.7428 11.7428 11.8633 11.8633 11.8645 11.8645 11.8996 11.8996 12.7562 12.7562 12.8102 12.8102 12.8142 12.8142 12.8165 12.8165 k = 0.0000 0.0476-0.0000 ( 1935 PWs) bands (ev): -1.1140 -1.1140 5.3078 5.3078 5.3850 5.3850 5.3863 5.3863 5.7176 5.7176 5.7178 5.7178 5.8019 5.8019 9.1365 9.1365 9.1830 9.1830 9.2145 9.2145 9.5325 9.5325 9.5788 9.5788 9.5850 9.5850 10.1363 10.1363 10.1435 10.1435 11.7304 11.7304 11.7509 11.7509 11.8618 11.8618 11.8640 11.8640 11.8979 11.8979 12.7593 12.7593 12.8120 12.8120 12.8124 12.8124 12.8193 12.8193 k = 0.0000 0.0595-0.0000 ( 1947 PWs) bands (ev): -1.1054 -1.1054 5.3136 5.3136 5.3859 5.3859 5.3883 5.3883 5.7184 5.7184 5.7185 5.7185 5.8020 5.8020 9.0817 9.0817 9.1578 9.1578 9.1852 9.1852 9.5339 9.5339 9.6012 9.6012 9.6047 9.6047 10.1369 10.1369 10.1504 10.1504 11.7301 11.7301 11.7595 11.7595 11.8598 11.8598 11.8636 11.8636 11.8956 11.8956 12.7629 12.7629 12.8062 12.8062 12.8154 12.8154 12.8256 12.8256 k = 0.0000 0.0714-0.0000 ( 1951 PWs) bands (ev): -1.0948 -1.0948 5.3199 5.3199 5.3871 5.3871 5.3915 5.3915 5.7193 5.7193 5.7197 5.7197 5.8022 5.8022 9.0172 9.0172 9.1303 9.1303 9.1546 9.1546 9.5354 9.5354 9.6247 9.6247 9.6259 9.6259 10.1362 10.1362 10.1588 10.1588 11.7298 11.7298 11.7677 11.7677 11.8574 11.8574 11.8637 11.8637 11.8930 11.8930 12.7668 12.7668 12.7991 12.7991 12.8198 12.8198 12.8334 12.8334 k = 0.0000 0.0833-0.0000 ( 1959 PWs) bands (ev): -1.0825 -1.0825 5.3262 5.3262 5.3884 5.3884 5.3960 5.3960 5.7203 5.7203 5.7211 5.7211 5.8024 5.8024 8.9448 8.9448 9.1013 9.1013 9.1229 9.1229 9.5370 9.5370 9.6475 9.6475 9.6482 9.6482 10.1336 10.1336 10.1687 10.1687 11.7294 11.7294 11.7744 11.7744 11.8545 11.8545 11.8643 11.8643 11.8899 11.8899 12.7705 12.7705 12.7907 12.7907 12.8258 12.8258 12.8428 12.8428 k = 0.0000 0.0952-0.0000 ( 1959 PWs) bands (ev): -1.0683 -1.0683 5.3319 5.3319 5.3899 5.3899 5.4024 5.4024 5.7216 5.7216 5.7229 5.7229 5.8028 5.8028 8.8660 8.8660 9.0712 9.0712 9.0908 9.0908 9.5388 9.5388 9.6692 9.6692 9.6718 9.6718 10.1288 10.1288 10.1801 10.1801 11.7290 11.7290 11.7789 11.7789 11.8513 11.8513 11.8654 11.8654 11.8864 11.8864 12.7740 12.7740 12.7812 12.7812 12.8338 12.8338 12.8538 12.8538 k = 0.0000 0.1071-0.0000 ( 1959 PWs) bands (ev): -1.0523 -1.0523 5.3364 5.3364 5.3916 5.3916 5.4110 5.4110 5.7229 5.7229 5.7252 5.7252 5.8031 5.8031 8.7821 8.7821 9.0406 9.0406 9.0584 9.0584 9.5404 9.5404 9.6907 9.6907 9.6948 9.6948 10.1215 10.1215 10.1930 10.1930 11.7284 11.7284 11.7809 11.7809 11.8477 11.8477 11.8669 11.8669 11.8826 11.8826 12.7704 12.7704 12.7768 12.7768 12.8438 12.8438 12.8662 12.8662 k = 0.0000 0.1190-0.0000 ( 1967 PWs) bands (ev): -1.0346 -1.0346 5.3396 5.3396 5.3935 5.3935 5.4217 5.4217 5.7244 5.7244 5.7279 5.7279 5.8034 5.8034 8.6943 8.6943 9.0095 9.0095 9.0259 9.0259 9.5425 9.5425 9.7113 9.7113 9.7168 9.7168 10.1114 10.1114 10.2072 10.2072 11.7278 11.7278 11.7799 11.7799 11.8438 11.8438 11.8677 11.8677 11.8784 11.8784 12.7582 12.7582 12.7791 12.7791 12.8560 12.8560 12.8802 12.8802 k = 0.0000 0.1310-0.0000 ( 1967 PWs) bands (ev): -1.0152 -1.0152 5.3413 5.3413 5.3955 5.3955 5.4345 5.4345 5.7260 5.7260 5.7313 5.7313 5.8039 5.8039 8.6039 8.6039 8.9784 8.9784 8.9935 8.9935 9.5449 9.5449 9.7311 9.7311 9.7379 9.7379 10.0984 10.0984 10.2230 10.2230 11.7271 11.7271 11.7764 11.7764 11.8394 11.8394 11.8673 11.8673 11.8739 11.8739 12.7450 12.7450 12.7810 12.7810 12.8702 12.8702 12.8957 12.8957 k = 0.0000 0.1429-0.0000 ( 1967 PWs) bands (ev): -0.9943 -0.9943 5.3416 5.3416 5.3976 5.3976 5.4487 5.4487 5.7278 5.7278 5.7355 5.7355 5.8044 5.8044 8.5117 8.5117 8.9474 8.9474 8.9614 8.9614 9.5474 9.5474 9.7500 9.7500 9.7579 9.7579 10.0824 10.0824 10.2401 10.2401 11.7263 11.7263 11.7707 11.7707 11.8348 11.8348 11.8653 11.8653 11.8692 11.8692 12.7305 12.7305 12.7824 12.7824 12.8862 12.8862 12.9126 12.9126 k = 0.0000 0.1548-0.0000 ( 1967 PWs) bands (ev): -0.9718 -0.9718 5.3407 5.3407 5.3999 5.3999 5.4639 5.4639 5.7296 5.7296 5.7408 5.7408 5.8050 5.8050 8.4189 8.4189 8.9167 8.9167 8.9296 8.9296 9.5501 9.5501 9.7676 9.7676 9.7766 9.7766 10.0633 10.0633 10.2587 10.2587 11.7254 11.7254 11.7628 11.7628 11.8298 11.8298 11.8611 11.8611 11.8642 11.8642 12.7149 12.7149 12.7835 12.7835 12.9041 12.9041 12.9311 12.9311 k = 0.0000 0.1667-0.0000 ( 1975 PWs) bands (ev): -0.9479 -0.9479 5.3386 5.3386 5.4023 5.4023 5.4793 5.4793 5.7315 5.7315 5.7472 5.7472 5.8055 5.8055 8.3264 8.3264 8.8862 8.8862 8.8983 8.8983 9.5529 9.5529 9.7840 9.7840 9.7940 9.7940 10.0409 10.0409 10.2785 10.2785 11.7243 11.7243 11.7528 11.7528 11.8245 11.8245 11.8547 11.8547 11.8590 11.8590 12.6981 12.6981 12.7843 12.7843 12.9235 12.9235 12.9509 12.9509 k = 0.0000 0.1786-0.0000 ( 1971 PWs) bands (ev): -0.9225 -0.9225 5.3354 5.3354 5.4048 5.4048 5.4946 5.4946 5.7336 5.7336 5.7553 5.7553 5.8062 5.8062 8.2349 8.2349 8.8563 8.8563 8.8675 8.8675 9.5558 9.5558 9.7992 9.7992 9.8101 9.8101 10.0151 10.0151 10.2997 10.2997 11.7231 11.7231 11.7407 11.7407 11.8189 11.8189 11.8466 11.8466 11.8537 11.8537 12.6803 12.6803 12.7850 12.7850 12.9446 12.9446 12.9723 12.9723 k = 0.0000 0.1905-0.0000 ( 1971 PWs) bands (ev): -0.8959 -0.8959 5.3311 5.3311 5.4073 5.4073 5.5090 5.5090 5.7357 5.7357 5.7650 5.7650 5.8069 5.8069 8.1455 8.1455 8.8270 8.8270 8.8374 8.8374 9.5589 9.5589 9.8131 9.8131 9.8247 9.8247 9.9859 9.9859 10.3221 10.3221 11.7218 11.7218 11.7263 11.7263 11.8130 11.8130 11.8370 11.8370 11.8483 11.8483 12.6614 12.6614 12.7856 12.7856 12.9671 12.9671 12.9949 12.9949 k = 0.0000 0.2024-0.0000 ( 1971 PWs) bands (ev): -0.8680 -0.8680 5.3255 5.3255 5.4100 5.4100 5.5222 5.5222 5.7378 5.7378 5.7767 5.7767 5.8076 5.8076 8.0589 8.0589 8.7983 8.7983 8.8080 8.8080 9.5621 9.5621 9.8256 9.8256 9.8380 9.8380 9.9531 9.9531 10.3458 10.3458 11.7093 11.7093 11.7203 11.7203 11.8070 11.8070 11.8266 11.8266 11.8429 11.8429 12.6414 12.6414 12.7860 12.7860 12.9908 12.9908 13.0188 13.0188 k = 0.0000 0.2143-0.0000 ( 1971 PWs) bands (ev): -0.8391 -0.8391 5.3186 5.3186 5.4126 5.4126 5.5336 5.5336 5.7400 5.7400 5.7905 5.7905 5.8083 5.8083 7.9760 7.9760 8.7703 8.7703 8.7793 8.7793 9.5653 9.5653 9.8369 9.8369 9.8497 9.8497 9.9168 9.9168 10.3705 10.3705 11.6899 11.6899 11.7186 11.7186 11.8007 11.8007 11.8160 11.8160 11.8376 11.8376 12.6204 12.6204 12.7864 12.7864 13.0157 13.0157 13.0437 13.0437 k = 0.0000 0.2262-0.0000 ( 1959 PWs) bands (ev): -0.8093 -0.8093 5.3102 5.3102 5.4154 5.4154 5.5432 5.5432 5.7422 5.7422 5.8062 5.8062 5.8091 5.8091 7.8977 7.8977 8.7433 8.7433 8.7516 8.7516 9.5688 9.5688 9.8469 9.8469 9.8586 9.8586 9.8782 9.8782 10.3965 10.3965 11.6681 11.6681 11.7171 11.7171 11.7944 11.7944 11.8056 11.8056 11.8325 11.8325 12.5985 12.5985 12.7867 12.7867 13.0416 13.0416 13.0697 13.0697 k = 0.0000 0.2381-0.0000 ( 1960 PWs) bands (ev): -0.7786 -0.7786 5.3002 5.3002 5.4181 5.4181 5.5508 5.5508 5.7444 5.7444 5.8099 5.8099 5.8236 5.8236 7.8246 7.8246 8.7170 8.7170 8.7248 8.7248 9.5722 9.5722 9.8303 9.8303 9.8556 9.8556 9.8716 9.8716 10.4234 10.4234 11.6440 11.6440 11.7150 11.7150 11.7878 11.7878 11.7955 11.7955 11.8272 11.8272 12.5757 12.5757 12.7870 12.7870 13.0683 13.0683 13.0964 13.0964 k = 0.0000 0.2500-0.0000 ( 1956 PWs) bands (ev): -0.7472 -0.7472 5.2885 5.2885 5.4208 5.4208 5.5566 5.5566 5.7466 5.7466 5.8108 5.8108 5.8423 5.8423 7.7578 7.7578 8.6917 8.6917 8.6988 8.6988 9.5757 9.5757 9.7828 9.7828 9.8632 9.8632 9.8791 9.8791 10.4511 10.4511 11.6184 11.6184 11.7127 11.7127 11.7812 11.7812 11.7860 11.7860 11.8222 11.8222 12.5521 12.5521 12.7872 12.7872 13.0957 13.0957 13.1239 13.1239 k = 0.0000 0.2619-0.0000 ( 1956 PWs) bands (ev): -0.7153 -0.7153 5.2749 5.2749 5.4235 5.4235 5.5606 5.5606 5.7488 5.7488 5.8116 5.8116 5.8619 5.8619 7.6978 7.6978 8.6673 8.6673 8.6739 8.6739 9.5792 9.5792 9.7308 9.7308 9.8696 9.8696 9.8860 9.8860 10.4798 10.4798 11.5917 11.5917 11.7102 11.7102 11.7745 11.7745 11.7770 11.7770 11.8173 11.8173 12.5277 12.5277 12.7874 12.7874 13.1236 13.1236 13.1519 13.1519 k = 0.0000 0.2738-0.0000 ( 1956 PWs) bands (ev): -0.6830 -0.6830 5.2592 5.2592 5.4261 5.4261 5.5633 5.5633 5.7509 5.7509 5.8125 5.8125 5.8818 5.8818 7.6454 7.6454 8.6439 8.6439 8.6500 8.6500 9.5827 9.5827 9.6748 9.6748 9.8750 9.8750 9.8918 9.8918 10.5092 10.5092 11.5644 11.5644 11.7075 11.7075 11.7678 11.7678 11.7687 11.7687 11.8125 11.8125 12.5028 12.5028 12.7875 12.7875 13.1518 13.1518 13.1803 13.1803 k = 0.0000 0.2857-0.0000 ( 1964 PWs) bands (ev): -0.6505 -0.6505 5.2413 5.2413 5.4287 5.4287 5.5647 5.5647 5.7529 5.7529 5.8134 5.8134 5.9014 5.9014 7.6014 7.6014 8.6216 8.6216 8.6271 8.6271 9.5862 9.5862 9.6149 9.6149 9.8794 9.8794 9.8966 9.8966 10.5392 10.5392 11.5370 11.5370 11.7046 11.7046 11.7608 11.7608 11.7611 11.7611 11.8078 11.8078 12.4771 12.4771 12.7876 12.7876 13.1801 13.1801 13.2088 13.2088 k = 0.0000 0.2976-0.0000 ( 1968 PWs) bands (ev): -0.6180 -0.6180 5.2214 5.2214 5.4312 5.4312 5.5653 5.5653 5.7549 5.7549 5.8143 5.8143 5.9202 5.9202 7.5661 7.5661 8.6003 8.6003 8.6054 8.6054 9.5513 9.5513 9.5896 9.5896 9.8829 9.8829 9.9005 9.9005 10.5698 10.5698 11.5100 11.5100 11.7014 11.7014 11.7536 11.7536 11.7546 11.7546 11.8034 11.8034 12.4511 12.4511 12.7877 12.7877 13.2085 13.2085 13.2373 13.2373 k = 0.0000 0.3095-0.0000 ( 1968 PWs) bands (ev): -0.5856 -0.5856 5.1993 5.1993 5.4337 5.4337 5.5652 5.5652 5.7568 5.7568 5.8152 5.8152 5.9379 5.9379 7.5400 7.5400 8.5801 8.5801 8.5848 8.5848 9.4843 9.4843 9.5930 9.5930 9.8857 9.8857 9.9036 9.9036 10.6008 10.6008 11.4837 11.4837 11.6981 11.6981 11.7467 11.7467 11.7482 11.7482 11.7991 11.7991 12.4249 12.4249 12.7878 12.7878 13.2366 13.2366 13.2656 13.2656 k = 0.0000 0.3214-0.0000 ( 1968 PWs) bands (ev): -0.5536 -0.5536 5.1754 5.1754 5.4360 5.4360 5.5646 5.5646 5.7586 5.7586 5.8162 5.8162 5.9542 5.9542 7.5234 7.5234 8.5611 8.5611 8.5653 8.5653 9.4140 9.4140 9.5963 9.5963 9.8877 9.8877 9.9060 9.9060 10.6321 10.6321 11.4586 11.4586 11.6947 11.6947 11.7404 11.7404 11.7420 11.7420 11.7949 11.7949 12.3986 12.3986 12.7879 12.7879 13.2643 13.2643 13.2935 13.2935 k = 0.0000 0.3333-0.0000 ( 1964 PWs) bands (ev): -0.5221 -0.5221 5.1497 5.1497 5.4383 5.4383 5.5638 5.5638 5.7604 5.7604 5.8172 5.8172 5.9687 5.9687 7.5164 7.5164 8.5433 8.5433 8.5470 8.5470 9.3408 9.3408 9.5996 9.5996 9.8891 9.8891 9.9077 9.9077 10.6634 10.6634 11.4347 11.4347 11.6912 11.6912 11.7346 11.7346 11.7359 11.7359 11.7910 11.7910 12.3723 12.3723 12.7880 12.7880 13.2914 13.2914 13.3208 13.3208 k = 0.0000 0.3452-0.0000 ( 1968 PWs) bands (ev): -0.4915 -0.4915 5.1227 5.1227 5.4405 5.4405 5.5627 5.5627 5.7620 5.7620 5.8181 5.8181 5.9814 5.9814 7.5187 7.5187 8.5265 8.5265 8.5299 8.5299 9.2647 9.2647 9.6028 9.6028 9.8900 9.8900 9.9088 9.9088 10.6947 10.6947 11.4123 11.4123 11.6876 11.6876 11.7291 11.7291 11.7300 11.7300 11.7870 11.7870 12.3463 12.3463 12.7881 12.7881 13.3176 13.3176 13.3472 13.3472 k = 0.0000 0.3571-0.0000 ( 1960 PWs) bands (ev): -0.4618 -0.4618 5.0947 5.0947 5.4426 5.4426 5.5616 5.5616 5.7636 5.7636 5.8191 5.8191 5.9923 5.9923 7.5302 7.5302 8.5111 8.5111 8.5141 8.5141 9.1863 9.1863 9.6058 9.6058 9.8905 9.8905 9.9094 9.9094 10.7257 10.7257 11.3917 11.3917 11.6840 11.6840 11.7243 11.7243 11.7244 11.7244 11.7834 11.7834 12.3207 12.3207 12.7882 12.7882 13.3429 13.3429 13.3728 13.3728 k = 0.0000 0.3690-0.0000 ( 1964 PWs) bands (ev): -0.4335 -0.4335 5.0661 5.0661 5.4445 5.4445 5.5604 5.5604 5.7650 5.7650 5.8200 5.8200 6.0013 6.0013 7.5502 7.5502 8.4968 8.4968 8.4995 8.4995 9.1058 9.1058 9.6086 9.6086 9.8905 9.8905 9.9097 9.9097 10.7561 10.7561 11.3724 11.3724 11.6804 11.6804 11.7188 11.7188 11.7196 11.7196 11.7797 11.7797 12.2958 12.2958 12.7882 12.7882 13.3670 13.3670 13.3970 13.3970 k = 0.0000 0.3810-0.0000 ( 1960 PWs) bands (ev): -0.4065 -0.4065 5.0377 5.0377 5.4463 5.4463 5.5593 5.5593 5.7663 5.7663 5.8209 5.8209 6.0089 6.0089 7.5785 7.5785 8.4837 8.4837 8.4861 8.4861 9.0238 9.0238 9.6112 9.6112 9.8903 9.8903 9.9097 9.9097 10.7858 10.7858 11.3550 11.3550 11.6770 11.6770 11.7134 11.7134 11.7154 11.7154 11.7761 11.7761 12.2718 12.2718 12.7883 12.7883 13.3896 13.3896 13.4199 13.4199 k = 0.0000 0.3929-0.0000 ( 1960 PWs) bands (ev): -0.3813 -0.3813 5.0098 5.0098 5.4479 5.4479 5.5582 5.5582 5.7675 5.7675 5.8217 5.8217 6.0150 6.0150 7.6143 7.6143 8.4718 8.4718 8.4739 8.4739 8.9404 8.9404 9.6137 9.6137 9.8899 9.8899 9.9094 9.9094 10.8143 10.8143 11.3394 11.3394 11.6738 11.6738 11.7081 11.7081 11.7116 11.7116 11.7726 11.7726 12.2490 12.2490 12.7884 12.7884 13.4108 13.4108 13.4413 13.4413 k = 0.0000 0.4048-0.0000 ( 1960 PWs) bands (ev): -0.3579 -0.3579 4.9830 4.9830 5.4494 5.4494 5.5573 5.5573 5.7685 5.7685 5.8225 5.8225 6.0198 6.0198 7.6570 7.6570 8.4612 8.4612 8.4629 8.4629 8.8559 8.8559 9.6159 9.6159 9.8893 9.8893 9.9089 9.9089 10.8414 10.8414 11.3255 11.3255 11.6710 11.6710 11.7029 11.7029 11.7083 11.7083 11.7693 11.7693 12.2276 12.2276 12.7885 12.7885 13.4301 13.4301 13.4609 13.4609 k = 0.0000 0.4167-0.0000 ( 1968 PWs) bands (ev): -0.3368 -0.3368 4.9578 4.9578 5.4507 5.4507 5.5563 5.5563 5.7694 5.7694 5.8232 5.8232 6.0237 6.0237 7.7059 7.7059 8.4517 8.4517 8.4533 8.4533 8.7709 8.7709 9.6180 9.6180 9.8884 9.8884 9.9081 9.9081 10.8668 10.8668 11.3133 11.3133 11.6684 11.6684 11.6977 11.6977 11.7053 11.7053 11.7662 11.7662 12.2079 12.2079 12.7886 12.7886 13.4476 13.4476 13.4785 13.4785 k = 0.0000 0.4286-0.0000 ( 1968 PWs) bands (ev): -0.3180 -0.3180 4.9349 4.9349 5.4519 5.4519 5.5556 5.5556 5.7702 5.7702 5.8238 5.8238 6.0266 6.0266 7.7603 7.7603 8.4436 8.4436 8.4449 8.4449 8.6858 8.6858 9.6198 9.6198 9.8877 9.8877 9.9075 9.9075 10.8900 10.8900 11.3028 11.3028 11.6663 11.6663 11.6926 11.6926 11.7027 11.7027 11.7633 11.7633 12.1903 12.1903 12.7886 12.7886 13.4630 13.4630 13.4942 13.4942 k = 0.0000 0.4405-0.0000 ( 1968 PWs) bands (ev): -0.3017 -0.3017 4.9147 4.9147 5.4528 5.4528 5.5550 5.5550 5.7708 5.7708 5.8243 5.8243 6.0289 6.0289 7.8196 7.8196 8.4366 8.4366 8.4377 8.4377 8.6010 8.6010 9.6213 9.6213 9.8870 9.8870 9.9069 9.9069 10.9106 10.9106 11.2940 11.2940 11.6648 11.6648 11.6877 11.6877 11.7005 11.7005 11.7607 11.7607 12.1749 12.1749 12.7886 12.7886 13.4764 13.4764 13.5076 13.5076 k = 0.0000 0.4524-0.0000 ( 1968 PWs) bands (ev): -0.2881 -0.2881 4.8976 4.8976 5.4536 5.4536 5.5545 5.5545 5.7714 5.7714 5.8247 5.8247 6.0306 6.0306 7.8831 7.8831 8.4310 8.4310 8.4317 8.4317 8.5172 8.5172 9.6223 9.6223 9.8864 9.8864 9.9064 9.9064 10.9281 10.9281 11.2867 11.2867 11.6637 11.6637 11.6830 11.6830 11.6987 11.6987 11.7585 11.7585 12.1622 12.1622 12.7887 12.7887 13.4874 13.4874 13.5188 13.5189 k = 0.0000 0.4643-0.0000 ( 1968 PWs) bands (ev): -0.2774 -0.2774 4.8839 4.8839 5.4542 5.4542 5.5541 5.5541 5.7718 5.7718 5.8251 5.8251 6.0318 6.0318 7.9499 7.9499 8.4236 8.4236 8.4266 8.4266 8.4380 8.4380 9.6233 9.6233 9.8859 9.8859 9.9059 9.9059 10.9423 10.9423 11.2812 11.2812 11.6634 11.6634 11.6787 11.6787 11.6973 11.6973 11.7568 11.7568 12.1519 12.1519 12.7887 12.7887 13.4961 13.4961 13.5277 13.5277 k = 0.0000 0.4762-0.0000 ( 1968 PWs) bands (ev): -0.2696 -0.2696 4.8739 4.8739 5.4547 5.4547 5.5538 5.5538 5.7721 5.7721 5.8254 5.8254 6.0326 6.0326 8.0186 8.0186 8.3535 8.3535 8.4234 8.4234 8.4250 8.4250 9.6240 9.6240 9.8855 9.8855 9.9055 9.9055 10.9528 10.9528 11.2772 11.2772 11.6637 11.6637 11.6750 11.6750 11.6963 11.6963 11.7555 11.7555 12.1445 12.1445 12.7887 12.7887 13.5024 13.5024 13.5340 13.5340 k = 0.0000 0.4881-0.0000 ( 1976 PWs) bands (ev): -0.2650 -0.2650 4.8678 4.8678 5.4549 5.4549 5.5536 5.5536 5.7722 5.7722 5.8255 5.8255 6.0331 6.0331 8.0848 8.0848 8.2808 8.2808 8.4215 8.4215 8.4227 8.4227 9.6244 9.6244 9.8852 9.8852 9.9053 9.9053 10.9591 10.9591 11.2749 11.2749 11.6644 11.6644 11.6720 11.6720 11.6955 11.6955 11.7545 11.7545 12.1400 12.1400 12.7887 12.7887 13.5061 13.5061 13.5378 13.5378 k = 0.0000 0.5000-0.0000 ( 1984 PWs) bands (ev): -0.2634 -0.2634 4.8657 4.8657 5.4550 5.4550 5.5535 5.5535 5.7723 5.7723 5.8255 5.8255 6.0331 6.0331 8.1233 8.1233 8.2400 8.2400 8.4208 8.4208 8.4220 8.4220 9.6245 9.6245 9.8852 9.8852 9.9052 9.9052 10.9612 10.9612 11.2738 11.2738 11.6649 11.6649 11.6707 11.6707 11.6952 11.6952 11.7541 11.7541 12.1385 12.1385 12.7887 12.7887 13.5074 13.5074 13.5390 13.5390 k = 0.0000 0.5000-0.0000 ( 1984 PWs) bands (ev): -0.2634 -0.2634 4.8657 4.8657 5.4550 5.4550 5.5535 5.5535 5.7723 5.7723 5.8255 5.8255 6.0331 6.0331 8.1233 8.1233 8.2400 8.2400 8.4208 8.4208 8.4220 8.4220 9.6245 9.6245 9.8852 9.8852 9.9052 9.9052 10.9612 10.9612 11.2738 11.2738 11.6649 11.6649 11.6707 11.6707 11.6952 11.6952 11.7541 11.7541 12.1385 12.1385 12.7887 12.7887 13.5074 13.5074 13.5390 13.5390 k = 0.0119 0.5000-0.0000 ( 1980 PWs) bands (ev): -0.2625 -0.2625 4.8666 4.8666 5.4551 5.4551 5.5535 5.5535 5.7724 5.7724 5.8256 5.8256 6.0330 6.0330 8.1221 8.1221 8.2346 8.2346 8.4192 8.4192 8.4243 8.4243 9.6270 9.6270 9.8856 9.8856 9.9056 9.9056 10.9607 10.9607 11.2738 11.2738 11.6524 11.6524 11.6724 11.6724 11.7032 11.7032 11.7566 11.7566 12.1386 12.1386 12.7863 12.7863 13.5087 13.5087 13.5405 13.5405 k = 0.0238 0.5000-0.0000 ( 1976 PWs) bands (ev): -0.2596 -0.2596 4.8691 4.8691 5.4554 5.4554 5.5534 5.5534 5.7726 5.7726 5.8256 5.8256 6.0328 6.0328 8.1187 8.1187 8.2190 8.2190 8.4131 8.4131 8.4322 8.4322 9.6339 9.6339 9.8868 9.8868 9.9068 9.9068 10.9591 10.9591 11.2736 11.2736 11.6316 11.6316 11.6718 11.6718 11.7160 11.7160 11.7643 11.7643 12.1388 12.1388 12.7794 12.7794 13.5123 13.5123 13.5456 13.5456 k = 0.0357 0.5000-0.0000 ( 1968 PWs) bands (ev): -0.2549 -0.2549 4.8733 4.8733 5.4559 5.4559 5.5533 5.5533 5.7729 5.7729 5.8257 5.8257 6.0325 6.0325 8.1130 8.1130 8.1947 8.1947 8.4031 8.4031 8.4439 8.4439 9.6454 9.6454 9.8887 9.8887 9.9088 9.9088 10.9563 10.9563 11.2732 11.2732 11.6085 11.6085 11.6698 11.6698 11.7269 11.7269 11.7772 11.7772 12.1390 12.1390 12.7680 12.7680 13.5166 13.5166 13.5554 13.5554 k = 0.0476 0.5000-0.0000 ( 1962 PWs) bands (ev): -0.2482 -0.2482 4.8792 4.8792 5.4566 5.4566 5.5531 5.5531 5.7733 5.7733 5.8259 5.8259 6.0320 6.0320 8.1051 8.1051 8.1631 8.1631 8.3894 8.3894 8.4580 8.4580 9.6610 9.6610 9.8912 9.8912 9.9116 9.9116 10.9526 10.9526 11.2725 11.2725 11.5843 11.5843 11.6663 11.6663 11.7365 11.7365 11.7935 11.7935 12.1394 12.1394 12.7528 12.7528 13.5203 13.5203 13.5705 13.5705 k = 0.0595 0.5000-0.0000 ( 1962 PWs) bands (ev): -0.2398 -0.2398 4.8867 4.8867 5.4575 5.4575 5.5529 5.5529 5.7739 5.7739 5.8260 5.8260 6.0313 6.0313 8.0948 8.0948 8.1252 8.1252 8.3722 8.3722 8.4739 8.4739 9.6804 9.6804 9.8942 9.8942 9.9152 9.9152 10.9479 10.9479 11.2710 11.2710 11.5591 11.5591 11.6618 11.6618 11.7464 11.7464 11.8112 11.8112 12.1397 12.1397 12.7342 12.7342 13.5232 13.5232 13.5905 13.5905 k = 0.0714 0.5000-0.0000 ( 1968 PWs) bands (ev): -0.2295 -0.2295 4.8958 4.8958 5.4584 5.4584 5.5526 5.5526 5.7745 5.7745 5.8261 5.8261 6.0304 6.0304 8.0766 8.0766 8.0874 8.0874 8.3521 8.3521 8.4913 8.4913 9.7033 9.7033 9.8975 9.8975 9.9194 9.9194 10.9422 10.9422 11.2687 11.2687 11.5331 11.5331 11.6563 11.6563 11.7576 11.7576 11.8295 11.8295 12.1401 12.1401 12.7125 12.7125 13.5254 13.5254 13.6147 13.6147 k = 0.0833 0.5000-0.0000 ( 1964 PWs) bands (ev): -0.2173 -0.2173 4.9065 4.9065 5.4596 5.4596 5.5522 5.5522 5.7753 5.7753 5.8263 5.8263 6.0294 6.0294 8.0295 8.0295 8.0710 8.0710 8.3293 8.3293 8.5102 8.5102 9.7293 9.7293 9.9012 9.9012 9.9242 9.9242 10.9360 10.9360 11.2654 11.2654 11.5068 11.5068 11.6504 11.6504 11.7704 11.7704 11.8477 11.8477 12.1404 12.1404 12.6887 12.6887 13.5271 13.5271 13.6422 13.6422 k = 0.0952 0.5000-0.0000 ( 1972 PWs) bands (ev): -0.2035 -0.2035 4.9187 4.9187 5.4609 5.4609 5.5518 5.5518 5.7762 5.7762 5.8265 5.8265 6.0282 6.0282 7.9747 7.9747 8.0556 8.0556 8.3044 8.3044 8.5305 8.5305 9.7580 9.7580 9.9051 9.9051 9.9292 9.9292 10.9291 10.9291 11.2607 11.2607 11.4799 11.4799 11.6446 11.6446 11.7851 11.7851 11.8655 11.8655 12.1406 12.1406 12.6626 12.6626 13.5281 13.5281 13.6723 13.6723 k = 0.1071 0.5000-0.0000 ( 1972 PWs) bands (ev): -0.1878 -0.1878 4.9324 4.9324 5.4624 5.4624 5.5513 5.5513 5.7772 5.7772 5.8268 5.8268 6.0269 6.0269 7.9147 7.9147 8.0390 8.0390 8.2776 8.2776 8.5521 8.5521 9.7890 9.7890 9.9094 9.9094 9.9344 9.9344 10.9218 10.9218 11.2545 11.2545 11.4528 11.4528 11.6394 11.6394 11.8015 11.8015 11.8829 11.8829 12.1407 12.1407 12.6352 12.6352 13.5285 13.5285 13.7049 13.7049 k = 0.1190 0.5000-0.0000 ( 1972 PWs) bands (ev): -0.1705 -0.1705 4.9477 4.9477 5.4639 5.4639 5.5509 5.5509 5.7783 5.7783 5.8272 5.8272 6.0255 6.0255 7.8502 7.8502 8.0212 8.0212 8.2493 8.2493 8.5751 8.5751 9.8220 9.8220 9.9139 9.9139 9.9394 9.9394 10.9142 10.9142 11.2466 11.2466 11.4254 11.4254 11.6352 11.6352 11.8196 11.8196 11.8997 11.8997 12.1407 12.1407 12.6064 12.6064 13.5282 13.5282 13.7393 13.7393 k = 0.1310 0.5000-0.0000 ( 1972 PWs) bands (ev): -0.1516 -0.1516 4.9643 4.9643 5.4656 5.4656 5.5504 5.5504 5.7795 5.7795 5.8276 5.8276 6.0240 6.0240 7.7813 7.7813 8.0025 8.0025 8.2198 8.2198 8.5996 8.5996 9.8566 9.8566 9.9186 9.9186 9.9438 9.9438 10.9065 10.9065 11.2370 11.2370 11.3978 11.3978 11.6321 11.6321 11.8393 11.8393 11.9158 11.9158 12.1403 12.1403 12.5768 12.5768 13.5270 13.5270 13.7752 13.7752 k = 0.1429 0.5000-0.0000 ( 1972 PWs) bands (ev): -0.1310 -0.1310 4.9822 4.9822 5.4674 5.4674 5.5499 5.5499 5.7808 5.7808 5.8281 5.8281 6.0223 6.0223 7.7084 7.7084 7.9829 7.9829 8.1894 8.1894 8.6255 8.6255 9.8925 9.8925 9.9236 9.9236 9.9478 9.9478 10.8987 10.8987 11.2256 11.2256 11.3700 11.3700 11.6305 11.6305 11.8605 11.8605 11.9313 11.9313 12.1395 12.1395 12.5464 12.5464 13.5251 13.5251 13.8123 13.8123 k = 0.1548 0.5000-0.0000 ( 1968 PWs) bands (ev): -0.1090 -0.1090 5.0014 5.0014 5.4692 5.4692 5.5495 5.5495 5.7822 5.7822 5.8288 5.8288 6.0206 6.0206 7.6322 7.6322 7.9628 7.9628 8.1584 8.1584 8.6529 8.6529 9.9286 9.9286 9.9291 9.9291 9.9513 9.9513 10.8913 10.8913 11.2128 11.2128 11.3423 11.3423 11.6304 11.6304 11.8831 11.8831 11.9460 11.9460 12.1384 12.1384 12.5155 12.5155 13.5222 13.5222 13.8505 13.8505 k = 0.1667 0.5000-0.0000 ( 1968 PWs) bands (ev): -0.0855 -0.0855 5.0218 5.0218 5.4711 5.4711 5.5490 5.5490 5.7837 5.7837 5.8296 5.8296 6.0187 6.0187 7.5529 7.5529 7.9422 7.9422 8.1270 8.1270 8.6816 8.6816 9.9333 9.9333 9.9504 9.9504 9.9699 9.9699 10.8843 10.8843 11.1984 11.1984 11.3145 11.3145 11.6317 11.6317 11.9070 11.9070 11.9601 11.9601 12.1367 12.1367 12.4841 12.4841 13.5184 13.5184 13.8894 13.8894 k = 0.1786 0.5000-0.0000 ( 1964 PWs) bands (ev): -0.0607 -0.0607 5.0433 5.0433 5.4730 5.4730 5.5487 5.5487 5.7852 5.7852 5.8304 5.8304 6.0167 6.0167 7.4710 7.4710 7.9214 7.9214 8.0954 8.0954 8.7117 8.7117 9.9367 9.9367 9.9532 9.9532 10.0078 10.0078 10.8778 10.8778 11.1829 11.1829 11.2868 11.2868 11.6343 11.6343 11.9322 11.9322 11.9734 11.9734 12.1345 12.1345 12.4525 12.4525 13.5136 13.5136 13.9289 13.9289 k = 0.1905 0.5000-0.0000 ( 1968 PWs) bands (ev): -0.0346 -0.0346 5.0658 5.0658 5.4749 5.4749 5.5483 5.5483 5.7868 5.7868 5.8313 5.8313 6.0146 6.0146 7.3869 7.3869 7.9005 7.9005 8.0638 8.0638 8.7431 8.7431 9.9371 9.9371 9.9565 9.9565 10.0466 10.0466 10.8720 10.8720 11.1664 11.1664 11.2592 11.2592 11.6381 11.6381 11.9584 11.9584 11.9857 11.9857 12.1317 12.1317 12.4207 12.4207 13.5080 13.5080 13.9687 13.9687 k = 0.2024 0.5000-0.0000 ( 1968 PWs) bands (ev): -0.0073 -0.0073 5.0892 5.0892 5.4768 5.4768 5.5481 5.5481 5.7884 5.7884 5.8324 5.8324 6.0124 6.0124 7.3010 7.3010 7.8796 7.8796 8.0324 8.0324 8.7757 8.7757 9.9338 9.9338 9.9616 9.9616 10.0860 10.0860 10.8670 10.8670 11.1493 11.1493 11.2318 11.2318 11.6428 11.6428 11.9854 11.9854 11.9975 11.9975 12.1284 12.1284 12.3888 12.3888 13.5017 13.5017 14.0089 14.0089 k = 0.2143 0.5000-0.0000 ( 1968 PWs) bands (ev): 0.0210 0.0210 5.1134 5.1134 5.4786 5.4786 5.5481 5.5481 5.7900 5.7900 5.8335 5.8335 6.0102 6.0102 7.2139 7.2139 7.8591 7.8591 8.0013 8.0013 8.8094 8.8094 9.9272 9.9272 9.9679 9.9679 10.1256 10.1256 10.8630 10.8630 11.1318 11.1318 11.2046 11.2046 11.6483 11.6483 12.0081 12.0081 12.0132 12.0132 12.1247 12.1247 12.3570 12.3570 13.4946 13.4946 14.0490 14.0490 k = 0.2262 0.5000-0.0000 ( 1972 PWs) bands (ev): 0.0503 0.0503 5.1382 5.1382 5.4804 5.4804 5.5482 5.5482 5.7916 5.7916 5.8348 5.8348 6.0078 6.0078 7.1258 7.1258 7.8388 7.8388 7.9706 7.9706 8.8440 8.8440 9.9176 9.9176 9.9750 9.9750 10.1652 10.1652 10.8599 10.8599 11.1143 11.1143 11.1778 11.1778 11.6543 11.6543 12.0181 12.0181 12.0407 12.0407 12.1212 12.1212 12.3253 12.3253 13.4867 13.4867 14.0892 14.0892 k = 0.2381 0.5000-0.0000 ( 1972 PWs) bands (ev): 0.0804 0.0804 5.1637 5.1637 5.4820 5.4820 5.5486 5.5486 5.7932 5.7932 5.8362 5.8362 6.0054 6.0054 7.0373 7.0373 7.8192 7.8192 7.9405 7.9405 8.8795 8.8795 9.9055 9.9055 9.9825 9.9825 10.2046 10.2046 10.8579 10.8579 11.0968 11.0968 11.1515 11.1515 11.6608 11.6608 12.0268 12.0268 12.0663 12.0663 12.1200 12.1200 12.2938 12.2938 13.4785 13.4785 14.1291 14.1291 k = 0.2500 0.5000-0.0000 ( 1986 PWs) bands (ev): 0.1111 0.1111 5.1895 5.1895 5.4836 5.4836 5.5491 5.5491 5.7946 5.7946 5.8375 5.8375 6.0029 6.0029 6.9487 6.9487 7.8002 7.8002 7.9109 7.9109 8.9158 8.9158 9.8908 9.8908 9.9904 9.9904 10.2437 10.2437 10.8567 10.8567 11.0794 11.0794 11.1255 11.1255 11.6675 11.6675 12.0339 12.0339 12.0831 12.0831 12.1278 12.1278 12.2624 12.2624 13.4697 13.4697 14.1685 14.1685 k = 0.2619 0.5000-0.0000 ( 1972 PWs) bands (ev): 0.1425 0.1425 5.2156 5.2156 5.4852 5.4852 5.5502 5.5502 5.7962 5.7962 5.8391 5.8391 6.0004 6.0004 6.8607 6.8607 7.7820 7.7820 7.8823 7.8823 8.9527 8.9527 9.8740 9.8740 9.9987 9.9987 10.2826 10.2826 10.8567 10.8567 11.0624 11.0624 11.1007 11.1007 11.6743 11.6743 12.0389 12.0389 12.0871 12.0871 12.1499 12.1499 12.2317 12.2317 13.4608 13.4608 14.2076 14.2076 k = 0.2738 0.5000-0.0000 ( 1964 PWs) bands (ev): 0.1743 0.1743 5.2418 5.2418 5.4866 5.4866 5.5515 5.5515 5.7976 5.7976 5.8407 5.8407 5.9979 5.9979 6.7734 6.7734 7.7648 7.7648 7.8546 7.8546 8.9900 8.9900 9.8547 9.8547 10.0074 10.0074 10.3209 10.3209 10.8575 10.8575 11.0456 11.0456 11.0770 11.0770 11.6810 11.6810 12.0404 12.0404 12.0864 12.0864 12.1778 12.1778 12.2024 12.2024 13.4516 13.4516 14.2460 14.2460 k = 0.2857 0.5000-0.0000 ( 1968 PWs) bands (ev): 0.2062 0.2062 5.2678 5.2678 5.4879 5.4879 5.5533 5.5533 5.7989 5.7989 5.8421 5.8421 5.9952 5.9952 6.6874 6.6874 7.7484 7.7484 7.8277 7.8277 9.0275 9.0275 9.8334 9.8334 10.0160 10.0160 10.3585 10.3585 10.8590 10.8590 11.0283 11.0283 11.0552 11.0552 11.6875 11.6875 12.0372 12.0372 12.0867 12.0867 12.1696 12.1696 12.2120 12.2120 13.4424 13.4424 14.2835 14.2835 k = 0.2976 0.5000-0.0000 ( 1968 PWs) bands (ev): 0.2382 0.2382 5.2936 5.2936 5.4891 5.4891 5.5555 5.5555 5.8000 5.8000 5.8436 5.8436 5.9926 5.9926 6.6031 6.6031 7.7332 7.7332 7.8019 7.8019 9.0650 9.0650 9.8103 9.8103 10.0248 10.0248 10.3954 10.3954 10.8613 10.8613 11.0100 11.0100 11.0363 11.0363 11.6935 11.6935 12.0297 12.0297 12.0890 12.0890 12.1404 12.1404 12.2444 12.2444 13.4331 13.4331 14.3160 14.3160 k = 0.3095 0.5000-0.0000 ( 1972 PWs) bands (ev): 0.2700 0.2700 5.3188 5.3188 5.4903 5.4903 5.5583 5.5583 5.8009 5.8009 5.8449 5.8449 5.9899 5.9899 6.5208 6.5208 7.7190 7.7190 7.7772 7.7772 9.1022 9.1022 9.7857 9.7857 10.0337 10.0337 10.4315 10.4315 10.8638 10.8638 10.9901 10.9901 11.0209 11.0209 11.6991 11.6991 12.0188 12.0188 12.0927 12.0927 12.1115 12.1115 12.2778 12.2778 13.4240 13.4240 14.2371 14.2371 k = 0.3214 0.5000-0.0000 ( 1972 PWs) bands (ev): 0.3015 0.3015 5.3433 5.3433 5.4915 5.4915 5.5617 5.5617 5.8016 5.8016 5.8461 5.8461 5.9871 5.9871 6.4411 6.4411 7.7060 7.7060 7.7537 7.7537 9.1391 9.1391 9.7600 9.7600 10.0426 10.0426 10.4666 10.4666 10.8666 10.8666 10.9695 10.9695 11.0085 11.0085 11.7039 11.7039 12.0060 12.0060 12.0831 12.0831 12.0972 12.0972 12.3119 12.3119 13.4152 13.4152 14.1496 14.1496 k = 0.3333 0.5000-0.0000 ( 1976 PWs) bands (ev): 0.3325 0.3325 5.3667 5.3667 5.4927 5.4927 5.5658 5.5658 5.8021 5.8021 5.8471 5.8471 5.9842 5.9842 6.3643 6.3643 7.6942 7.6942 7.7314 7.7314 9.1754 9.1754 9.7334 9.7334 10.0515 10.0515 10.5005 10.5005 10.8696 10.8696 10.9488 10.9488 10.9985 10.9985 11.7080 11.7080 11.9918 11.9918 12.0557 12.0557 12.1016 12.1016 12.3463 12.3463 13.4066 13.4066 14.0652 14.0652 k = 0.3452 0.5000-0.0000 ( 1970 PWs) bands (ev): 0.3627 0.3627 5.3888 5.3888 5.4940 5.4940 5.5709 5.5709 5.8022 5.8022 5.8478 5.8478 5.9812 5.9812 6.2911 6.2911 7.6835 7.6835 7.7104 7.7104 9.2108 9.2108 9.7064 9.7064 10.0604 10.0604 10.5333 10.5333 10.8724 10.8724 10.9288 10.9288 10.9906 10.9906 11.7110 11.7110 11.9771 11.9771 12.0291 12.0291 12.1061 12.1061 12.3811 12.3811 13.3984 13.3984 13.9841 13.9841 k = 0.3571 0.5000-0.0000 ( 1978 PWs) bands (ev): 0.3920 0.3920 5.4092 5.4092 5.4954 5.4954 5.5770 5.5770 5.8018 5.8018 5.8482 5.8482 5.9777 5.9777 6.2221 6.2221 7.6741 7.6741 7.6908 7.6908 9.2450 9.2450 9.6792 9.6792 10.0691 10.0691 10.5646 10.5646 10.8747 10.8747 10.9097 10.9097 10.9844 10.9844 11.7128 11.7128 11.9619 11.9619 12.0034 12.0034 12.1102 12.1102 12.4160 12.4160 13.3907 13.3907 13.9064 13.9064 k = 0.3690 0.5000-0.0000 ( 1972 PWs) bands (ev): 0.4200 0.4200 5.4278 5.4278 5.4971 5.4971 5.5842 5.5842 5.8008 5.8008 5.8483 5.8483 5.9736 5.9736 6.1581 6.1581 7.6656 7.6656 7.6728 7.6728 9.2781 9.2781 9.6523 9.6523 10.0776 10.0776 10.5944 10.5944 10.8759 10.8759 10.8928 10.8928 10.9801 10.9801 11.7134 11.7134 11.9470 11.9470 11.9792 11.9792 12.1140 12.1140 12.4509 12.4509 13.3834 13.3834 13.8325 13.8325 k = 0.3810 0.5000-0.0000 ( 1974 PWs) bands (ev): 0.4466 0.4466 5.4442 5.4442 5.4990 5.4990 5.5926 5.5926 5.7989 5.7989 5.8479 5.8479 5.9677 5.9677 6.1007 6.1007 7.6549 7.6549 7.6597 7.6597 9.3093 9.3093 9.6260 9.6260 10.0858 10.0858 10.6224 10.6224 10.8693 10.8693 10.8845 10.8845 10.9772 10.9772 11.7123 11.7123 11.9325 11.9325 11.9565 11.9565 12.1176 12.1176 12.4856 12.4856 13.3766 13.3766 13.7622 13.7622 k = 0.3929 0.5000-0.0000 ( 1970 PWs) bands (ev): 0.4715 0.4715 5.4584 5.4584 5.5014 5.5014 5.6021 5.6021 5.7955 5.7955 5.8471 5.8471 5.9581 5.9581 6.0530 6.0530 7.6400 7.6400 7.6532 7.6532 9.3385 9.3385 9.6008 9.6008 10.0937 10.0937 10.6485 10.6485 10.8552 10.8552 10.8847 10.8847 10.9758 10.9758 11.7098 11.7098 11.9184 11.9184 11.9360 11.9360 12.1208 12.1208 12.5200 12.5200 13.3703 13.3703 13.6960 13.6960 k = 0.4048 0.5000-0.0000 ( 1966 PWs) bands (ev): 0.4946 0.4946 5.4704 5.4704 5.5042 5.5042 5.6124 5.6124 5.7899 5.7899 5.8459 5.8459 5.9408 5.9408 6.0196 6.0196 7.6263 7.6263 7.6481 7.6481 9.3656 9.3656 9.5770 9.5770 10.1011 10.1011 10.6725 10.6725 10.8412 10.8412 10.8862 10.8862 10.9754 10.9754 11.7057 11.7057 11.9038 11.9038 11.9192 11.9192 12.1237 12.1237 12.5539 12.5539 13.3644 13.3644 13.6341 13.6341 k = 0.4167 0.5000-0.0000 ( 1966 PWs) bands (ev): 0.5155 0.5155 5.4803 5.4803 5.5076 5.5076 5.6233 5.6233 5.7807 5.7807 5.8443 5.8443 5.9161 5.9161 6.0019 6.0019 7.6140 7.6140 7.6440 7.6440 9.3902 9.3902 9.5549 9.5549 10.1079 10.1079 10.6939 10.6939 10.8286 10.8286 10.8877 10.8877 10.9758 10.9758 11.7003 11.7003 11.8882 11.8882 11.9067 11.9067 12.1262 12.1262 12.5867 12.5867 13.3588 13.3588 13.5769 13.5769 k = 0.4286 0.5000-0.0000 ( 1970 PWs) bands (ev): 0.5341 0.5341 5.4880 5.4880 5.5119 5.5119 5.6342 5.6342 5.7666 5.7666 5.8424 5.8424 5.8920 5.8920 5.9933 5.9933 7.6033 7.6033 7.6407 7.6407 9.4120 9.4120 9.5350 9.5350 10.1141 10.1141 10.7124 10.7124 10.8178 10.8178 10.8892 10.8892 10.9768 10.9768 11.6939 11.6939 11.8727 11.8727 11.8978 11.8978 12.1283 12.1283 12.6181 12.6181 13.3533 13.3533 13.5251 13.5251 k = 0.4405 0.5000-0.0000 ( 1974 PWs) bands (ev): 0.5502 0.5502 5.4937 5.4937 5.5173 5.5173 5.6446 5.6446 5.7478 5.7478 5.8404 5.8404 5.8739 5.8739 5.9887 5.9887 7.5942 7.5942 7.6381 7.6381 9.4309 9.4309 9.5175 9.5175 10.1195 10.1195 10.7276 10.7276 10.8094 10.8094 10.8906 10.8906 10.9780 10.9780 11.6870 11.6870 11.8587 11.8587 11.8913 11.8913 12.1301 12.1301 12.6474 12.6474 13.3476 13.3476 13.4794 13.4794 k = 0.4524 0.5000-0.0000 ( 1974 PWs) bands (ev): 0.5637 0.5637 5.4978 5.4978 5.5236 5.5236 5.6540 5.6540 5.7264 5.7264 5.8384 5.8384 5.8622 5.8622 5.9861 5.9861 7.5868 7.5868 7.6362 7.6362 9.4466 9.4466 9.5028 9.5028 10.1241 10.1241 10.7391 10.7391 10.8036 10.8036 10.8920 10.8920 10.9794 10.9794 11.6804 11.6804 11.8467 11.8467 11.8866 11.8866 12.1316 12.1316 12.6739 12.6739 13.3412 13.3412 13.4415 13.4415 k = 0.4643 0.5000-0.0000 ( 1974 PWs) bands (ev): 0.5743 0.5743 5.5006 5.5006 5.5304 5.5304 5.6618 5.6618 5.7055 5.7055 5.8366 5.8366 5.8549 5.8549 5.9844 5.9844 7.5809 7.5809 7.6349 7.6349 9.4590 9.4590 9.4911 9.4911 10.1277 10.1277 10.7466 10.7466 10.8007 10.8007 10.8931 10.8931 10.9807 10.9807 11.6745 11.6745 11.8371 11.8371 11.8833 11.8833 12.1327 12.1327 12.6965 12.6965 13.3335 13.3335 13.4129 13.4129 k = 0.4762 0.5000-0.0000 ( 1970 PWs) bands (ev): 0.5820 0.5820 5.5024 5.5024 5.5369 5.5369 5.6671 5.6671 5.6886 5.6886 5.8351 5.8351 5.8507 5.8507 5.9835 5.9835 7.5768 7.5768 7.6339 7.6339 9.4678 9.4678 9.4828 9.4828 10.1305 10.1305 10.7505 10.7505 10.8001 10.8001 10.8940 10.8940 10.9818 10.9818 11.6699 11.6699 11.8301 11.8301 11.8811 11.8811 12.1336 12.1336 12.7140 12.7140 13.3247 13.3247 13.3943 13.3943 k = 0.4881 0.5000-0.0000 ( 1966 PWs) bands (ev): 0.5866 0.5866 5.5035 5.5035 5.5417 5.5417 5.6679 5.6679 5.6796 5.6796 5.8341 5.8341 5.8485 5.8485 5.9829 5.9829 7.5743 7.5743 7.6334 7.6334 9.4725 9.4725 9.4784 9.4784 10.1322 10.1322 10.7522 10.7522 10.8006 10.8006 10.8946 10.8946 10.9824 10.9824 11.6669 11.6669 11.8259 11.8259 11.8799 11.8799 12.1341 12.1341 12.7251 12.7251 13.3172 13.3172 13.3847 13.3847 k = 0.5000 0.5000-0.0000 ( 1956 PWs) bands (ev): 0.5882 0.5882 5.5038 5.5038 5.5436 5.5436 5.6663 5.6663 5.6782 5.6782 5.8338 5.8338 5.8479 5.8479 5.9828 5.9828 7.5735 7.5735 7.6333 7.6333 9.4732 9.4732 9.4779 9.4779 10.1328 10.1328 10.7526 10.7526 10.8010 10.8010 10.8948 10.8948 10.9828 10.9828 11.6660 11.6660 11.8245 11.8245 11.8795 11.8795 12.1343 12.1343 12.7290 12.7290 13.3144 13.3144 13.3819 13.3819 k = 0.5000 0.5000-0.0000 ( 1956 PWs) bands (ev): 0.5882 0.5882 5.5038 5.5038 5.5436 5.5436 5.6663 5.6663 5.6782 5.6782 5.8338 5.8338 5.8479 5.8479 5.9828 5.9828 7.5735 7.5735 7.6333 7.6333 9.4732 9.4732 9.4779 9.4779 10.1328 10.1328 10.7526 10.7526 10.8010 10.8010 10.8948 10.8948 10.9828 10.9828 11.6660 11.6660 11.8245 11.8245 11.8795 11.8795 12.1343 12.1343 12.7290 12.7290 13.3144 13.3144 13.3819 13.3819 k = 0.4915 0.4915-0.0000 ( 1971 PWs) bands (ev): 0.5866 0.5866 5.5034 5.5034 5.5417 5.5417 5.6686 5.6686 5.6789 5.6789 5.8341 5.8341 5.8485 5.8485 5.9828 5.9828 7.5743 7.5743 7.6334 7.6334 9.4730 9.4730 9.4779 9.4779 10.1321 10.1321 10.7521 10.7521 10.8006 10.8006 10.8945 10.8945 10.9824 10.9824 11.6668 11.6668 11.8259 11.8259 11.8799 11.8799 12.1341 12.1341 12.7251 12.7251 13.3173 13.3173 13.3848 13.3848 k = 0.4831 0.4831-0.0000 ( 1975 PWs) bands (ev): 0.5819 0.5819 5.5023 5.5023 5.5366 5.5366 5.6751 5.6751 5.6810 5.6810 5.8349 5.8349 5.8509 5.8509 5.9834 5.9834 7.5768 7.5768 7.6339 7.6339 9.4718 9.4718 9.4788 9.4788 10.1304 10.1304 10.7505 10.7505 10.8001 10.8001 10.8938 10.8938 10.9817 10.9817 11.6699 11.6699 11.8301 11.8301 11.8811 11.8811 12.1335 12.1335 12.7139 12.7139 13.3245 13.3245 13.3948 13.3948 k = 0.4746 0.4746-0.0000 ( 1975 PWs) bands (ev): 0.5740 0.5740 5.5000 5.5000 5.5299 5.5299 5.6840 5.6840 5.6852 5.6852 5.8356 5.8356 5.8553 5.8553 5.9844 5.9844 7.5811 7.5811 7.6348 7.6348 9.4689 9.4689 9.4815 9.4815 10.1277 10.1277 10.7465 10.7465 10.8007 10.8007 10.8927 10.8927 10.9808 10.9808 11.6750 11.6750 11.8372 11.8372 11.8829 11.8829 12.1327 12.1327 12.6964 12.6964 13.3322 13.3322 13.4145 13.4145 k = 0.4661 0.4661-0.0000 ( 1975 PWs) bands (ev): 0.5632 0.5632 5.4959 5.4959 5.5233 5.5233 5.6881 5.6881 5.6974 5.6974 5.8361 5.8361 5.8619 5.8619 5.9860 5.9860 7.5870 7.5870 7.6361 7.6361 9.4645 9.4645 9.4857 9.4857 10.1240 10.1240 10.7390 10.7390 10.8037 10.8037 10.8909 10.8909 10.9798 10.9798 11.6822 11.6822 11.8469 11.8469 11.8855 11.8855 12.1316 12.1316 12.6740 12.6740 13.3380 13.3380 13.4448 13.4448 k = 0.4576 0.4576-0.0000 ( 1975 PWs) bands (ev): 0.5493 0.5493 5.4895 5.4895 5.5182 5.5182 5.6922 5.6922 5.7117 5.7117 5.8362 5.8362 5.8707 5.8707 5.9884 5.9884 7.5945 7.5945 7.6377 7.6377 9.4591 9.4591 9.4912 9.4912 10.1194 10.1194 10.7275 10.7275 10.8096 10.8096 10.8882 10.8882 10.9790 10.9790 11.6913 11.6913 11.8589 11.8589 11.8885 11.8885 12.1301 12.1301 12.6481 12.6481 13.3419 13.3419 13.4846 13.4846 k = 0.4492 0.4492-0.0000 ( 1969 PWs) bands (ev): 0.5325 0.5325 5.4811 5.4811 5.5149 5.5149 5.6961 5.6961 5.7277 5.7277 5.8360 5.8360 5.8810 5.8810 5.9919 5.9919 7.6038 7.6038 7.6398 7.6398 9.4531 9.4531 9.4980 9.4980 10.1140 10.1140 10.7123 10.7123 10.8182 10.8182 10.8844 10.8844 10.9789 10.9789 11.7024 11.7024 11.8727 11.8727 11.8921 11.8921 12.1285 12.1285 12.6198 12.6198 13.3445 13.3445 13.5318 13.5318 k = 0.4407 0.4407-0.0000 ( 1969 PWs) bands (ev): 0.5128 0.5128 5.4719 5.4719 5.5127 5.5127 5.6995 5.6995 5.7449 5.7449 5.8357 5.8357 5.8926 5.8926 5.9968 5.9968 7.6146 7.6146 7.6424 7.6424 9.4466 9.4466 9.5059 9.5059 10.1078 10.1078 10.6940 10.6940 10.8291 10.8291 10.8793 10.8793 10.9795 10.9795 11.7152 11.7152 11.8864 11.8864 11.8977 11.8977 12.1266 12.1266 12.5902 12.5902 13.3464 13.3464 13.5848 13.5848 k = 0.4322 0.4322-0.0000 ( 1969 PWs) bands (ev): 0.4905 0.4905 5.4625 5.4625 5.5110 5.5110 5.7023 5.7023 5.7630 5.7630 5.8353 5.8353 5.9050 5.9050 6.0034 6.0034 7.6270 7.6270 7.6454 7.6454 9.4400 9.4400 9.5150 9.5150 10.1009 10.1009 10.6731 10.6731 10.8419 10.8419 10.8727 10.8727 10.9813 10.9813 11.7298 11.7298 11.8939 11.8939 11.9108 11.9108 12.1245 12.1245 12.5599 12.5599 13.3478 13.3478 13.6425 13.6425 k = 0.4237 0.4237-0.0000 ( 1969 PWs) bands (ev): 0.4656 0.4656 5.4535 5.4535 5.5097 5.5097 5.7045 5.7045 5.7811 5.7811 5.8350 5.8350 5.9181 5.9181 6.0121 6.0121 7.6409 7.6409 7.6492 7.6492 9.4337 9.4337 9.5252 9.5252 10.0935 10.0935 10.6499 10.6499 10.8562 10.8562 10.8647 10.8647 10.9844 10.9844 11.7461 11.7461 11.8971 11.8971 11.9290 11.9290 12.1221 12.1221 12.5296 12.5296 13.3491 13.3491 13.7041 13.7041 k = 0.4153 0.4153-0.0000 ( 1969 PWs) bands (ev): 0.4381 0.4381 5.4450 5.4450 5.5085 5.5085 5.7061 5.7061 5.7982 5.7982 5.8350 5.8350 5.9321 5.9321 6.0232 6.0232 7.6524 7.6524 7.6574 7.6574 9.4279 9.4279 9.5365 9.5365 10.0857 10.0857 10.6248 10.6248 10.8546 10.8546 10.8727 10.8727 10.9890 10.9890 11.7638 11.7638 11.8987 11.8987 11.9490 11.9490 12.1198 12.1198 12.4997 12.4997 13.3501 13.3501 13.7689 13.7689 k = 0.4068 0.4068-0.0000 ( 1969 PWs) bands (ev): 0.4084 0.4084 5.4374 5.4374 5.5073 5.5073 5.7071 5.7071 5.8124 5.8124 5.8360 5.8360 5.9476 5.9476 6.0370 6.0370 7.6578 7.6578 7.6741 7.6741 9.4230 9.4230 9.5488 9.5488 10.0775 10.0775 10.5982 10.5982 10.8435 10.8435 10.8899 10.8899 10.9951 10.9951 11.7830 11.7830 11.8990 11.8990 11.9698 11.9698 12.1177 12.1177 12.4706 12.4706 13.3510 13.3510 13.8363 13.8363 k = 0.3983 0.3983-0.0000 ( 1967 PWs) bands (ev): 0.3765 0.3765 5.4305 5.4305 5.5062 5.5062 5.7076 5.7076 5.8211 5.8211 5.8396 5.8396 5.9647 5.9647 6.0538 6.0538 7.6636 7.6636 7.6926 7.6926 9.4193 9.4193 9.5621 9.5621 10.0691 10.0691 10.5701 10.5701 10.8311 10.8311 10.9084 10.9084 11.0028 11.0028 11.8036 11.8036 11.8978 11.8978 11.9909 11.9909 12.1160 12.1160 12.4427 12.4427 13.3518 13.3518 13.9060 13.9060 k = 0.3898 0.3898-0.0000 ( 1963 PWs) bands (ev): 0.3425 0.3425 5.4245 5.4245 5.5051 5.5051 5.7077 5.7077 5.8242 5.8242 5.8455 5.8455 5.9827 5.9827 6.0744 6.0744 7.6702 7.6702 7.7127 7.7127 9.4171 9.4171 9.5762 9.5762 10.0605 10.0605 10.5410 10.5410 10.8174 10.8174 10.9281 10.9281 11.0120 11.0120 11.8252 11.8252 11.8950 11.8950 12.0113 12.0113 12.1152 12.1152 12.4166 12.4166 13.3524 13.3524 13.9776 13.9776 k = 0.3814 0.3814-0.0000 ( 1969 PWs) bands (ev): 0.3067 0.3067 5.4193 5.4193 5.5039 5.5039 5.7074 5.7074 5.8245 5.8245 5.8506 5.8506 6.0002 6.0002 6.1000 6.1000 7.6777 7.6777 7.7341 7.7341 9.4166 9.4166 9.5912 9.5912 10.0516 10.0516 10.5109 10.5109 10.8026 10.8026 10.9484 10.9484 11.0227 11.0227 11.8476 11.8476 11.8906 11.8906 12.0300 12.0300 12.1164 12.1164 12.3922 12.3922 13.3529 13.3529 14.0505 14.0505 k = 0.3729 0.3729-0.0000 ( 1969 PWs) bands (ev): 0.2692 0.2692 5.4149 5.4149 5.5027 5.5027 5.7068 5.7068 5.8239 5.8239 5.8539 5.8539 6.0154 6.0154 6.1315 6.1315 7.6864 7.6864 7.7569 7.7569 9.4181 9.4181 9.6070 9.6070 10.0428 10.0428 10.4800 10.4800 10.7870 10.7870 10.9695 10.9695 11.0350 11.0350 11.8682 11.8682 11.8868 11.8868 12.0449 12.0449 12.1215 12.1215 12.3698 12.3698 13.3532 13.3532 14.1245 14.1245 k = 0.3644 0.3644-0.0000 ( 1965 PWs) bands (ev): 0.2301 0.2301 5.4112 5.4112 5.5015 5.5015 5.7060 5.7060 5.8230 5.8230 5.8555 5.8555 6.0274 6.0274 6.1690 6.1690 7.6964 7.6964 7.7810 7.7810 9.4217 9.4217 9.6236 9.6236 10.0340 10.0340 10.4485 10.4485 10.7705 10.7705 10.9912 10.9912 11.0490 11.0490 11.8695 11.8695 11.9009 11.9009 12.0542 12.0542 12.1323 12.1323 12.3498 12.3498 13.3533 13.3533 14.1991 14.1991 k = 0.3559 0.3559-0.0000 ( 1973 PWs) bands (ev): 0.1896 0.1896 5.4082 5.4082 5.5001 5.5001 5.7049 5.7049 5.8218 5.8218 5.8555 5.8555 6.0360 6.0360 6.2119 6.2119 7.7076 7.7076 7.8064 7.8064 9.4272 9.4272 9.6407 9.6407 10.0251 10.0251 10.4164 10.4164 10.7533 10.7533 11.0133 11.0133 11.0645 11.0645 11.8589 11.8589 11.9254 11.9254 12.0578 12.0578 12.1484 12.1484 12.3321 12.3321 13.3531 13.3531 14.2698 14.2698 k = 0.3475 0.3475-0.0000 ( 1973 PWs) bands (ev): 0.1480 0.1480 5.4058 5.4058 5.4987 5.4987 5.7036 5.7036 5.8205 5.8205 5.8544 5.8544 6.0413 6.0413 6.2595 6.2595 7.7204 7.7204 7.8330 7.8330 9.4352 9.4352 9.6586 9.6586 10.0164 10.0164 10.3841 10.3841 10.7356 10.7356 11.0358 11.0358 11.0818 11.0818 11.8451 11.8451 11.9514 11.9514 12.0576 12.0576 12.1682 12.1682 12.3168 12.3168 13.3527 13.3527 14.2519 14.2519 k = 0.3390 0.3390-0.0000 ( 1971 PWs) bands (ev): 0.1052 0.1052 5.4039 5.4039 5.4972 5.4972 5.7022 5.7022 5.8191 5.8191 5.8525 5.8525 6.0434 6.0434 6.3112 6.3112 7.7347 7.7347 7.8608 7.8608 9.4454 9.4454 9.6770 9.6770 10.0077 10.0077 10.3515 10.3515 10.7173 10.7173 11.0586 11.0586 11.1007 11.1007 11.8292 11.8292 11.9779 11.9779 12.0554 12.0554 12.1899 12.1899 12.3041 12.3041 13.3519 13.3519 14.2095 14.2095 k = 0.3305 0.3305-0.0000 ( 1971 PWs) bands (ev): 0.0616 0.0616 5.4025 5.4025 5.4956 5.4956 5.7006 5.7006 5.8177 5.8177 5.8500 5.8500 6.0426 6.0426 6.3666 6.3666 7.7508 7.7508 7.8898 7.8898 9.4577 9.4577 9.6958 9.6958 9.9991 9.9991 10.3188 10.3188 10.6986 10.6986 11.0816 11.0816 11.1213 11.1213 11.8114 11.8114 12.0039 12.0039 12.0529 12.0529 12.2116 12.2116 12.2940 12.2940 13.3508 13.3508 14.1651 14.1651 k = 0.3220 0.3220-0.0000 ( 1963 PWs) bands (ev): 0.0173 0.0173 5.4015 5.4015 5.4940 5.4940 5.6988 5.6988 5.8163 5.8163 5.8471 5.8471 6.0390 6.0390 6.4254 6.4254 7.7687 7.7687 7.9198 7.9198 9.4722 9.4722 9.7151 9.7151 9.9907 9.9907 10.2861 10.2861 10.6796 10.6796 11.1050 11.1050 11.1435 11.1435 11.7921 11.7921 12.0253 12.0253 12.0547 12.0547 12.2315 12.2315 12.2879 12.2879 13.3492 13.3492 14.1194 14.1194 k = 0.3136 0.3136-0.0000 ( 1967 PWs) bands (ev): -0.0276 -0.0276 5.4007 5.4007 5.4922 5.4922 5.6969 5.6969 5.8147 5.8147 5.8437 5.8437 6.0327 6.0327 6.4872 6.4872 7.7883 7.7883 7.9509 7.9509 9.4884 9.4884 9.7346 9.7346 9.9824 9.9824 10.2534 10.2534 10.6602 10.6602 11.1287 11.1287 11.1668 11.1668 11.7719 11.7719 12.0314 12.0314 12.0714 12.0714 12.2450 12.2450 12.2896 12.2896 13.3470 13.3470 14.0725 14.0725 k = 0.3051 0.3051-0.0000 ( 1969 PWs) bands (ev): -0.0730 -0.0730 5.4002 5.4002 5.4902 5.4902 5.6948 5.6948 5.8130 5.8130 5.8402 5.8402 6.0238 6.0238 6.5520 6.5520 7.8100 7.8100 7.9830 7.9830 9.5062 9.5062 9.7544 9.7544 9.9741 9.9741 10.2208 10.2208 10.6406 10.6406 11.1529 11.1529 11.1913 11.1913 11.7511 11.7511 12.0282 12.0282 12.0971 12.0971 12.2483 12.2483 12.3027 12.3027 13.3442 13.3442 14.0247 14.0247 k = 0.2966 0.2966-0.0000 ( 1969 PWs) bands (ev): -0.1186 -0.1186 5.3998 5.3998 5.4881 5.4881 5.6925 5.6925 5.8112 5.8112 5.8366 5.8366 6.0126 6.0126 6.6195 6.6195 7.8336 7.8336 8.0160 8.0160 9.5255 9.5255 9.7745 9.7745 9.9662 9.9662 10.1882 10.1882 10.6209 10.6209 11.1777 11.1777 11.2167 11.2167 11.7300 11.7300 12.0228 12.0228 12.1246 12.1246 12.2457 12.2457 12.3225 12.3225 13.3408 13.3408 13.9760 13.9760 k = 0.2881 0.2881-0.0000 ( 1967 PWs) bands (ev): -0.1644 -0.1644 5.3996 5.3996 5.4859 5.4859 5.6901 5.6901 5.8092 5.8092 5.8330 5.8330 5.9992 5.9992 6.6896 6.6896 7.8593 7.8593 8.0500 8.0500 9.5459 9.5459 9.7946 9.7946 9.9582 9.9582 10.1562 10.1562 10.6012 10.6012 11.2032 11.2032 11.2428 11.2428 11.7094 11.7094 12.0168 12.0168 12.1514 12.1514 12.2422 12.2422 12.3445 12.3445 13.3366 13.3366 13.9267 13.9267 k = 0.2797 0.2797-0.0000 ( 1969 PWs) bands (ev): -0.2102 -0.2102 5.3994 5.3994 5.4835 5.4835 5.6874 5.6874 5.8070 5.8070 5.8295 5.8295 5.9838 5.9838 6.7621 6.7621 7.8869 7.8869 8.0848 8.0848 9.5671 9.5671 9.8147 9.8147 9.9503 9.9503 10.1244 10.1244 10.5813 10.5813 11.2292 11.2292 11.2695 11.2695 11.6896 11.6896 12.0105 12.0105 12.1757 12.1757 12.2407 12.2407 12.3671 12.3671 13.3315 13.3315 13.8768 13.8768 k = 0.2712 0.2712-0.0000 ( 1969 PWs) bands (ev): -0.2559 -0.2559 5.3992 5.3992 5.4809 5.4809 5.6845 5.6845 5.8045 5.8045 5.8262 5.8262 5.9668 5.9668 6.8370 6.8370 7.9166 7.9166 8.1204 8.1204 9.5887 9.5887 9.8348 9.8348 9.9424 9.9424 10.0931 10.0931 10.5616 10.5616 11.2558 11.2558 11.2966 11.2966 11.6709 11.6709 12.0040 12.0040 12.1925 12.1925 12.2461 12.2461 12.3897 12.3897 13.3255 13.3255 13.8265 13.8265 k = 0.2627 0.2627-0.0000 ( 1971 PWs) bands (ev): -0.3014 -0.3014 5.3991 5.3991 5.4780 5.4780 5.6812 5.6812 5.8016 5.8016 5.8232 5.8232 5.9485 5.9485 6.9142 6.9142 7.9483 7.9483 8.1567 8.1567 9.6103 9.6103 9.8548 9.8548 9.9346 9.9346 10.0622 10.0622 10.5419 10.5419 11.2827 11.2827 11.3241 11.3241 11.6537 11.6537 11.9975 11.9975 12.1974 12.1974 12.2630 12.2630 12.4122 12.4122 13.3184 13.3184 13.7759 13.7759 k = 0.2542 0.2542-0.0000 ( 1967 PWs) bands (ev): -0.3465 -0.3465 5.3988 5.3988 5.4751 5.4751 5.6775 5.6775 5.7983 5.7983 5.8206 5.8206 5.9291 5.9291 6.9935 6.9935 7.9820 7.9820 8.1937 8.1937 9.6317 9.6317 9.8746 9.8746 9.9267 9.9267 10.0319 10.0319 10.5224 10.5224 11.3101 11.3101 11.3521 11.3521 11.6384 11.6384 11.9909 11.9909 12.1942 12.1942 12.2873 12.2873 12.4343 12.4343 13.3102 13.3102 13.7253 13.7253 k = 0.2458 0.2458-0.0000 ( 1967 PWs) bands (ev): -0.3912 -0.3912 5.3985 5.3985 5.4719 5.4719 5.6732 5.6732 5.7946 5.7946 5.8183 5.8183 5.9091 5.9091 7.0747 7.0747 8.0176 8.0176 8.2314 8.2314 9.6525 9.6525 9.8942 9.8942 9.9188 9.9188 10.0021 10.0021 10.5030 10.5030 11.3374 11.3374 11.3804 11.3804 11.6253 11.6253 11.9843 11.9843 12.1875 12.1875 12.3141 12.3141 12.4559 12.4559 13.3008 13.3008 13.6747 13.6747 k = 0.2373 0.2373-0.0000 ( 1967 PWs) bands (ev): -0.4352 -0.4352 5.3981 5.3981 5.4686 5.4686 5.6681 5.6681 5.7906 5.7906 5.8163 5.8163 5.8889 5.8889 7.1579 7.1579 8.0550 8.0550 8.2697 8.2697 9.6722 9.6722 9.9108 9.9108 9.9133 9.9133 9.9732 9.9732 10.4839 10.4839 11.3646 11.3646 11.4090 11.4090 11.6147 11.6147 11.9777 11.9777 12.1790 12.1790 12.3416 12.3416 12.4771 12.4771 13.2900 13.2900 13.6244 13.6244 k = 0.2288 0.2288-0.0000 ( 1965 PWs) bands (ev): -0.4786 -0.4786 5.3977 5.3977 5.4650 5.4650 5.6621 5.6621 5.7863 5.7863 5.8145 5.8145 5.8690 5.8690 7.2428 7.2428 8.0942 8.0942 8.3085 8.3085 9.6906 9.6906 9.9026 9.9026 9.9308 9.9308 9.9463 9.9463 10.4650 10.4650 11.3913 11.3913 11.4380 11.4380 11.6070 11.6070 11.9712 11.9712 12.1693 12.1693 12.3693 12.3693 12.4978 12.4978 13.2778 13.2778 13.5743 13.5743 k = 0.2203 0.2203-0.0000 ( 1965 PWs) bands (ev): -0.5212 -0.5212 5.3971 5.3971 5.4613 5.4613 5.6548 5.6548 5.7817 5.7817 5.8128 5.8128 5.8499 5.8499 7.3294 7.3294 8.1351 8.1351 8.3479 8.3479 9.7075 9.7075 9.8939 9.8939 9.9161 9.9161 9.9520 9.9520 10.4463 10.4463 11.4171 11.4171 11.4671 11.4671 11.6025 11.6025 11.9648 11.9648 12.1585 12.1585 12.3969 12.3969 12.5179 12.5179 13.2641 13.2641 13.5248 13.5248 k = 0.2119 0.2119-0.0000 ( 1963 PWs) bands (ev): -0.5629 -0.5629 5.3964 5.3964 5.4575 5.4575 5.6459 5.6459 5.7768 5.7768 5.8108 5.8108 5.8326 5.8326 7.4174 7.4174 8.1775 8.1775 8.3876 8.3876 9.7225 9.7225 9.8830 9.8830 9.8918 9.8918 9.9697 9.9697 10.4279 10.4279 11.4417 11.4417 11.4963 11.4963 11.6012 11.6012 11.9585 11.9585 12.1468 12.1468 12.4241 12.4241 12.5374 12.5374 13.2489 13.2489 13.4759 13.4759 k = 0.2034 0.2034-0.0000 ( 1957 PWs) bands (ev): -0.6037 -0.6037 5.3956 5.3956 5.4535 5.4535 5.6353 5.6353 5.7717 5.7717 5.8068 5.8068 5.8193 5.8193 7.5068 7.5068 8.2216 8.2216 8.4277 8.4277 9.7354 9.7354 9.8612 9.8612 9.8786 9.8786 9.9872 9.9872 10.4099 10.4099 11.4648 11.4648 11.5254 11.5254 11.6038 11.6038 11.9524 11.9524 12.1342 12.1342 12.4508 12.4508 12.5564 12.5564 13.2320 13.2320 13.4278 13.4278 k = 0.1949 0.1949-0.0000 ( 1957 PWs) bands (ev): -0.6433 -0.6433 5.3947 5.3947 5.4494 5.4494 5.6226 5.6226 5.7664 5.7664 5.7975 5.7975 5.8135 5.8135 7.5972 7.5972 8.2670 8.2670 8.4682 8.4682 9.7461 9.7461 9.8362 9.8362 9.8689 9.8689 10.0040 10.0040 10.3922 10.3922 11.4863 11.4863 11.5541 11.5541 11.6104 11.6104 11.9463 11.9463 12.1207 12.1207 12.4770 12.4770 12.5746 12.5746 13.2135 13.2135 13.3807 13.3807 k = 0.1864 0.1864-0.0000 ( 1957 PWs) bands (ev): -0.6819 -0.6819 5.3936 5.3936 5.4453 5.4453 5.6080 5.6080 5.7608 5.7608 5.7869 5.7869 5.8114 5.8114 7.6887 7.6887 8.3136 8.3136 8.5089 8.5089 9.7544 9.7544 9.8118 9.8118 9.8592 9.8592 10.0203 10.0203 10.3747 10.3747 11.5060 11.5060 11.5819 11.5819 11.6210 11.6210 11.9403 11.9403 12.1065 12.1065 12.5025 12.5025 12.5922 12.5922 13.1933 13.1933 13.3346 13.3346 k = 0.1780 0.1780-0.0000 ( 1965 PWs) bands (ev): -0.7193 -0.7193 5.3924 5.3924 5.4409 5.4409 5.5914 5.5914 5.7551 5.7551 5.7778 5.7778 5.8102 5.8102 7.7810 7.7810 8.3614 8.3614 8.5499 8.5499 9.7604 9.7604 9.7881 9.7881 9.8490 9.8490 10.0357 10.0357 10.3576 10.3576 11.5242 11.5242 11.6082 11.6082 11.6354 11.6354 11.9345 11.9345 12.0915 12.0915 12.5273 12.5273 12.6090 12.6090 13.1714 13.1714 13.2897 13.2897 k = 0.1695 0.1695-0.0000 ( 1965 PWs) bands (ev): -0.7553 -0.7553 5.3912 5.3912 5.4366 5.4366 5.5734 5.5734 5.7496 5.7496 5.7703 5.7703 5.8092 5.8092 7.8738 7.8738 8.4102 8.4102 8.5910 8.5910 9.7625 9.7625 9.7667 9.7667 9.8384 9.8384 10.0504 10.0504 10.3408 10.3408 11.5414 11.5414 11.6325 11.6325 11.6535 11.6535 11.9289 11.9289 12.0760 12.0760 12.5514 12.5514 12.6251 12.6251 13.1482 13.1482 13.2462 13.2462 k = 0.1610 0.1610-0.0000 ( 1961 PWs) bands (ev): -0.7900 -0.7900 5.3899 5.3899 5.4324 5.4324 5.5543 5.5543 5.7446 5.7446 5.7640 5.7640 5.8085 5.8085 7.9671 7.9671 8.4599 8.4599 8.6321 8.6321 9.7430 9.7430 9.7658 9.7658 9.8272 9.8272 10.0644 10.0644 10.3244 10.3244 11.5579 11.5579 11.6545 11.6545 11.6742 11.6742 11.9235 11.9235 12.0597 12.0597 12.5747 12.5747 12.6408 12.6408 13.1236 13.1236 13.2044 13.2044 k = 0.1525 0.1525-0.0000 ( 1961 PWs) bands (ev): -0.8233 -0.8233 5.3884 5.3884 5.4281 5.4281 5.5346 5.5346 5.7402 5.7402 5.7586 5.7586 5.8078 5.8078 8.0604 8.0604 8.5102 8.5102 8.6733 8.6733 9.7221 9.7221 9.7648 9.7648 9.8154 9.8154 10.0774 10.0774 10.3083 10.3083 11.5744 11.5744 11.6751 11.6751 11.6956 11.6956 11.9183 11.9183 12.0432 12.0432 12.5972 12.5972 12.6555 12.6555 13.0977 13.0977 13.1641 13.1641 k = 0.1441 0.1441-0.0000 ( 1961 PWs) bands (ev): -0.8551 -0.8551 5.3867 5.3867 5.4239 5.4239 5.5147 5.5147 5.7364 5.7364 5.7537 5.7537 5.8071 5.8071 8.1537 8.1537 8.5612 8.5612 8.7145 8.7145 9.7021 9.7021 9.7617 9.7617 9.8028 9.8028 10.0895 10.0895 10.2925 10.2925 11.5909 11.5909 11.6949 11.6949 11.7162 11.7162 11.9133 11.9133 12.0265 12.0265 12.6188 12.6188 12.6695 12.6695 13.0709 13.0709 13.1256 13.1256 k = 0.1356 0.1356-0.0000 ( 1957 PWs) bands (ev): -0.8854 -0.8854 5.3849 5.3849 5.4197 5.4197 5.4950 5.4950 5.7331 5.7331 5.7494 5.7494 5.8065 5.8065 8.2464 8.2464 8.6125 8.6125 8.7556 8.7556 9.6831 9.6831 9.7565 9.7565 9.7896 9.7896 10.1005 10.1005 10.2772 10.2772 11.6075 11.6075 11.7143 11.7143 11.7349 11.7349 11.9085 11.9085 12.0098 12.0098 12.6394 12.6394 12.6828 12.6828 13.0435 13.0435 13.0891 13.0891 k = 0.1271 0.1271-0.0000 ( 1957 PWs) bands (ev): -0.9141 -0.9141 5.3828 5.3828 5.4157 5.4157 5.4759 5.4759 5.7304 5.7304 5.7453 5.7453 5.8059 5.8059 8.3385 8.3385 8.6639 8.6639 8.7965 8.7965 9.6652 9.6652 9.7495 9.7495 9.7755 9.7755 10.1105 10.1105 10.2623 10.2623 11.6241 11.6241 11.7329 11.7329 11.7511 11.7511 11.9039 11.9039 11.9933 11.9933 12.6591 12.6591 12.6953 12.6953 13.0157 13.0157 13.0546 13.0546 k = 0.1186 0.1186-0.0000 ( 1959 PWs) bands (ev): -0.9412 -0.9412 5.3803 5.3803 5.4117 5.4117 5.4577 5.4577 5.7280 5.7280 5.7416 5.7416 5.8054 5.8054 8.4293 8.4293 8.7154 8.7154 8.8371 8.8371 9.6483 9.6483 9.7405 9.7405 9.7605 9.7605 10.1192 10.1192 10.2479 10.2479 11.6406 11.6406 11.7509 11.7509 11.7644 11.7644 11.8995 11.8995 11.9772 11.9772 12.6776 12.6776 12.7070 12.7070 12.9881 12.9881 13.0221 13.0221 k = 0.1102 0.1102-0.0000 ( 1959 PWs) bands (ev): -0.9665 -0.9665 5.3772 5.3772 5.4079 5.4079 5.4409 5.4409 5.7260 5.7260 5.7381 5.7381 5.8049 5.8049 8.5186 8.5186 8.7667 8.7667 8.8774 8.8774 9.6324 9.6324 9.7300 9.7300 9.7448 9.7448 10.1267 10.1267 10.2339 10.2339 11.6566 11.6566 11.7679 11.7679 11.7745 11.7745 11.8952 11.8952 11.9619 11.9619 12.6950 12.6950 12.7183 12.7183 12.9611 12.9611 12.9919 12.9919 k = 0.1017 0.1017-0.0000 ( 1955 PWs) bands (ev): -0.9902 -0.9902 5.3731 5.3731 5.4042 5.4042 5.4262 5.4262 5.7242 5.7242 5.7349 5.7349 5.8044 5.8044 8.6059 8.6059 8.8176 8.8176 8.9173 8.9173 9.6178 9.6178 9.7179 9.7179 9.7282 9.7282 10.1330 10.1330 10.2205 10.2205 11.6720 11.6720 11.7813 11.7813 11.7839 11.7839 11.8910 11.8910 11.9477 11.9477 12.7109 12.7109 12.7289 12.7289 12.9353 12.9353 12.9639 12.9639 k = 0.0932 0.0932-0.0000 ( 1955 PWs) bands (ev): -1.0121 -1.0121 5.3675 5.3675 5.4007 5.4007 5.4141 5.4141 5.7227 5.7227 5.7320 5.7320 5.8040 5.8040 8.6907 8.6907 8.8678 8.8678 8.9566 8.9566 9.6042 9.6042 9.7042 9.7042 9.7108 9.7108 10.1380 10.1380 10.2078 10.2078 11.6863 11.6863 11.7848 11.7848 11.7987 11.7987 11.8867 11.8867 11.9350 11.9350 12.7249 12.7249 12.7395 12.7395 12.9110 12.9110 12.9381 12.9381 k = 0.0847 0.0847-0.0000 ( 1959 PWs) bands (ev): -1.0323 -1.0323 5.3600 5.3600 5.3973 5.3973 5.4051 5.4051 5.7214 5.7214 5.7292 5.7292 5.8035 5.8035 8.7723 8.7723 8.9171 8.9171 8.9953 8.9953 9.5917 9.5917 9.6891 9.6891 9.6927 9.6927 10.1416 10.1416 10.1957 10.1957 11.6991 11.6991 11.7849 11.7849 11.8120 11.8120 11.8823 11.8823 11.9240 11.9240 12.7362 12.7362 12.7506 12.7506 12.8886 12.8886 12.9146 12.9146 k = 0.0763 0.0763-0.0000 ( 1955 PWs) bands (ev): -1.0506 -1.0506 5.3509 5.3509 5.3942 5.3942 5.3990 5.3990 5.7203 5.7203 5.7268 5.7268 5.8031 5.8031 8.8501 8.8501 8.9652 8.9652 9.0333 9.0333 9.5803 9.5803 9.6723 9.6723 9.6745 9.6745 10.1439 10.1439 10.1844 10.1844 11.7103 11.7103 11.7824 11.7824 11.8242 11.8242 11.8779 11.8779 11.9152 11.9152 12.7448 12.7448 12.7621 12.7621 12.8687 12.8687 12.8936 12.8936 k = 0.0678 0.0678-0.0000 ( 1957 PWs) bands (ev): -1.0670 -1.0670 5.3413 5.3413 5.3914 5.3914 5.3949 5.3949 5.7194 5.7194 5.7246 5.7246 5.8028 5.8028 8.9232 8.9232 9.0117 9.0117 9.0706 9.0706 9.5701 9.5701 9.6532 9.6532 9.6566 9.6566 10.1448 10.1448 10.1739 10.1739 11.7192 11.7192 11.7774 11.7774 11.8347 11.8347 11.8735 11.8735 11.9085 11.9085 12.7511 12.7511 12.7734 12.7734 12.8515 12.8515 12.8749 12.8749 k = 0.0593 0.0593-0.0000 ( 1953 PWs) bands (ev): -1.0816 -1.0816 5.3317 5.3317 5.3891 5.3891 5.3919 5.3919 5.7186 5.7186 5.7226 5.7226 5.8025 5.8025 8.9908 8.9908 9.0563 9.0563 9.1069 9.1069 9.5610 9.5610 9.6332 9.6332 9.6383 9.6383 10.1445 10.1445 10.1644 10.1644 11.7259 11.7259 11.7708 11.7708 11.8438 11.8438 11.8698 11.8698 11.9039 11.9039 12.7555 12.7555 12.7838 12.7838 12.8373 12.8373 12.8587 12.8587 k = 0.0508 0.0508-0.0000 ( 1953 PWs) bands (ev): -1.0943 -1.0943 5.3228 5.3228 5.3873 5.3873 5.3894 5.3894 5.7179 5.7179 5.7209 5.7209 5.8022 5.8022 9.0519 9.0519 9.0982 9.0982 9.1424 9.1424 9.5530 9.5530 9.6129 9.6129 9.6195 9.6195 10.1432 10.1432 10.1559 10.1559 11.7302 11.7302 11.7632 11.7632 11.8511 11.8511 11.8670 11.8670 11.9010 11.9010 12.7579 12.7579 12.7930 12.7930 12.8264 12.8264 12.8449 12.8449 k = 0.0424 0.0424-0.0000 ( 1945 PWs) bands (ev): -1.1050 -1.1050 5.3150 5.3150 5.3860 5.3860 5.3875 5.3875 5.7174 5.7174 5.7195 5.7195 5.8020 5.8020 9.1055 9.1055 9.1366 9.1366 9.1768 9.1768 9.5462 9.5462 9.5928 9.5928 9.6007 9.6007 10.1411 10.1411 10.1486 10.1486 11.7324 11.7324 11.7552 11.7552 11.8566 11.8566 11.8654 11.8654 11.8997 11.8997 12.7585 12.7585 12.8007 12.8007 12.8190 12.8190 12.8335 12.8335 k = 0.0339 0.0339-0.0000 ( 1945 PWs) bands (ev): -1.1138 -1.1138 5.3084 5.3084 5.3849 5.3849 5.3859 5.3859 5.7169 5.7169 5.7183 5.7183 5.8018 5.8018 9.1507 9.1507 9.1703 9.1703 9.2096 9.2096 9.5403 9.5403 9.5732 9.5732 9.5826 9.5826 10.1384 10.1384 10.1424 10.1424 11.7329 11.7329 11.7475 11.7475 11.8604 11.8604 11.8647 11.8647 11.8995 11.8995 12.7575 12.7575 12.8062 12.8062 12.8151 12.8151 12.8246 12.8246 k = 0.0254 0.0254-0.0000 ( 1935 PWs) bands (ev): -1.1207 -1.1207 5.3032 5.3032 5.3842 5.3842 5.3848 5.3848 5.7167 5.7167 5.7174 5.7174 5.8017 5.8017 9.1872 9.1872 9.1982 9.1982 9.2391 9.2391 9.5353 9.5353 9.5553 9.5553 9.5667 9.5667 10.1357 10.1357 10.1376 10.1376 11.7325 11.7325 11.7407 11.7407 11.8629 11.8629 11.8647 11.8647 11.9001 11.9001 12.7556 12.7556 12.8083 12.8083 12.8143 12.8143 12.8192 12.8192 k = 0.0169 0.0169-0.0000 ( 1935 PWs) bands (ev): -1.1256 -1.1256 5.2995 5.2995 5.3837 5.3837 5.3840 5.3840 5.7164 5.7164 5.7168 5.7168 5.8016 5.8016 9.2144 9.2144 9.2194 9.2194 9.2629 9.2629 9.5309 9.5309 9.5401 9.5401 9.5541 9.5541 10.1334 10.1334 10.1341 10.1341 11.7317 11.7317 11.7353 11.7353 11.8643 11.8643 11.8650 11.8650 11.9009 11.9009 12.7537 12.7537 12.8081 12.8081 12.8114 12.8114 12.8199 12.8199 k = 0.0085 0.0085-0.0000 ( 1935 PWs) bands (ev): -1.1285 -1.1285 5.2972 5.2972 5.3834 5.3834 5.3834 5.3834 5.7163 5.7163 5.7164 5.7164 5.8015 5.8015 9.2315 9.2315 9.2328 9.2328 9.2785 9.2785 9.5272 9.5272 9.5295 9.5295 9.5466 9.5466 10.1318 10.1318 10.1319 10.1319 11.7310 11.7310 11.7319 11.7319 11.8651 11.8651 11.8652 11.8652 11.9015 11.9015 12.7523 12.7523 12.8079 12.8079 12.8087 12.8087 12.8216 12.8216 k = 0.0000 0.0000 0.0000 ( 1935 PWs) bands (ev): -1.1295 -1.1295 5.2964 5.2964 5.3833 5.3833 5.3833 5.3833 5.7162 5.7162 5.7162 5.7162 5.8015 5.8015 9.2374 9.2374 9.2374 9.2374 9.2840 9.2840 9.5257 9.5257 9.5257 9.5257 9.5442 9.5442 10.1312 10.1312 10.1312 10.1312 11.7308 11.7308 11.7308 11.7308 11.8653 11.8653 11.8653 11.8653 11.9018 11.9018 12.7518 12.7518 12.8078 12.8078 12.8078 12.8078 12.8223 12.8223 k = 0.0000 0.0000 0.0000 ( 1935 PWs) bands (ev): -1.1295 -1.1295 5.2964 5.2964 5.3833 5.3833 5.3833 5.3833 5.7162 5.7162 5.7162 5.7162 5.8015 5.8015 9.2374 9.2374 9.2374 9.2374 9.2840 9.2840 9.5257 9.5257 9.5257 9.5257 9.5442 9.5442 10.1312 10.1312 10.1312 10.1312 11.7308 11.7308 11.7308 11.7308 11.8653 11.8653 11.8653 11.8653 11.9018 11.9018 12.7518 12.7518 12.8078 12.8078 12.8078 12.8078 12.8223 12.8223 k = 0.0069 0.0069 0.0069 ( 1935 PWs) bands (ev): -1.1285 -1.1285 5.2972 5.2972 5.3834 5.3834 5.3834 5.3834 5.7163 5.7163 5.7164 5.7164 5.8015 5.8015 9.2319 9.2319 9.2323 9.2323 9.2785 9.2785 9.5275 9.5275 9.5293 9.5293 9.5466 9.5466 10.1318 10.1318 10.1319 10.1319 11.7312 11.7312 11.7318 11.7318 11.8651 11.8651 11.8652 11.8652 11.9015 11.9015 12.7523 12.7523 12.8078 12.8078 12.8088 12.8088 12.8216 12.8216 k = 0.0139 0.0139 0.0139 ( 1935 PWs) bands (ev): -1.1256 -1.1256 5.2995 5.2995 5.3837 5.3837 5.3840 5.3840 5.7164 5.7164 5.7168 5.7168 5.8016 5.8016 9.2160 9.2160 9.2176 9.2176 9.2626 9.2626 9.5325 9.5325 9.5382 9.5382 9.5545 9.5545 10.1336 10.1336 10.1339 10.1339 11.7323 11.7323 11.7347 11.7347 11.8642 11.8642 11.8650 11.8650 11.9009 11.9009 12.7537 12.7537 12.8078 12.8078 12.8117 12.8117 12.8199 12.8199 k = 0.0208 0.0208 0.0208 ( 1935 PWs) bands (ev): -1.1206 -1.1206 5.3033 5.3033 5.3841 5.3841 5.3848 5.3848 5.7166 5.7166 5.7175 5.7175 5.8017 5.8017 9.1907 9.1907 9.1948 9.1948 9.2381 9.2381 9.5399 9.5399 9.5482 9.5482 9.5693 9.5693 10.1365 10.1365 10.1370 10.1370 11.7339 11.7339 11.7393 11.7393 11.8627 11.8627 11.8649 11.8649 11.9003 11.9003 12.7554 12.7554 12.8076 12.8076 12.8167 12.8167 12.8180 12.8180 k = 0.0278 0.0278 0.0278 ( 1947 PWs) bands (ev): -1.1137 -1.1137 5.3087 5.3087 5.3848 5.3848 5.3860 5.3860 5.7168 5.7168 5.7184 5.7184 5.8018 5.8018 9.1571 9.1571 9.1654 9.1654 9.2066 9.2066 9.5490 9.5490 9.5579 9.5579 9.5894 9.5894 10.1402 10.1402 10.1411 10.1411 11.7353 11.7353 11.7449 11.7449 11.8600 11.8600 11.8648 11.8648 11.9001 11.9001 12.7562 12.7562 12.8062 12.8062 12.8175 12.8175 12.8235 12.8235 k = 0.0347 0.0347 0.0347 ( 1947 PWs) bands (ev): -1.1048 -1.1048 5.3156 5.3156 5.3857 5.3857 5.3876 5.3876 5.7172 5.7172 5.7197 5.7197 5.8020 5.8020 9.1164 9.1164 9.1301 9.1301 9.1701 9.1701 9.5593 9.5593 9.5678 9.5678 9.6125 9.6125 10.1445 10.1445 10.1459 10.1459 11.7360 11.7360 11.7509 11.7509 11.8560 11.8560 11.8655 11.8655 11.9011 11.9011 12.7548 12.7548 12.8043 12.8043 12.8204 12.8204 12.8328 12.8328 k = 0.0417 0.0417 0.0417 ( 1947 PWs) bands (ev): -1.0939 -1.0939 5.3240 5.3240 5.3867 5.3867 5.3895 5.3895 5.7177 5.7177 5.7212 5.7212 5.8022 5.8022 9.0696 9.0696 9.0888 9.0888 9.1307 9.1307 9.5704 9.5704 9.5782 9.5782 9.6368 9.6368 10.1493 10.1493 10.1511 10.1511 11.7355 11.7355 11.7563 11.7563 11.8503 11.8503 11.8671 11.8671 11.9037 11.9037 12.7493 12.7493 12.8026 12.8026 12.8274 12.8274 12.8444 12.8444 k = 0.0486 0.0486 0.0486 ( 1953 PWs) bands (ev): -1.0811 -1.0811 5.3339 5.3339 5.3879 5.3879 5.3917 5.3917 5.7182 5.7182 5.7229 5.7229 5.8025 5.8025 9.0175 9.0175 9.0412 9.0412 9.0901 9.0901 9.5819 9.5819 9.5889 9.5889 9.6612 9.6612 10.1542 10.1542 10.1565 10.1565 11.7332 11.7332 11.7604 11.7604 11.8429 11.8429 11.8701 11.8701 11.9079 11.9079 12.7394 12.7394 12.8013 12.8013 12.8386 12.8386 12.8583 12.8583 k = 0.0556 0.0556 0.0556 ( 1950 PWs) bands (ev): -1.0664 -1.0664 5.3453 5.3453 5.3893 5.3893 5.3943 5.3943 5.7188 5.7188 5.7250 5.7250 5.8028 5.8028 8.9609 8.9609 8.9878 8.9878 9.0493 9.0493 9.5939 9.5939 9.6003 9.6003 9.6854 9.6854 10.1592 10.1592 10.1619 10.1619 11.7290 11.7290 11.7625 11.7625 11.8342 11.8342 11.8747 11.8747 11.9136 11.9136 12.7257 12.7257 12.8004 12.8004 12.8539 12.8539 12.8750 12.8750 k = 0.0625 0.0625 0.0625 ( 1956 PWs) bands (ev): -1.0498 -1.0498 5.3581 5.3581 5.3907 5.3907 5.3971 5.3971 5.7195 5.7195 5.7273 5.7273 5.8031 5.8031 8.9003 8.9003 8.9294 8.9294 9.0081 9.0081 9.6064 9.6064 9.6120 9.6120 9.7086 9.7086 10.1640 10.1640 10.1672 10.1672 11.7227 11.7227 11.7622 11.7622 11.8240 11.8240 11.8807 11.8807 11.9202 11.9202 12.7087 12.7087 12.7995 12.7995 12.8730 12.8730 12.8942 12.8942 k = 0.0694 0.0694 0.0694 ( 1962 PWs) bands (ev): -1.0312 -1.0312 5.3724 5.3724 5.3923 5.3923 5.4003 5.4003 5.7202 5.7202 5.7298 5.7298 5.8034 5.8034 8.8363 8.8363 8.8670 8.8670 8.9666 8.9666 9.6193 9.6193 9.6243 9.6243 9.7308 9.7308 10.1685 10.1685 10.1722 10.1722 11.7145 11.7145 11.7596 11.7596 11.8129 11.8129 11.8878 11.8878 11.9272 11.9272 12.6891 12.6891 12.7985 12.7985 12.8953 12.8953 12.9160 12.9160 k = 0.0764 0.0764 0.0764 ( 1962 PWs) bands (ev): -1.0108 -1.0108 5.3880 5.3880 5.3940 5.3940 5.4039 5.4039 5.7211 5.7211 5.7326 5.7326 5.8039 5.8039 8.7694 8.7694 8.8011 8.8011 8.9246 8.9246 9.6328 9.6328 9.6372 9.6372 9.7516 9.7516 10.1728 10.1728 10.1769 10.1769 11.7045 11.7045 11.7549 11.7549 11.8007 11.8007 11.8954 11.8954 11.9342 11.9342 12.6673 12.6673 12.7975 12.7975 12.9208 12.9208 12.9405 12.9405 k = 0.0833 0.0833 0.0833 ( 1962 PWs) bands (ev): -0.9885 -0.9885 5.3958 5.3958 5.4039 5.4039 5.4089 5.4089 5.7220 5.7220 5.7356 5.7356 5.8043 5.8043 8.7001 8.7001 8.7326 8.7326 8.8820 8.8820 9.6470 9.6470 9.6508 9.6508 9.7708 9.7708 10.1768 10.1768 10.1812 10.1812 11.6931 11.6931 11.7487 11.7487 11.7880 11.7880 11.9029 11.9029 11.9407 11.9407 12.6432 12.6432 12.7963 12.7963 12.9491 12.9491 12.9675 12.9675 k = 0.0903 0.0903 0.0903 ( 1962 PWs) bands (ev): -0.9644 -0.9644 5.3977 5.3977 5.4108 5.4108 5.4245 5.4245 5.7229 5.7229 5.7389 5.7389 5.8048 5.8048 8.6286 8.6286 8.6617 8.6617 8.8390 8.8390 9.6616 9.6616 9.6650 9.6650 9.7881 9.7881 10.1804 10.1804 10.1852 10.1852 11.6802 11.6802 11.7409 11.7409 11.7747 11.7747 11.9098 11.9098 11.9465 11.9465 12.6174 12.6174 12.7951 12.7951 12.9799 12.9799 12.9969 12.9969 k = 0.0972 0.0972 0.0972 ( 1962 PWs) bands (ev): -0.9384 -0.9384 5.3996 5.3996 5.4153 5.4153 5.4442 5.4442 5.7239 5.7239 5.7423 5.7423 5.8053 5.8053 8.5555 8.5555 8.5891 8.5891 8.7954 8.7954 9.6767 9.6767 9.6798 9.6798 9.8034 9.8034 10.1837 10.1837 10.1888 10.1888 11.6662 11.6662 11.7320 11.7320 11.7610 11.7610 11.9160 11.9160 11.9513 11.9513 12.5898 12.5898 12.7937 12.7937 13.0128 13.0128 13.0284 13.0284 k = 0.1042 0.1042 0.1042 ( 1965 PWs) bands (ev): -0.9107 -0.9107 5.4015 5.4015 5.4197 5.4197 5.4654 5.4654 5.7249 5.7249 5.7459 5.7459 5.8059 5.8059 8.4810 8.4810 8.5151 8.5151 8.7514 8.7514 9.6924 9.6924 9.6952 9.6952 9.8165 9.8165 10.1867 10.1867 10.1920 10.1920 11.6513 11.6513 11.7222 11.7222 11.7471 11.7471 11.9211 11.9211 11.9551 11.9551 12.5605 12.5605 12.7922 12.7922 13.0476 13.0476 13.0617 13.0617 k = 0.1111 0.1111 0.1111 ( 1965 PWs) bands (ev): -0.8812 -0.8812 5.4034 5.4034 5.4244 5.4244 5.4879 5.4879 5.7258 5.7258 5.7497 5.7497 5.8065 5.8065 8.4054 8.4054 8.4399 8.4399 8.7069 8.7069 9.7086 9.7086 9.7111 9.7111 9.8274 9.8274 10.1895 10.1895 10.1951 10.1951 11.6358 11.6358 11.7116 11.7116 11.7330 11.7330 11.9253 11.9253 11.9578 11.9578 12.5297 12.5297 12.7907 12.7907 13.0837 13.0837 13.0965 13.0965 k = 0.1181 0.1181 0.1181 ( 1959 PWs) bands (ev): -0.8500 -0.8500 5.4053 5.4053 5.4294 5.4294 5.5117 5.5117 5.7268 5.7268 5.7538 5.7538 5.8073 5.8073 8.3290 8.3290 8.3639 8.3639 8.6620 8.6620 9.7254 9.7254 9.7276 9.7276 9.8360 9.8360 10.1922 10.1922 10.1980 10.1980 11.6199 11.6199 11.7004 11.7004 11.7190 11.7190 11.9285 11.9285 11.9596 11.9596 12.4975 12.4975 12.7892 12.7892 13.1209 13.1209 13.1324 13.1324 k = 0.1250 0.1250 0.1250 ( 1959 PWs) bands (ev): -0.8172 -0.8172 5.4071 5.4071 5.4344 5.4344 5.5366 5.5366 5.7276 5.7276 5.7579 5.7579 5.8080 5.8080 8.2521 8.2521 8.2874 8.2874 8.6168 8.6168 9.7425 9.7425 9.7446 9.7446 9.8420 9.8420 10.1947 10.1947 10.2007 10.2007 11.6038 11.6038 11.6887 11.6887 11.7051 11.7051 11.9308 11.9308 11.9604 11.9604 12.4639 12.4639 12.7875 12.7875 13.1588 13.1588 13.1691 13.1691 k = 0.1319 0.1319 0.1319 ( 1956 PWs) bands (ev): -0.7827 -0.7827 5.4088 5.4088 5.4396 5.4396 5.5627 5.5627 5.7283 5.7283 5.7622 5.7622 5.8090 5.8090 8.1749 8.1749 8.2106 8.2106 8.5712 8.5712 9.7600 9.7600 9.7619 9.7619 9.8454 9.8454 10.1974 10.1974 10.2034 10.2034 11.5878 11.5878 11.6766 11.6766 11.6914 11.6914 11.9323 11.9323 11.9605 11.9605 12.4292 12.4292 12.7857 12.7857 13.1970 13.1970 13.2063 13.2063 k = 0.1389 0.1389 0.1389 ( 1956 PWs) bands (ev): -0.7465 -0.7465 5.4104 5.4104 5.4448 5.4448 5.5898 5.5898 5.7287 5.7287 5.7665 5.7665 5.8100 5.8100 8.0977 8.0977 8.1338 8.1338 8.5252 8.5252 9.7777 9.7777 9.7795 9.7795 9.8462 9.8462 10.2001 10.2001 10.2062 10.2062 11.5720 11.5720 11.6642 11.6642 11.6779 11.6779 11.9333 11.9333 11.9601 11.9601 12.3932 12.3932 12.7839 12.7839 13.2351 13.2351 13.2435 13.2435 k = 0.1458 0.1458 0.1458 ( 1956 PWs) bands (ev): -0.7089 -0.7089 5.4118 5.4118 5.4502 5.4502 5.6179 5.6179 5.7289 5.7289 5.7710 5.7710 5.8112 5.8112 8.0206 8.0206 8.0571 8.0571 8.4790 8.4790 9.7956 9.7956 9.7972 9.7972 9.8446 9.8446 10.2032 10.2032 10.2093 10.2093 11.5566 11.5566 11.6514 11.6514 11.6647 11.6647 11.9338 11.9338 11.9590 11.9590 12.3563 12.3563 12.7820 12.7820 13.2727 13.2727 13.2805 13.2805 k = 0.1528 0.1528 0.1528 ( 1953 PWs) bands (ev): -0.6696 -0.6696 5.4130 5.4130 5.4557 5.4557 5.6470 5.6470 5.7287 5.7287 5.7756 5.7756 5.8126 5.8126 7.9437 7.9437 7.9808 7.9808 8.4326 8.4326 9.8137 9.8137 9.8145 9.8145 9.8410 9.8410 10.2067 10.2067 10.2127 10.2127 11.5416 11.5416 11.6384 11.6384 11.6520 11.6520 11.9341 11.9341 11.9577 11.9577 12.3186 12.3186 12.7801 12.7801 13.3098 13.3098 13.3170 13.3170 k = 0.1597 0.1597 0.1597 ( 1953 PWs) bands (ev): -0.6289 -0.6289 5.4139 5.4139 5.4612 5.4612 5.6769 5.6769 5.7282 5.7282 5.7802 5.7802 5.8142 5.8142 7.8674 7.8674 7.9050 7.9050 8.3860 8.3860 9.8266 9.8266 9.8317 9.8317 9.8402 9.8402 10.2108 10.2108 10.2167 10.2167 11.5273 11.5273 11.6251 11.6251 11.6396 11.6396 11.9342 11.9342 11.9561 11.9561 12.2801 12.2801 12.7781 12.7781 13.3458 13.3458 13.3526 13.3526 k = 0.1667 0.1667 0.1667 ( 1953 PWs) bands (ev): -0.5868 -0.5868 5.4146 5.4146 5.4666 5.4666 5.7075 5.7075 5.7271 5.7271 5.7848 5.7848 5.8161 5.8161 7.7917 7.7917 7.8299 7.8299 8.3393 8.3393 9.8213 9.8213 9.8495 9.8495 9.8541 9.8541 10.2157 10.2157 10.2213 10.2213 11.5136 11.5136 11.6117 11.6117 11.6278 11.6278 11.9344 11.9344 11.9544 11.9544 12.2410 12.2410 12.7761 12.7761 13.3807 13.3807 13.3872 13.3872 k = 0.1736 0.1736 0.1736 ( 1953 PWs) bands (ev): -0.5433 -0.5433 5.4149 5.4149 5.4721 5.4721 5.7255 5.7255 5.7388 5.7388 5.7894 5.7894 5.8183 5.8183 7.7169 7.7169 7.7557 7.7557 8.2924 8.2924 9.8104 9.8104 9.8670 9.8670 9.8713 9.8713 10.2216 10.2216 10.2268 10.2268 11.5006 11.5006 11.5980 11.5980 11.6166 11.6166 11.9348 11.9348 11.9528 11.9528 12.2014 12.2014 12.7740 12.7740 13.4142 13.4142 13.4205 13.4205 k = 0.1806 0.1806 0.1806 ( 1947 PWs) bands (ev): -0.4985 -0.4985 5.4149 5.4149 5.4775 5.4775 5.7233 5.7233 5.7705 5.7705 5.7940 5.7940 5.8208 5.8208 7.6430 7.6430 7.6826 7.6826 8.2458 8.2458 9.7970 9.7970 9.8842 9.8842 9.8886 9.8886 10.2286 10.2286 10.2334 10.2334 11.4885 11.4885 11.5843 11.5843 11.6062 11.6062 11.9356 11.9356 11.9512 11.9512 12.1615 12.1615 12.7718 12.7718 13.4460 13.4460 13.4523 13.4523 k = 0.1875 0.1875 0.1875 ( 1953 PWs) bands (ev): -0.4524 -0.4524 5.4145 5.4145 5.4827 5.4827 5.7205 5.7205 5.7985 5.7985 5.8026 5.8026 5.8235 5.8235 7.5702 7.5702 7.6105 7.6105 8.1991 8.1991 9.7816 9.7816 9.9007 9.9007 9.9054 9.9054 10.2369 10.2369 10.2413 10.2413 11.4766 11.4766 11.5704 11.5704 11.5962 11.5962 11.9368 11.9368 11.9496 11.9496 12.1214 12.1214 12.7697 12.7697 13.4761 13.4761 13.4823 13.4823 k = 0.1944 0.1944 0.1944 ( 1953 PWs) bands (ev): -0.4050 -0.4050 5.4136 5.4136 5.4877 5.4877 5.7170 5.7170 5.8030 5.8030 5.8262 5.8262 5.8352 5.8352 7.4986 7.4986 7.5399 7.5399 8.1526 8.1526 9.7647 9.7647 9.9167 9.9167 9.9218 9.9218 10.2467 10.2467 10.2505 10.2505 11.4654 11.4654 11.5563 11.5563 11.5871 11.5871 11.9386 11.9386 11.9478 11.9478 12.0818 12.0818 12.7675 12.7675 13.5042 13.5042 13.5106 13.5106 k = 0.2014 0.2014 0.2014 ( 1953 PWs) bands (ev): -0.3565 -0.3565 5.4122 5.4122 5.4926 5.4926 5.7129 5.7129 5.8074 5.8074 5.8295 5.8295 5.8675 5.8675 7.4284 7.4284 7.4707 7.4707 8.1064 8.1064 9.7466 9.7466 9.9319 9.9319 9.9375 9.9375 10.2580 10.2580 10.2613 10.2613 11.4545 11.4545 11.5422 11.5422 11.5787 11.5787 11.9410 11.9410 11.9450 11.9450 12.0436 12.0436 12.7652 12.7652 13.5304 13.5304 13.5369 13.5369 k = 0.2083 0.2083 0.2083 ( 1956 PWs) bands (ev): -0.3069 -0.3069 5.4103 5.4103 5.4970 5.4970 5.7080 5.7080 5.8117 5.8117 5.8329 5.8329 5.8997 5.8997 7.3597 7.3597 7.4031 7.4031 8.0607 8.0607 9.7275 9.7275 9.9463 9.9463 9.9524 9.9524 10.2710 10.2710 10.2738 10.2738 11.4438 11.4438 11.5279 11.5279 11.5711 11.5711 11.9386 11.9386 11.9442 11.9442 12.0093 12.0093 12.7630 12.7630 13.5543 13.5543 13.5611 13.5611 k = 0.2153 0.2153 0.2153 ( 1944 PWs) bands (ev): -0.2562 -0.2562 5.4079 5.4079 5.5011 5.5011 5.7026 5.7026 5.8159 5.8159 5.8364 5.8364 5.9317 5.9317 7.2927 7.2927 7.3373 7.3373 8.0156 8.0156 9.7080 9.7080 9.9602 9.9602 9.9668 9.9668 10.2859 10.2859 10.2881 10.2881 11.4335 11.4335 11.5137 11.5137 11.5646 11.5646 11.9225 11.9225 11.9482 11.9482 11.9858 11.9858 12.7607 12.7607 13.5761 13.5761 13.5832 13.5832 k = 0.2222 0.2222 0.2222 ( 1950 PWs) bands (ev): -0.2045 -0.2045 5.4047 5.4047 5.5045 5.5045 5.6965 5.6965 5.8199 5.8199 5.8399 5.8399 5.9631 5.9631 7.2273 7.2273 7.2731 7.2731 7.9714 7.9714 9.6881 9.6881 9.9734 9.9734 9.9804 9.9804 10.3021 10.3021 10.3039 10.3039 11.4230 11.4230 11.4993 11.4993 11.5589 11.5589 11.8927 11.8927 11.9528 11.9528 11.9762 11.9762 12.7584 12.7584 13.5954 13.5954 13.6029 13.6029 k = 0.2292 0.2292 0.2292 ( 1950 PWs) bands (ev): -0.1520 -0.1520 5.4009 5.4009 5.5073 5.5073 5.6898 5.6898 5.8237 5.8237 5.8435 5.8435 5.9937 5.9937 7.1638 7.1638 7.2110 7.2110 7.9281 7.9281 9.6685 9.6685 9.9861 9.9861 9.9935 9.9935 10.3200 10.3200 10.3215 10.3215 11.4124 11.4124 11.4848 11.4848 11.5540 11.5540 11.8561 11.8561 11.9583 11.9583 11.9746 11.9746 12.7561 12.7561 13.6123 13.6123 13.6202 13.6202 k = 0.2361 0.2361 0.2361 ( 1947 PWs) bands (ev): -0.0985 -0.0985 5.3963 5.3963 5.5093 5.5093 5.6827 5.6827 5.8273 5.8273 5.8470 5.8470 6.0232 6.0232 7.1021 7.1021 7.1509 7.1509 7.8862 7.8862 9.6496 9.6496 9.9985 9.9985 10.0063 10.0063 10.3394 10.3394 10.3405 10.3405 11.4017 11.4017 11.4703 11.4703 11.5499 11.5499 11.8171 11.8171 11.9645 11.9645 11.9765 11.9765 12.7538 12.7538 13.6266 13.6266 13.6350 13.6350 k = 0.2431 0.2431 0.2431 ( 1953 PWs) bands (ev): -0.0443 -0.0443 5.3910 5.3910 5.5102 5.5102 5.6752 5.6752 5.8307 5.8307 5.8503 5.8503 6.0515 6.0515 7.0425 7.0425 7.0928 7.0928 7.8457 7.8457 9.6316 9.6316 10.0107 10.0107 10.0187 10.0187 10.3600 10.3600 10.3609 10.3609 11.3908 11.3908 11.4559 11.4559 11.5466 11.5466 11.7770 11.7770 11.9715 11.9715 11.9802 11.9802 12.7515 12.7515 13.6383 13.6383 13.6471 13.6471 k = 0.2500 0.2500 0.2500 ( 1953 PWs) bands (ev): 0.0106 0.0106 5.3848 5.3848 5.5098 5.5098 5.6675 5.6675 5.8338 5.8338 5.8535 5.8535 6.0782 6.0782 6.9851 6.9851 7.0370 7.0370 7.8070 7.8070 9.6150 9.6150 10.0231 10.0231 10.0312 10.0312 10.3817 10.3817 10.3826 10.3826 11.3798 11.3798 11.4415 11.4415 11.5440 11.5440 11.7370 11.7370 11.9792 11.9792 11.9852 11.9852 12.7492 12.7492 13.6474 13.6474 13.6567 13.6567 k = 0.2569 0.2569 0.2569 ( 1953 PWs) bands (ev): 0.0662 0.0662 5.3778 5.3778 5.5078 5.5078 5.6598 5.6598 5.8367 5.8367 5.8563 5.8563 6.1030 6.1030 6.9298 6.9298 6.9835 6.9835 7.7703 7.7703 9.6001 9.6001 10.0357 10.0357 10.0439 10.0439 10.4043 10.4043 10.4052 10.4052 11.3685 11.3685 11.4273 11.4273 11.5419 11.5419 11.6971 11.6971 11.9877 11.9877 11.9913 11.9913 12.7469 12.7469 13.6537 13.6537 13.6635 13.6635 k = 0.2639 0.2639 0.2639 ( 1944 PWs) bands (ev): 0.1224 0.1224 5.3699 5.3699 5.5040 5.5040 5.6523 5.6523 5.8394 5.8394 5.8587 5.8587 6.1258 6.1258 6.8769 6.8769 6.9324 6.9324 7.7360 7.7360 9.5872 9.5872 10.0488 10.0488 10.0571 10.0571 10.4278 10.4278 10.4289 10.4289 11.3572 11.3572 11.4133 11.4133 11.5400 11.5400 11.6577 11.6577 11.9969 11.9969 11.9984 11.9984 12.7446 12.7446 13.6572 13.6572 13.6676 13.6676 k = 0.2708 0.2708 0.2708 ( 1956 PWs) bands (ev): 0.1790 0.1790 5.3610 5.3610 5.4981 5.4981 5.6450 5.6450 5.8417 5.8417 5.8606 5.8606 6.1462 6.1462 6.8262 6.8262 6.8836 6.8836 7.7042 7.7042 9.5768 9.5768 10.0624 10.0624 10.0707 10.0707 10.4517 10.4517 10.4531 10.4531 11.3457 11.3457 11.3994 11.3994 11.5382 11.5382 11.6189 11.6189 12.0061 12.0061 12.0066 12.0066 12.7422 12.7422 13.6577 13.6577 13.6686 13.6686 k = 0.2778 0.2778 0.2778 ( 1950 PWs) bands (ev): 0.2360 0.2360 5.3513 5.3513 5.4900 5.4900 5.6382 5.6382 5.8438 5.8438 5.8620 5.8620 6.1642 6.1642 6.7780 6.7780 6.8372 6.8372 7.6754 7.6754 9.5692 9.5692 10.0770 10.0770 10.0851 10.0851 10.4761 10.4761 10.4779 10.4779 11.3341 11.3341 11.3858 11.3858 11.5353 11.5353 11.5824 11.5824 12.0146 12.0146 12.0169 12.0169 12.7400 12.7400 13.6552 13.6552 13.6667 13.6667 k = 0.2847 0.2847 0.2847 ( 1953 PWs) bands (ev): 0.2934 0.2934 5.3405 5.3405 5.4796 5.4796 5.6315 5.6315 5.8456 5.8456 5.8627 5.8627 6.1796 6.1796 6.7322 6.7322 6.7933 6.7933 7.6495 7.6495 9.5646 9.5646 10.0924 10.0924 10.1004 10.1004 10.5007 10.5007 10.5030 10.5030 11.3224 11.3224 11.3724 11.3724 11.5247 11.5247 11.5542 11.5542 12.0237 12.0237 12.0277 12.0277 12.7377 12.7377 13.6496 13.6496 13.6617 13.6617 k = 0.2917 0.2917 0.2917 ( 1953 PWs) bands (ev): 0.3510 0.3510 5.3289 5.3289 5.4670 5.4670 5.6250 5.6250 5.8471 5.8471 5.8627 5.8627 6.1924 6.1924 6.6889 6.6889 6.7518 6.7518 7.6267 7.6267 9.5635 9.5635 10.1090 10.1090 10.1167 10.1167 10.5253 10.5253 10.5283 10.5283 11.3109 11.3109 11.3594 11.3594 11.4963 11.4963 11.5447 11.5447 12.0334 12.0334 12.0389 12.0389 12.7355 12.7355 13.6409 13.6409 13.6535 13.6535 k = 0.2986 0.2986 0.2986 ( 1962 PWs) bands (ev): 0.4088 0.4088 5.3162 5.3162 5.4522 5.4522 5.6182 5.6182 5.8482 5.8482 5.8620 5.8620 6.2026 6.2026 6.6480 6.6480 6.7127 6.7127 7.6071 7.6071 9.5660 9.5660 10.1266 10.1266 10.1341 10.1341 10.5497 10.5497 10.5536 10.5536 11.2994 11.2994 11.3468 11.3468 11.4613 11.4613 11.5423 11.5423 12.0435 12.0435 12.0504 12.0504 12.7333 12.7333 13.6289 13.6289 13.6420 13.6420 k = 0.3056 0.3056 0.3056 ( 1962 PWs) bands (ev): 0.4666 0.4666 5.3027 5.3027 5.4357 5.4357 5.6108 5.6108 5.8492 5.8492 5.8605 5.8605 6.2105 6.2105 6.6097 6.6097 6.6760 6.6760 7.5907 7.5907 9.5726 9.5726 10.1456 10.1456 10.1527 10.1527 10.5740 10.5740 10.5789 10.5789 11.2880 11.2880 11.3347 11.3347 11.4261 11.4261 11.5412 11.5412 12.0540 12.0540 12.0622 12.0622 12.7311 12.7311 13.6136 13.6136 13.6272 13.6272 k = 0.3125 0.3125 0.3125 ( 1950 PWs) bands (ev): 0.5244 0.5244 5.2884 5.2884 5.4176 5.4176 5.6024 5.6024 5.8500 5.8500 5.8584 5.8584 6.2162 6.2162 6.5739 6.5739 6.6417 6.6417 7.5773 7.5773 9.5834 9.5834 10.1661 10.1661 10.1728 10.1728 10.5980 10.5980 10.6040 10.6040 11.2770 11.2770 11.3231 11.3231 11.3915 11.3915 11.5404 11.5404 12.0649 12.0649 12.0743 12.0743 12.7291 12.7291 13.5951 13.5951 13.6091 13.6091 k = 0.3194 0.3194 0.3194 ( 1950 PWs) bands (ev): 0.5820 0.5820 5.2733 5.2733 5.3982 5.3982 5.5924 5.5924 5.8504 5.8504 5.8557 5.8557 6.2201 6.2201 6.5404 6.5404 6.6096 6.6096 7.5668 7.5668 9.5986 9.5986 10.1879 10.1879 10.1942 10.1942 10.6214 10.6214 10.6286 10.6286 11.2661 11.2661 11.3121 11.3121 11.3575 11.3575 11.5396 11.5396 12.0759 12.0759 12.0864 12.0864 12.7271 12.7271 13.5731 13.5731 13.5876 13.5876 k = 0.3264 0.3264 0.3264 ( 1944 PWs) bands (ev): 0.6395 0.6395 5.2574 5.2574 5.3776 5.3776 5.5807 5.5807 5.8507 5.8507 5.8526 5.8526 6.2226 6.2226 6.5093 6.5093 6.5797 6.5797 7.5588 7.5588 9.6183 9.6183 10.2113 10.2113 10.2170 10.2170 10.6443 10.6443 10.6529 10.6529 11.2556 11.2556 11.3017 11.3017 11.3244 11.3244 11.5387 11.5387 12.0871 12.0871 12.0985 12.0985 12.7250 12.7250 13.5479 13.5479 13.5627 13.5627 k = 0.3333 0.3333 0.3333 ( 1944 PWs) bands (ev): 0.6966 0.6966 5.2409 5.2409 5.3562 5.3562 5.5666 5.5666 5.8491 5.8491 5.8507 5.8507 6.2239 6.2239 6.4804 6.4804 6.5520 6.5520 7.5530 7.5530 9.6427 9.6427 10.2360 10.2360 10.2412 10.2412 10.6663 10.6663 10.6765 10.6765 11.2454 11.2454 11.2920 11.2920 11.2923 11.2923 11.5373 11.5373 12.0983 12.0983 12.1105 12.1105 12.7230 12.7230 13.5193 13.5193 13.5344 13.5344 k = 0.3403 0.3403 0.3403 ( 1944 PWs) bands (ev): 0.7532 0.7532 5.2239 5.2239 5.3341 5.3341 5.5500 5.5500 5.8457 5.8457 5.8505 5.8505 6.2244 6.2244 6.4538 6.4538 6.5262 6.5262 7.5492 7.5492 9.6717 9.6717 10.2623 10.2623 10.2669 10.2669 10.6875 10.6875 10.6994 10.6994 11.2353 11.2353 11.2616 11.2616 11.2830 11.2830 11.5356 11.5356 12.1095 12.1095 12.1224 12.1224 12.7211 12.7211 13.4875 13.4875 13.5029 13.5029 k = 0.3472 0.3472 0.3472 ( 1950 PWs) bands (ev): 0.8092 0.8092 5.2064 5.2064 5.3115 5.3115 5.5306 5.5306 5.8423 5.8423 5.8500 5.8500 6.2245 6.2245 6.4292 6.4292 6.5023 6.5023 7.5468 7.5468 9.7054 9.7054 10.2900 10.2900 10.2939 10.2939 10.7075 10.7075 10.7213 10.7213 11.2230 11.2230 11.2346 11.2346 11.2748 11.2748 11.5334 11.5334 12.1205 12.1205 12.1340 12.1340 12.7192 12.7192 13.4526 13.4526 13.4682 13.4682 k = 0.3542 0.3542 0.3542 ( 1950 PWs) bands (ev): 0.8645 0.8645 5.1887 5.1887 5.2886 5.2886 5.5086 5.5086 5.8393 5.8393 5.8495 5.8495 6.2244 6.2244 6.4066 6.4066 6.4804 6.4804 7.5457 7.5457 9.7438 9.7438 10.3193 10.3193 10.3225 10.3225 10.7266 10.7266 10.7423 10.7423 11.1994 11.1994 11.2208 11.2208 11.2674 11.2674 11.5307 11.5307 12.1312 12.1312 12.1453 12.1453 12.7174 12.7174 13.4148 13.4148 13.4305 13.4305 k = 0.3611 0.3611 0.3611 ( 1962 PWs) bands (ev): 0.9189 0.9189 5.1707 5.1707 5.2657 5.2657 5.4839 5.4839 5.8367 5.8367 5.8488 5.8488 6.2241 6.2241 6.3859 6.3859 6.4601 6.4601 7.5454 7.5454 9.7867 9.7867 10.3500 10.3500 10.3523 10.3523 10.7443 10.7443 10.7621 10.7621 11.1722 11.1722 11.2123 11.2123 11.2609 11.2609 11.5273 11.5273 12.1416 12.1416 12.1561 12.1561 12.7154 12.7154 13.3743 13.3743 13.3901 13.3901 k = 0.3681 0.3681 0.3681 ( 1962 PWs) bands (ev): 0.9724 0.9724 5.1528 5.1528 5.2428 5.2428 5.4569 5.4569 5.8345 5.8345 5.8480 5.8480 6.2240 6.2240 6.3670 6.3670 6.4415 6.4415 7.5458 7.5458 9.8341 9.8341 10.3821 10.3821 10.3836 10.3836 10.7610 10.7610 10.7808 10.7808 11.1459 11.1459 11.2051 11.2051 11.2552 11.2552 11.5231 11.5231 12.1515 12.1515 12.1663 12.1663 12.7137 12.7137 13.3314 13.3314 13.3473 13.3473 k = 0.3750 0.3750 0.3750 ( 1953 PWs) bands (ev): 1.0247 1.0247 5.1349 5.1349 5.2202 5.2202 5.4278 5.4278 5.8330 5.8330 5.8472 5.8472 6.2241 6.2241 6.3499 6.3499 6.4246 6.4246 7.5466 7.5466 9.8858 9.8858 10.4157 10.4157 10.4162 10.4162 10.7763 10.7763 10.7982 10.7982 11.1209 11.1209 11.1988 11.1988 11.2504 11.2504 11.5182 11.5182 12.1609 12.1609 12.1758 12.1758 12.7120 12.7120 13.2865 13.2865 13.3024 13.3024 k = 0.3819 0.3819 0.3819 ( 1959 PWs) bands (ev): 1.0758 1.0758 5.1172 5.1172 5.1978 5.1978 5.3972 5.3972 5.8317 5.8317 5.8462 5.8462 6.2243 6.2243 6.3342 6.3342 6.4091 6.4091 7.5476 7.5476 9.9412 9.9412 10.4498 10.4498 10.4503 10.4503 10.7902 10.7902 10.8141 10.8141 11.0970 11.0970 11.1934 11.1934 11.2464 11.2464 11.5123 11.5123 12.1696 12.1696 12.1845 12.1845 12.7104 12.7104 13.2398 13.2398 13.2558 13.2558 k = 0.3889 0.3889 0.3889 ( 1947 PWs) bands (ev): 1.1254 1.1254 5.1000 5.1000 5.1759 5.1759 5.3654 5.3654 5.8310 5.8310 5.8454 5.8454 6.2248 6.2248 6.3200 6.3200 6.3951 6.3951 7.5487 7.5487 10.0005 10.0005 10.4847 10.4847 10.4863 10.4863 10.8030 10.8030 10.8286 10.8286 11.0745 11.0745 11.1889 11.1889 11.2432 11.2432 11.5055 11.5055 12.1775 12.1775 12.1923 12.1923 12.7089 12.7089 13.1920 13.1920 13.2081 13.2081 k = 0.3958 0.3958 0.3958 ( 1947 PWs) bands (ev): 1.1735 1.1735 5.0831 5.0831 5.1545 5.1545 5.3329 5.3329 5.8306 5.8306 5.8444 5.8444 6.2253 6.2253 6.3071 6.3071 6.3824 6.3824 7.5497 7.5497 10.0629 10.0629 10.5204 10.5204 10.5231 10.5231 10.8144 10.8144 10.8413 10.8413 11.0534 11.0534 11.1852 11.1852 11.2405 11.2405 11.4974 11.4974 12.1845 12.1845 12.1990 12.1990 12.7074 12.7074 13.1434 13.1434 13.1596 13.1596 k = 0.4028 0.4028 0.4028 ( 1941 PWs) bands (ev): 1.2197 1.2197 5.0667 5.0667 5.1336 5.1336 5.3004 5.3004 5.8304 5.8304 5.8434 5.8434 6.2259 6.2259 6.2954 6.2954 6.3710 6.3710 7.5506 7.5506 10.1282 10.1282 10.5568 10.5568 10.5608 10.5608 10.8246 10.8246 10.8524 10.8524 11.0339 11.0339 11.1824 11.1824 11.2385 11.2385 11.4881 11.4881 12.1904 12.1904 12.2045 12.2045 12.7059 12.7059 13.0946 13.0946 13.1111 13.1111 k = 0.4097 0.4097 0.4097 ( 1944 PWs) bands (ev): 1.2640 1.2640 5.0511 5.0511 5.1133 5.1133 5.2682 5.2682 5.8305 5.8305 5.8423 5.8423 6.2264 6.2264 6.2849 6.2849 6.3608 6.3608 7.5513 7.5513 10.1959 10.1959 10.5938 10.5938 10.5990 10.5990 10.8337 10.8337 10.8617 10.8617 11.0160 11.0160 11.1800 11.1800 11.2366 11.2366 11.4773 11.4773 12.1951 12.1951 12.2085 12.2085 12.7045 12.7045 13.0461 13.0461 13.0629 13.0629 k = 0.4167 0.4167 0.4167 ( 1944 PWs) bands (ev): 1.3061 1.3061 5.0362 5.0362 5.0937 5.0937 5.2369 5.2369 5.8307 5.8307 5.8413 5.8413 6.2271 6.2271 6.2755 6.2755 6.3518 6.3518 7.5519 7.5519 10.2656 10.2656 10.6311 10.6311 10.6375 10.6375 10.8421 10.8421 10.8694 10.8694 10.9998 10.9998 11.1784 11.1784 11.2349 11.2349 11.4647 11.4647 12.1984 12.1984 12.2111 12.2111 12.7030 12.7030 12.9987 12.9987 13.0158 13.0158 k = 0.4236 0.4236 0.4236 ( 1944 PWs) bands (ev): 1.3458 1.3458 5.0221 5.0221 5.0748 5.0748 5.2070 5.2070 5.8310 5.8310 5.8404 5.8404 6.2275 6.2275 6.2671 6.2671 6.3440 6.3440 7.5524 7.5524 10.3367 10.3367 10.6683 10.6683 10.6758 10.6758 10.8499 10.8499 10.8753 10.8753 10.9856 10.9856 11.1773 11.1773 11.2332 11.2332 11.4503 11.4503 12.2002 12.2002 12.2119 12.2119 12.7016 12.7016 12.9529 12.9529 12.9705 12.9705 k = 0.4306 0.4306 0.4306 ( 1944 PWs) bands (ev): 1.3830 1.3830 5.0091 5.0091 5.0564 5.0564 5.1789 5.1789 5.8314 5.8314 5.8395 5.8395 6.2279 6.2279 6.2596 6.2596 6.3372 6.3372 7.5526 7.5526 10.4087 10.4087 10.7052 10.7052 10.7132 10.7132 10.8578 10.8578 10.8797 10.8797 10.9734 10.9734 11.1764 11.1764 11.2311 11.2311 11.4339 11.4339 12.2004 12.2004 12.2110 12.2110 12.7003 12.7003 12.9093 12.9093 12.9274 12.9274 k = 0.4375 0.4375 0.4375 ( 1944 PWs) bands (ev): 1.4174 1.4174 4.9970 4.9970 5.0388 5.0388 5.1531 5.1531 5.8319 5.8319 5.8386 5.8386 6.2280 6.2280 6.2530 6.2530 6.3314 6.3314 7.5527 7.5527 10.4810 10.4810 10.7411 10.7411 10.7486 10.7486 10.8666 10.8666 10.8827 10.8827 10.9634 10.9634 11.1757 11.1757 11.2284 11.2284 11.4152 11.4152 12.1990 12.1990 12.2083 12.2083 12.6988 12.6988 12.8687 12.8687 12.8874 12.8874 k = 0.4444 0.4444 0.4444 ( 1944 PWs) bands (ev): 1.4489 1.4489 4.9860 4.9860 5.0218 5.0218 5.1299 5.1299 5.8324 5.8324 5.8379 5.8379 6.2281 6.2281 6.2472 6.2472 6.3266 6.3266 7.5527 7.5527 10.5529 10.5529 10.7751 10.7751 10.7802 10.7802 10.8781 10.8781 10.8852 10.8852 10.9555 10.9555 11.1748 11.1748 11.2250 11.2250 11.3941 11.3941 12.1961 12.1961 12.2039 12.2039 12.6972 12.6972 12.8317 12.8317 12.8509 12.8509 k = 0.4514 0.4514 0.4514 ( 1944 PWs) bands (ev): 1.4772 1.4772 4.9762 4.9762 5.0058 5.0058 5.1096 5.1096 5.8329 5.8329 5.8371 5.8371 6.2280 6.2280 6.2422 6.2422 6.3226 6.3226 7.5527 7.5527 10.6237 10.6237 10.8052 10.8052 10.8056 10.8056 10.8885 10.8885 10.8947 10.8947 10.9497 10.9497 11.1736 11.1736 11.2204 11.2204 11.3702 11.3702 12.1916 12.1916 12.1980 12.1980 12.6952 12.6952 12.7990 12.7990 12.8183 12.8183 k = 0.4583 0.4583 0.4583 ( 1944 PWs) bands (ev): 1.5022 1.5022 4.9676 4.9676 4.9908 4.9908 5.0924 5.0924 5.8333 5.8333 5.8365 5.8365 6.2278 6.2278 6.2379 6.2379 6.3194 6.3194 7.5525 7.5525 10.6925 10.6925 10.8221 10.8221 10.8297 10.8297 10.8957 10.8957 10.9175 10.9175 10.9458 10.9458 11.1720 11.1720 11.2145 11.2145 11.3435 11.3435 12.1861 12.1861 12.1910 12.1910 12.6927 12.6927 12.7713 12.7713 12.7900 12.7900 k = 0.4653 0.4653 0.4653 ( 1938 PWs) bands (ev): 1.5237 1.5237 4.9603 4.9603 4.9774 4.9774 5.0781 5.0781 5.8338 5.8338 5.8360 5.8360 6.2276 6.2276 6.2344 6.2344 6.3168 6.3168 7.5525 7.5525 10.7578 10.7578 10.8323 10.8323 10.8444 10.8444 10.9101 10.9101 10.9439 10.9439 10.9447 10.9447 11.1698 11.1698 11.2072 11.2072 11.3139 11.3139 12.1798 12.1798 12.1833 12.1833 12.6892 12.6892 12.7491 12.7491 12.7663 12.7663 k = 0.4722 0.4722 0.4722 ( 1932 PWs) bands (ev): 1.5415 1.5415 4.9543 4.9543 4.9657 4.9657 5.0667 5.0667 5.8341 5.8341 5.8356 5.8356 6.2273 6.2273 6.2315 6.2315 6.3149 6.3149 7.5523 7.5523 10.8151 10.8151 10.8385 10.8385 10.8539 10.8539 10.9276 10.9276 10.9468 10.9468 10.9730 10.9730 11.1672 11.1672 11.1984 11.1984 11.2814 11.2814 12.1734 12.1734 12.1757 12.1757 12.6844 12.6844 12.7331 12.7331 12.7471 12.7471 k = 0.4792 0.4792 0.4792 ( 1920 PWs) bands (ev): 1.5555 1.5555 4.9496 4.9496 4.9562 4.9562 5.0580 5.0580 5.8345 5.8345 5.8353 5.8353 6.2270 6.2270 6.2294 6.2294 6.3135 6.3135 7.5522 7.5522 10.8422 10.8422 10.8422 10.8422 10.8817 10.8817 10.9346 10.9346 10.9652 10.9652 10.9999 10.9999 11.1642 11.1642 11.1886 11.1886 11.2464 11.2464 12.1675 12.1675 12.1688 12.1688 12.6786 12.6786 12.7231 12.7231 12.7324 12.7324 k = 0.4861 0.4861 0.4861 ( 1905 PWs) bands (ev): 1.5656 1.5656 4.9462 4.9462 4.9492 4.9492 5.0520 5.0520 5.8347 5.8347 5.8351 5.8351 6.2269 6.2269 6.2279 6.2279 6.3126 6.3126 7.5521 7.5521 10.8445 10.8445 10.8456 10.8456 10.9179 10.9179 10.9355 10.9355 10.9952 10.9952 11.0230 11.0230 11.1610 11.1610 11.1787 11.1787 11.2104 11.2104 12.1627 12.1627 12.1633 12.1633 12.6730 12.6730 12.7176 12.7176 12.7222 12.7222 k = 0.4931 0.4931 0.4931 ( 1904 PWs) bands (ev): 1.5717 1.5717 4.9442 4.9442 4.9449 4.9449 5.0484 5.0484 5.8349 5.8349 5.8350 5.8350 6.2267 6.2267 6.2270 6.2270 6.3120 6.3120 7.5521 7.5521 10.8457 10.8457 10.8460 10.8460 10.9351 10.9351 10.9395 10.9395 11.0281 11.0281 11.0392 11.0392 11.1568 11.1568 11.1706 11.1706 11.1788 11.1788 12.1596 12.1596 12.1597 12.1597 12.6689 12.6689 12.7148 12.7148 12.7161 12.7161 k = 0.5000 0.5000 0.5000 ( 1904 PWs) bands (ev): 1.5737 1.5737 4.9435 4.9435 4.9435 4.9435 5.0472 5.0472 5.8349 5.8349 5.8349 5.8349 6.2267 6.2267 6.2267 6.2267 6.3119 6.3119 7.5520 7.5520 10.8460 10.8460 10.8460 10.8460 10.9353 10.9353 10.9459 10.9459 11.0453 11.0453 11.0453 11.0453 11.1510 11.1510 11.1673 11.1673 11.1673 11.1673 12.1585 12.1585 12.1585 12.1585 12.6675 12.6675 12.7140 12.7140 12.7140 12.7140 k = 0.5000 0.5000 0.5000 ( 1904 PWs) bands (ev): 1.5737 1.5737 4.9435 4.9435 4.9435 4.9435 5.0472 5.0472 5.8349 5.8349 5.8349 5.8349 6.2267 6.2267 6.2267 6.2267 6.3119 6.3119 7.5520 7.5520 10.8460 10.8460 10.8460 10.8460 10.9353 10.9353 10.9459 10.9459 11.0453 11.0453 11.0453 11.0453 11.1510 11.1510 11.1673 11.1673 11.1673 11.1673 12.1585 12.1585 12.1585 12.1585 12.6675 12.6675 12.7140 12.7140 12.7140 12.7140 k = 0.4915 0.5000 0.4915 ( 1904 PWs) bands (ev): 1.5717 1.5717 4.9441 4.9441 4.9450 4.9450 5.0484 5.0484 5.8348 5.8348 5.8350 5.8350 6.2266 6.2266 6.2271 6.2271 6.3120 6.3120 7.5520 7.5520 10.8457 10.8457 10.8460 10.8460 10.9351 10.9351 10.9396 10.9396 11.0277 11.0277 11.0399 11.0399 11.1555 11.1555 11.1745 11.1745 11.1760 11.1760 12.1590 12.1590 12.1602 12.1602 12.6689 12.6689 12.7147 12.7147 12.7162 12.7162 k = 0.4831 0.5000 0.4831 ( 1906 PWs) bands (ev): 1.5657 1.5657 4.9460 4.9460 4.9494 4.9494 5.0520 5.0520 5.8345 5.8345 5.8354 5.8354 6.2265 6.2265 6.2282 6.2282 6.3126 6.3126 7.5521 7.5521 10.8444 10.8444 10.8457 10.8457 10.9187 10.9187 10.9355 10.9355 10.9895 10.9895 11.0305 11.0305 11.1499 11.1499 11.1963 11.1963 11.2014 11.2014 12.1607 12.1607 12.1653 12.1653 12.6728 12.6728 12.7169 12.7169 12.7229 12.7229 k = 0.4746 0.5000 0.4746 ( 1920 PWs) bands (ev): 1.5557 1.5557 4.9490 4.9490 4.9565 4.9565 5.0580 5.0580 5.8338 5.8338 5.8360 5.8360 6.2263 6.2263 6.2301 6.2301 6.3136 6.3136 7.5522 7.5522 10.8410 10.8410 10.8442 10.8442 10.8851 10.8851 10.9346 10.9346 10.9462 10.9462 11.0246 11.0246 11.1370 11.1370 11.2204 11.2204 11.2325 11.2325 12.1633 12.1633 12.1731 12.1731 12.6780 12.6780 12.7216 12.7216 12.7340 12.7340 k = 0.4661 0.5000 0.4661 ( 1932 PWs) bands (ev): 1.5418 1.5418 4.9531 4.9531 4.9662 4.9662 5.0668 5.0668 5.8329 5.8329 5.8368 5.8368 6.2260 6.2260 6.2327 6.2327 6.3151 6.3151 7.5523 7.5523 10.8292 10.8292 10.8351 10.8351 10.8485 10.8485 10.9041 10.9041 10.9370 10.9370 11.0231 11.0231 11.1193 11.1193 11.2443 11.2443 11.2622 11.2622 12.1668 12.1668 12.1828 12.1828 12.6827 12.6827 12.7303 12.7303 12.7502 12.7502 k = 0.4576 0.5000 0.4576 ( 1936 PWs) bands (ev): 1.5242 1.5242 4.9585 4.9585 4.9780 4.9780 5.0785 5.0785 5.8319 5.8319 5.8379 5.8379 6.2255 6.2255 6.2360 6.2360 6.3172 6.3172 7.5525 7.5525 10.7881 10.7881 10.7976 10.7976 10.8421 10.8421 10.8822 10.8822 10.9378 10.9378 11.0248 11.0248 11.0976 11.0976 11.2662 11.2662 11.2890 11.2890 12.1710 12.1710 12.1936 12.1936 12.6857 12.6857 12.7438 12.7438 12.7720 12.7720 k = 0.4492 0.5000 0.4492 ( 1940 PWs) bands (ev): 1.5031 1.5031 4.9648 4.9648 4.9914 4.9914 5.0933 5.0933 5.8306 5.8306 5.8393 5.8393 6.2249 6.2249 6.2400 6.2400 6.3202 6.3202 7.5527 7.5527 10.7339 10.7339 10.7472 10.7472 10.8390 10.8390 10.8756 10.8756 10.9392 10.9392 11.0289 11.0289 11.0729 11.0729 11.2854 11.2854 11.3125 11.3125 12.1757 12.1757 12.2046 12.2046 12.6869 12.6869 12.7614 12.7614 12.8000 12.8000 k = 0.4407 0.5000 0.4407 ( 1946 PWs) bands (ev): 1.4786 1.4786 4.9721 4.9721 5.0061 5.0061 5.1113 5.1113 5.8292 5.8292 5.8408 5.8408 6.2240 6.2240 6.2445 6.2445 6.3243 6.3243 7.5529 7.5529 10.6764 10.6764 10.6898 10.6898 10.8356 10.8356 10.8741 10.8741 10.9413 10.9413 11.0346 11.0346 11.0462 11.0462 11.3017 11.3017 11.3326 11.3326 12.1807 12.1807 12.2148 12.2148 12.6868 12.6868 12.7818 12.7818 12.8346 12.8346 k = 0.4322 0.5000 0.4322 ( 1946 PWs) bands (ev): 1.4509 1.4509 4.9802 4.9802 5.0217 5.0217 5.1326 5.1326 5.8276 5.8276 5.8427 5.8427 6.2229 6.2229 6.2495 6.2495 6.3296 6.3296 7.5531 7.5531 10.6168 10.6168 10.6297 10.6297 10.8318 10.8318 10.8737 10.8737 10.9435 10.9435 11.0179 11.0179 11.0428 11.0428 11.3150 11.3150 11.3494 11.3494 12.1858 12.1858 12.2238 12.2238 12.6858 12.6858 12.8041 12.8041 12.8759 12.8759 k = 0.4237 0.5000 0.4237 ( 1946 PWs) bands (ev): 1.4203 1.4203 4.9891 4.9891 5.0380 5.0380 5.1570 5.1570 5.8257 5.8257 5.8448 5.8448 6.2213 6.2213 6.2550 6.2550 6.3365 6.3365 7.5534 7.5534 10.5556 10.5556 10.5685 10.5685 10.8275 10.8275 10.8730 10.8730 10.9434 10.9434 10.9924 10.9924 11.0521 11.0521 11.3254 11.3254 11.3630 11.3630 12.1907 12.1907 12.2311 12.2311 12.6842 12.6842 12.8276 12.8276 12.9236 12.9236 k = 0.4153 0.5000 0.4153 ( 1946 PWs) bands (ev): 1.3869 1.3869 4.9987 4.9987 5.0548 5.0548 5.1841 5.1841 5.8237 5.8237 5.8471 5.8471 6.2193 6.2193 6.2610 6.2610 6.3452 6.3452 7.5536 7.5536 10.4932 10.4932 10.5075 10.5075 10.8224 10.8224 10.8716 10.8716 10.9324 10.9324 10.9782 10.9782 11.0632 11.0632 11.3331 11.3331 11.3738 11.3738 12.1954 12.1954 12.2364 12.2364 12.6820 12.6820 12.8517 12.8517 12.9773 12.9773 k = 0.4068 0.5000 0.4068 ( 1942 PWs) bands (ev): 1.3511 1.3511 5.0089 5.0089 5.0723 5.0723 5.2136 5.2136 5.8216 5.8216 5.8498 5.8498 6.2166 6.2166 6.2675 6.2675 6.3559 6.3559 7.5538 7.5538 10.4296 10.4296 10.4475 10.4475 10.8165 10.8165 10.8691 10.8691 10.9078 10.9078 10.9788 10.9788 11.0761 11.0761 11.3383 11.3383 11.3821 11.3821 12.1997 12.1997 12.2399 12.2399 12.6794 12.6794 12.8760 12.8760 13.0365 13.0365 k = 0.3983 0.5000 0.3983 ( 1942 PWs) bands (ev): 1.3131 1.3131 5.0196 5.0196 5.0902 5.0902 5.2448 5.2448 5.8193 5.8193 5.8526 5.8526 6.2132 6.2132 6.2747 6.2747 6.3687 6.3687 7.5540 7.5540 10.3653 10.3653 10.3891 10.3891 10.8089 10.8089 10.8649 10.8649 10.8796 10.8796 10.9855 10.9855 11.0908 11.0908 11.3411 11.3411 11.3881 11.3881 12.2035 12.2035 12.2415 12.2415 12.6765 12.6765 12.9001 12.9001 13.1009 13.1009 k = 0.3898 0.5000 0.3898 ( 1944 PWs) bands (ev): 1.2730 1.2730 5.0306 5.0306 5.1086 5.1086 5.2773 5.2773 5.8169 5.8169 5.8557 5.8557 6.2091 6.2091 6.2828 6.2828 6.3838 6.3838 7.5542 7.5542 10.3005 10.3005 10.3326 10.3326 10.7980 10.7980 10.8485 10.8485 10.8638 10.8638 10.9945 10.9945 11.1072 11.1072 11.3417 11.3417 11.3920 11.3920 12.2067 12.2067 12.2414 12.2414 12.6731 12.6731 12.9236 12.9236 13.1701 13.1701 k = 0.3814 0.5000 0.3814 ( 1940 PWs) bands (ev): 1.2312 1.2312 5.0421 5.0421 5.1276 5.1276 5.3104 5.3104 5.8144 5.8144 5.8591 5.8591 6.2042 6.2042 6.2922 6.2922 6.4011 6.4011 7.5545 7.5545 10.2356 10.2356 10.2785 10.2785 10.7805 10.7805 10.8269 10.8269 10.8581 10.8581 11.0047 11.0047 11.1255 11.1255 11.3406 11.3406 11.3943 11.3943 12.2093 12.2093 12.2397 12.2397 12.6695 12.6695 12.9462 12.9462 13.2435 13.2435 k = 0.3729 0.5000 0.3729 ( 1948 PWs) bands (ev): 1.1878 1.1878 5.0537 5.0537 5.1469 5.1469 5.3436 5.3436 5.8118 5.8118 5.8627 5.8627 6.1983 6.1983 6.3030 6.3030 6.4207 6.4207 7.5549 7.5549 10.1706 10.1706 10.2269 10.2269 10.7549 10.7549 10.8118 10.8118 10.8523 10.8523 11.0156 11.0156 11.1453 11.1453 11.3380 11.3380 11.3951 11.3951 12.2111 12.2111 12.2364 12.2364 12.6655 12.6655 12.9678 12.9678 13.3207 13.3207 k = 0.3644 0.5000 0.3644 ( 1948 PWs) bands (ev): 1.1431 1.1431 5.0656 5.0656 5.1666 5.1666 5.3762 5.3762 5.8092 5.8092 5.8666 5.8666 6.1915 6.1915 6.3157 6.3157 6.4428 6.4428 7.5555 7.5555 10.1060 10.1060 10.1784 10.1784 10.7247 10.7247 10.8008 10.8008 10.8461 10.8461 11.0272 11.0272 11.1667 11.1667 11.3343 11.3343 11.3947 11.3947 12.2122 12.2122 12.2319 12.2319 12.6613 12.6613 12.9881 12.9881 13.4016 13.4016 k = 0.3559 0.5000 0.3559 ( 1948 PWs) bands (ev): 1.0972 1.0972 5.0775 5.0775 5.1866 5.1866 5.4076 5.4076 5.8067 5.8067 5.8707 5.8707 6.1838 6.1838 6.3307 6.3307 6.4673 6.4673 7.5562 7.5562 10.0418 10.0418 10.1330 10.1330 10.6929 10.6929 10.7910 10.7910 10.8395 10.8395 11.0393 11.0393 11.1892 11.1892 11.3301 11.3301 11.3932 11.3932 12.2128 12.2128 12.2262 12.2262 12.6568 12.6568 13.0072 13.0072 13.4859 13.4859 k = 0.3475 0.5000 0.3475 ( 1956 PWs) bands (ev): 1.0504 1.0504 5.0894 5.0894 5.2067 5.2067 5.4373 5.4373 5.8041 5.8041 5.8749 5.8749 6.1752 6.1752 6.3481 6.3481 6.4942 6.4942 7.5573 7.5573 9.9780 9.9780 10.0909 10.0909 10.6604 10.6604 10.7809 10.7809 10.8325 10.8325 11.0518 11.0518 11.2125 11.2125 11.3259 11.3259 11.3907 11.3907 12.2126 12.2126 12.2194 12.2194 12.6519 12.6519 13.0249 13.0249 13.5732 13.5732 k = 0.3390 0.5000 0.3390 ( 1956 PWs) bands (ev): 1.0029 1.0029 5.1012 5.1012 5.2268 5.2268 5.4647 5.4647 5.8017 5.8017 5.8793 5.8793 6.1658 6.1658 6.3685 6.3685 6.5236 6.5236 7.5587 7.5587 9.9150 9.9150 10.0524 10.0524 10.6280 10.6280 10.7701 10.7701 10.8257 10.8257 11.0648 11.0648 11.2352 11.2352 11.3233 11.3233 11.3876 11.3876 12.2112 12.2112 12.2122 12.2122 12.6468 12.6468 13.0413 13.0413 13.6634 13.6634 k = 0.3305 0.5000 0.3305 ( 1956 PWs) bands (ev): 0.9548 0.9548 5.1127 5.1127 5.2468 5.2468 5.4893 5.4893 5.7996 5.7996 5.8838 5.8838 6.1556 6.1556 6.3921 6.3921 6.5556 6.5556 7.5607 7.5607 9.8527 9.8527 10.0176 10.0176 10.5959 10.5959 10.7581 10.7581 10.8192 10.8192 11.0781 11.0781 11.2548 11.2548 11.3251 11.3251 11.3838 11.3838 12.2029 12.2029 12.2104 12.2104 12.6414 12.6414 13.0564 13.0564 13.7563 13.7563 k = 0.3220 0.5000 0.3220 ( 1968 PWs) bands (ev): 0.9063 0.9063 5.1239 5.1239 5.2666 5.2666 5.5106 5.5106 5.7976 5.7976 5.8881 5.8881 6.1446 6.1446 6.4192 6.4192 6.5900 6.5900 7.5633 7.5633 9.7913 9.7913 9.9864 9.9864 10.5642 10.5642 10.7444 10.7444 10.8130 10.8130 11.0918 11.0918 11.2665 11.2665 11.3357 11.3357 11.3794 11.3794 12.1932 12.1932 12.2082 12.2082 12.6357 12.6357 13.0702 13.0702 13.8518 13.8518 k = 0.3136 0.5000 0.3136 ( 1960 PWs) bands (ev): 0.8575 0.8575 5.1346 5.1346 5.2861 5.2861 5.5287 5.5287 5.7961 5.7961 5.8923 5.8923 6.1332 6.1332 6.4499 6.4499 6.6271 6.6271 7.5666 7.5666 9.7308 9.7308 9.9590 9.9590 10.5330 10.5330 10.7290 10.7290 10.8076 10.8076 11.1059 11.1059 11.2696 11.2696 11.3566 11.3566 11.3749 11.3749 12.1830 12.1830 12.2055 12.2055 12.6299 12.6299 13.0830 13.0830 13.9498 13.9498 k = 0.3051 0.5000 0.3051 ( 1960 PWs) bands (ev): 0.8086 0.8086 5.1448 5.1448 5.3052 5.3052 5.5432 5.5432 5.7948 5.7948 5.8961 5.8961 6.1212 6.1212 6.4842 6.4842 6.6667 6.6667 7.5707 7.5707 9.6713 9.6713 9.9352 9.9352 10.5024 10.5024 10.7117 10.7117 10.8029 10.8029 11.1202 11.1202 11.2678 11.2678 11.3692 11.3692 11.3847 11.3847 12.1721 12.1721 12.2021 12.2021 12.6238 12.6238 13.0948 13.0948 14.0501 14.0501 k = 0.2966 0.5000 0.2966 ( 1968 PWs) bands (ev): 0.7598 0.7598 5.1541 5.1541 5.3237 5.3237 5.5543 5.5543 5.7938 5.7938 5.8994 5.8994 6.1089 6.1089 6.5220 6.5220 6.7088 6.7088 7.5758 7.5758 9.6128 9.6128 9.9149 9.9149 10.4722 10.4722 10.6922 10.6922 10.7989 10.7989 11.1348 11.1348 11.2641 11.2641 11.3643 11.3643 11.4152 11.4152 12.1605 12.1605 12.1981 12.1981 12.6176 12.6176 13.1057 13.1057 14.1525 14.1525 k = 0.2881 0.5000 0.2881 ( 1968 PWs) bands (ev): 0.7111 0.7111 5.1627 5.1627 5.3417 5.3417 5.5619 5.5619 5.7932 5.7932 5.9020 5.9020 6.0966 6.0966 6.5633 6.5633 6.7533 6.7533 7.5819 7.5819 9.5554 9.5554 9.8981 9.8981 10.4427 10.4427 10.6709 10.6709 10.7957 10.7957 11.1495 11.1495 11.2602 11.2602 11.3592 11.3592 11.4480 11.4480 12.1484 12.1484 12.1935 12.1935 12.6112 12.6112 13.1160 13.1160 14.2571 14.2571 k = 0.2797 0.5000 0.2797 ( 1968 PWs) bands (ev): 0.6628 0.6628 5.1703 5.1703 5.3591 5.3591 5.5665 5.5665 5.7929 5.7929 5.9037 5.9037 6.0845 6.0845 6.6078 6.6078 6.8004 6.8004 7.5892 7.5892 9.4993 9.4993 9.8845 9.8845 10.4138 10.4138 10.6476 10.6476 10.7932 10.7932 11.1641 11.1641 11.2568 11.2568 11.3542 11.3542 11.4821 11.4821 12.1357 12.1357 12.1884 12.1884 12.6046 12.6046 13.1257 13.1257 14.3637 14.3637 k = 0.2712 0.5000 0.2712 ( 1964 PWs) bands (ev): 0.6149 0.6149 5.1767 5.1767 5.3758 5.3758 5.5684 5.5684 5.7928 5.7928 5.9045 5.9045 6.0729 6.0729 6.6554 6.6554 6.8497 6.8497 7.5977 7.5977 9.4444 9.4444 9.8741 9.8741 10.3856 10.3856 10.6225 10.6225 10.7918 10.7918 11.1785 11.1785 11.2542 11.2542 11.3494 11.3494 11.5172 11.5172 12.1225 12.1225 12.1827 12.1827 12.5979 12.5979 13.1351 13.1351 14.4722 14.4722 k = 0.2627 0.5000 0.2627 ( 1964 PWs) bands (ev): 0.5675 0.5675 5.1818 5.1818 5.3917 5.3917 5.5677 5.5677 5.7928 5.7928 5.9043 5.9043 6.0620 6.0620 6.7054 6.7054 6.9013 6.9013 7.6074 7.6074 9.3906 9.3906 9.8665 9.8665 10.3580 10.3580 10.5956 10.5956 10.7909 10.7909 11.1920 11.1920 11.2533 11.2533 11.3451 11.3451 11.5531 11.5531 12.1089 12.1089 12.1765 12.1765 12.5912 12.5912 13.1442 13.1442 14.5823 14.5823 k = 0.2542 0.5000 0.2542 ( 1964 PWs) bands (ev): 0.5207 0.5207 5.1854 5.1854 5.4068 5.4068 5.5650 5.5650 5.7928 5.7928 5.9029 5.9029 6.0520 6.0520 6.7578 6.7578 6.9551 6.9551 7.6185 7.6185 9.3382 9.3382 9.8615 9.8615 10.3311 10.3311 10.5669 10.5669 10.7907 10.7907 11.2039 11.2039 11.2548 11.2548 11.3413 11.3413 11.5895 11.5895 12.0949 12.0949 12.1697 12.1697 12.5845 12.5845 13.1532 13.1532 14.6922 14.6922 k = 0.2458 0.5000 0.2458 ( 1968 PWs) bands (ev): 0.4746 0.4746 5.1875 5.1875 5.4211 5.4211 5.5607 5.5607 5.7928 5.7928 5.9005 5.9005 6.0433 6.0433 6.8120 6.8120 7.0108 7.0108 7.6308 7.6308 9.2870 9.2870 9.8589 9.8589 10.3048 10.3048 10.5367 10.5367 10.7913 10.7913 11.2130 11.2130 11.2596 11.2596 11.3384 11.3384 11.6262 11.6262 12.0805 12.0805 12.1624 12.1624 12.5777 12.5777 13.1622 13.1622 14.7420 14.7420 k = 0.2373 0.5000 0.2373 ( 1968 PWs) bands (ev): 0.4294 0.4294 5.1878 5.1878 5.4345 5.4345 5.5551 5.5551 5.7928 5.7928 5.8970 5.8970 6.0358 6.0358 6.8681 6.8681 7.0684 7.0684 7.6445 7.6445 9.2372 9.2372 9.8583 9.8583 10.2791 10.2791 10.5050 10.5050 10.7927 10.7927 11.2188 11.2188 11.2679 11.2679 11.3369 11.3369 11.6630 11.6630 12.0658 12.0658 12.1546 12.1546 12.5711 12.5711 13.1714 13.1714 14.7102 14.7102 k = 0.2288 0.5000 0.2288 ( 1968 PWs) bands (ev): 0.3850 0.3850 5.1862 5.1862 5.4471 5.4471 5.5485 5.5485 5.7926 5.7926 5.8926 5.8926 6.0297 6.0297 6.9255 6.9255 7.1276 7.1276 7.6595 7.6595 9.1888 9.1888 9.8595 9.8595 10.2542 10.2542 10.4719 10.4719 10.7948 10.7948 11.2221 11.2221 11.2783 11.2783 11.3374 11.3374 11.6999 11.6999 12.0509 12.0509 12.1462 12.1462 12.5647 12.5647 13.1809 13.1809 14.6734 14.6734 k = 0.2203 0.5000 0.2203 ( 1964 PWs) bands (ev): 0.3416 0.3416 5.1826 5.1826 5.4589 5.4589 5.5414 5.5414 5.7923 5.7923 5.8876 5.8876 6.0248 6.0248 6.9840 6.9840 7.1884 7.1884 7.6758 7.6758 9.1418 9.1418 9.8623 9.8623 10.2299 10.2299 10.4375 10.4375 10.7976 10.7976 11.2243 11.2243 11.2887 11.2887 11.3408 11.3408 11.7365 11.7365 12.0359 12.0359 12.1374 12.1374 12.5586 12.5586 13.1909 13.1909 14.6344 14.6344 k = 0.2119 0.5000 0.2119 ( 1968 PWs) bands (ev): 0.2993 0.2993 5.1769 5.1769 5.4697 5.4697 5.5341 5.5341 5.7919 5.7919 5.8821 5.8821 6.0211 6.0211 7.0434 7.0434 7.2505 7.2505 7.6933 7.6933 9.0961 9.0961 9.8661 9.8661 10.2062 10.2062 10.4021 10.4021 10.8012 10.8012 11.2260 11.2260 11.2972 11.2972 11.3482 11.3482 11.7726 11.7726 12.0207 12.0207 12.1279 12.1279 12.5528 12.5528 13.2012 13.2012 14.5935 14.5935 k = 0.2034 0.5000 0.2034 ( 1970 PWs) bands (ev): 0.2581 0.2581 5.1692 5.1692 5.4796 5.4796 5.5268 5.5268 5.7914 5.7914 5.8763 5.8763 6.0185 6.0185 7.1035 7.1035 7.3137 7.3137 7.7118 7.7118 9.0519 9.0519 9.8708 9.8708 10.1834 10.1834 10.3655 10.3655 10.8055 10.8055 11.2277 11.2277 11.3033 11.3033 11.3596 11.3596 11.8077 11.8078 12.0056 12.0056 12.1180 12.1180 12.5475 12.5475 13.2122 13.2122 14.5508 14.5508 k = 0.1949 0.5000 0.1949 ( 1962 PWs) bands (ev): 0.2181 0.2181 5.1595 5.1595 5.4885 5.4885 5.5200 5.5200 5.7908 5.7908 5.8706 5.8706 6.0167 6.0167 7.1642 7.1642 7.3777 7.3777 7.7314 7.7314 9.0092 9.0092 9.8762 9.8762 10.1613 10.1613 10.3282 10.3282 10.8104 10.8104 11.2298 11.2298 11.3082 11.3082 11.3741 11.3741 11.8417 11.8417 11.9909 11.9909 12.1076 12.1076 12.5430 12.5430 13.2238 13.2238 14.5064 14.5064 k = 0.1864 0.5000 0.1864 ( 1962 PWs) bands (ev): 0.1794 0.1794 5.1479 5.1479 5.4958 5.4958 5.5143 5.5143 5.7900 5.7900 5.8651 5.8651 6.0156 6.0156 7.2250 7.2250 7.4423 7.4423 7.7520 7.7520 8.9680 8.9680 9.8818 9.8818 10.1399 10.1399 10.2901 10.2901 10.8160 10.8160 11.2320 11.2320 11.3124 11.3124 11.3905 11.3905 11.8733 11.8733 11.9771 11.9771 12.0967 12.0967 12.5393 12.5393 13.2361 13.2361 14.4604 14.4604 k = 0.1780 0.5000 0.1780 ( 1970 PWs) bands (ev): 0.1420 0.1420 5.1344 5.1344 5.4994 5.4994 5.5118 5.5118 5.7891 5.7891 5.8597 5.8597 6.0151 6.0151 7.2858 7.2858 7.5073 7.5073 7.7733 7.7733 8.9282 8.9282 9.8872 9.8872 10.1192 10.1192 10.2513 10.2513 10.8221 10.8221 11.2346 11.2346 11.3169 11.3169 11.4079 11.4079 11.9001 11.9001 11.9665 11.9665 12.0855 12.0855 12.5366 12.5366 13.2491 13.2491 14.4127 14.4127 k = 0.1695 0.5000 0.1695 ( 1974 PWs) bands (ev): 0.1060 0.1060 5.1195 5.1195 5.4971 5.4971 5.5151 5.5151 5.7882 5.7882 5.8548 5.8548 6.0151 6.0151 7.3466 7.3466 7.5724 7.5724 7.7953 7.7953 8.8898 8.8898 9.8927 9.8927 10.0994 10.0994 10.2120 10.2120 10.8288 10.8288 11.2374 11.2374 11.3222 11.3222 11.4260 11.4260 11.9144 11.9144 11.9665 11.9665 12.0741 12.0741 12.5352 12.5352 13.2628 13.2628 14.3637 14.3637 k = 0.1610 0.5000 0.1610 ( 1974 PWs) bands (ev): 0.0714 0.0714 5.1033 5.1033 5.4928 5.4928 5.5203 5.5203 5.7872 5.7872 5.8502 5.8502 6.0154 6.0154 7.4072 7.4072 7.6373 7.6373 7.8179 7.8179 8.8531 8.8531 9.8979 9.8979 10.0804 10.0804 10.1724 10.1724 10.8360 10.8360 11.2405 11.2405 11.3286 11.3286 11.4445 11.4445 11.9108 11.9108 11.9818 11.9818 12.0629 12.0629 12.5354 12.5354 13.2772 13.2772 14.3134 14.3134 k = 0.1525 0.5000 0.1525 ( 1966 PWs) bands (ev): 0.0383 0.0383 5.0862 5.0862 5.4885 5.4885 5.5254 5.5254 5.7863 5.7863 5.8462 5.8462 6.0162 6.0162 7.4673 7.4673 7.7019 7.7019 7.8409 7.8409 8.8178 8.8178 9.9025 9.9025 10.0622 10.0622 10.1326 10.1326 10.8438 10.8438 11.2439 11.2439 11.3364 11.3364 11.4632 11.4632 11.8991 11.8991 12.0006 12.0006 12.0538 12.0538 12.5374 12.5374 13.2924 13.2924 14.2620 14.2620 k = 0.1441 0.5000 0.1441 ( 1962 PWs) bands (ev): 0.0067 0.0067 5.0684 5.0684 5.4844 5.4844 5.5300 5.5300 5.7852 5.7852 5.8426 5.8426 6.0171 6.0171 7.5269 7.5269 7.7656 7.7656 7.8642 7.8642 8.7840 8.7840 9.9065 9.9065 10.0450 10.0450 10.0927 10.0927 10.8519 10.8519 11.2473 11.2473 11.3455 11.3455 11.4819 11.4819 11.8852 11.8852 12.0108 12.0108 12.0525 12.0525 12.5416 12.5416 13.3081 13.3081 14.2097 14.2097 k = 0.1356 0.5000 0.1356 ( 1962 PWs) bands (ev): -0.0233 -0.0233 5.0501 5.0501 5.4807 5.4807 5.5341 5.5341 5.7842 5.7842 5.8394 5.8394 6.0182 6.0182 7.5858 7.5858 7.8282 7.8282 7.8876 7.8876 8.7517 8.7517 9.9096 9.9096 10.0286 10.0286 10.0528 10.0528 10.8602 10.8602 11.2506 11.2506 11.3562 11.3562 11.5004 11.5004 11.8707 11.8707 12.0062 12.0062 12.0635 12.0635 12.5479 12.5479 13.3244 13.3244 14.1566 14.1566 k = 0.1271 0.5000 0.1271 ( 1958 PWs) bands (ev): -0.0517 -0.0517 5.0318 5.0318 5.4774 5.4774 5.5377 5.5377 5.7831 5.7831 5.8367 5.8367 6.0194 6.0194 7.6437 7.6437 7.8887 7.8887 7.9115 7.9115 8.7208 8.7208 9.9119 9.9119 10.0125 10.0125 10.0137 10.0137 10.8688 10.8688 11.2538 11.2538 11.3685 11.3685 11.5187 11.5187 11.8561 11.8561 11.9944 11.9944 12.0788 12.0788 12.5567 12.5567 13.3411 13.3411 14.1030 14.1030 k = 0.1186 0.5000 0.1186 ( 1958 PWs) bands (ev): -0.0784 -0.0784 5.0135 5.0135 5.4744 5.4744 5.5407 5.5407 5.7820 5.7820 5.8344 5.8344 6.0207 6.0207 7.7006 7.7006 7.9316 7.9316 7.9511 7.9511 8.6914 8.6914 9.9133 9.9133 9.9739 9.9739 9.9986 9.9986 10.8776 10.8776 11.2568 11.2568 11.3824 11.3824 11.5365 11.5365 11.8417 11.8417 11.9799 11.9799 12.0932 12.0932 12.5679 12.5679 13.3581 13.3581 14.0492 14.0492 k = 0.1102 0.5000 0.1102 ( 1960 PWs) bands (ev): -0.1034 -0.1034 4.9957 4.9957 5.4716 5.4716 5.5433 5.5433 5.7809 5.7809 5.8325 5.8325 6.0220 6.0220 7.7563 7.7563 7.9549 7.9549 8.0078 8.0078 8.6634 8.6634 9.9135 9.9135 9.9354 9.9354 9.9848 9.9848 10.8865 10.8865 11.2596 11.2596 11.3979 11.3979 11.5539 11.5539 11.8276 11.8276 11.9643 11.9643 12.1057 12.1057 12.5814 12.5814 13.3753 13.3753 13.9955 13.9955 k = 0.1017 0.5000 0.1017 ( 1968 PWs) bands (ev): -0.1268 -0.1268 4.9784 4.9784 5.4690 5.4690 5.5454 5.5454 5.7798 5.7798 5.8307 5.8307 6.0233 6.0233 7.8106 7.8106 7.9768 7.9768 8.0627 8.0627 8.6367 8.6367 9.8970 9.8970 9.9135 9.9135 9.9723 9.9723 10.8952 10.8952 11.2620 11.2620 11.4148 11.4148 11.5706 11.5706 11.8140 11.8140 11.9476 11.9476 12.1156 12.1156 12.5972 12.5972 13.3924 13.3924 13.9422 13.9422 k = 0.0932 0.5000 0.0932 ( 1966 PWs) bands (ev): -0.1483 -0.1483 4.9618 4.9618 5.4668 5.4668 5.5472 5.5472 5.7788 5.7788 5.8295 5.8295 6.0247 6.0247 7.8632 7.8632 7.9978 7.9978 8.1151 8.1151 8.6113 8.6113 9.8606 9.8606 9.9123 9.9123 9.9607 9.9607 10.9039 10.9039 11.2642 11.2642 11.4331 11.4331 11.5865 11.5865 11.8009 11.8009 11.9303 11.9303 12.1234 12.1234 12.6149 12.6149 13.4094 13.4094 13.8897 13.8897 k = 0.0847 0.5000 0.0847 ( 1966 PWs) bands (ev): -0.1681 -0.1681 4.9462 4.9462 5.4647 5.4647 5.5487 5.5487 5.7778 5.7778 5.8284 5.8284 6.0260 6.0260 7.9141 7.9141 8.0177 8.0177 8.1645 8.1645 8.5872 8.5872 9.8253 9.8253 9.9104 9.9104 9.9503 9.9503 10.9124 10.9124 11.2662 11.2662 11.4527 11.4527 11.6015 11.6015 11.7886 11.7886 11.9122 11.9122 12.1292 12.1292 12.6342 12.6342 13.4259 13.4259 13.8385 13.8385 k = 0.0763 0.5000 0.0763 ( 1970 PWs) bands (ev): -0.1860 -0.1860 4.9317 4.9317 5.4629 5.4629 5.5499 5.5499 5.7768 5.7768 5.8276 5.8276 6.0272 6.0272 7.9628 7.9628 8.0365 8.0365 8.2104 8.2104 8.5643 8.5643 9.7917 9.7917 9.9078 9.9078 9.9409 9.9409 10.9206 10.9206 11.2679 11.2679 11.4734 11.4734 11.6155 11.6155 11.7771 11.7771 11.8935 11.8935 12.1333 12.1333 12.6545 12.6545 13.4418 13.4418 13.7889 13.7889 k = 0.0678 0.5000 0.0678 ( 1970 PWs) bands (ev): -0.2022 -0.2022 4.9184 4.9184 5.4612 5.4612 5.5509 5.5509 5.7760 5.7760 5.8270 5.8270 6.0284 6.0284 8.0091 8.0091 8.0539 8.0539 8.2526 8.2526 8.5424 8.5424 9.7602 9.7602 9.9048 9.9048 9.9327 9.9327 10.9283 10.9283 11.2694 11.2694 11.4949 11.4949 11.6282 11.6282 11.7665 11.7665 11.8743 11.8743 12.1361 12.1361 12.6754 12.6754 13.4568 13.4568 13.7415 13.7415 k = 0.0593 0.5000 0.0593 ( 1970 PWs) bands (ev): -0.2164 -0.2164 4.9064 4.9064 5.4598 5.4598 5.5516 5.5516 5.7752 5.7752 5.8265 5.8265 6.0295 6.0295 8.0522 8.0522 8.0705 8.0705 8.2907 8.2907 8.5215 8.5215 9.7310 9.7310 9.9015 9.9015 9.9258 9.9258 10.9354 10.9354 11.2706 11.2706 11.5172 11.5172 11.6395 11.6395 11.7569 11.7569 11.8547 11.8547 12.1378 12.1378 12.6964 12.6964 13.4707 13.4707 13.6970 13.6970 k = 0.0508 0.5000 0.0508 ( 1970 PWs) bands (ev): -0.2289 -0.2289 4.8959 4.8959 5.4585 5.4585 5.5522 5.5522 5.7744 5.7744 5.8262 5.8262 6.0305 6.0305 8.0812 8.0812 8.0966 8.0966 8.3245 8.3245 8.5016 8.5016 9.7045 9.7045 9.8980 9.8980 9.9200 9.9200 10.9419 10.9419 11.2716 11.2716 11.5401 11.5401 11.6493 11.6493 11.7483 11.7483 11.8349 11.8349 12.1387 12.1387 12.7168 12.7168 13.4831 13.4831 13.6561 13.6561 k = 0.0424 0.5000 0.0424 ( 1966 PWs) bands (ev): -0.2394 -0.2394 4.8868 4.8868 5.4575 5.4575 5.5527 5.5527 5.7738 5.7738 5.8260 5.8260 6.0313 6.0313 8.0945 8.0945 8.1332 8.1332 8.3535 8.3535 8.4826 8.4826 9.6813 9.6813 9.8946 9.8946 9.9154 9.9154 10.9476 10.9476 11.2724 11.2724 11.5632 11.5632 11.6574 11.6574 11.7406 11.7406 11.8151 11.8151 12.1390 12.1390 12.7361 12.7361 13.4939 13.4939 13.6195 13.6195 k = 0.0339 0.5000 0.0339 ( 1966 PWs) bands (ev): -0.2480 -0.2480 4.8793 4.8793 5.4567 5.4567 5.5531 5.5531 5.7733 5.7733 5.8259 5.8259 6.0319 6.0319 8.1048 8.1048 8.1669 8.1669 8.3777 8.3777 8.4647 8.4647 9.6616 9.6616 9.8914 9.8914 9.9117 9.9117 10.9524 10.9524 11.2729 11.2729 11.5866 11.5866 11.6638 11.6638 11.7334 11.7334 11.7959 11.7959 12.1391 12.1391 12.7536 12.7536 13.5024 13.5024 13.5884 13.5884 k = 0.0254 0.5000 0.0254 ( 1966 PWs) bands (ev): -0.2547 -0.2547 4.8734 4.8734 5.4560 5.4560 5.5533 5.5533 5.7729 5.7729 5.8258 5.8258 6.0324 6.0324 8.1128 8.1128 8.1960 8.1960 8.3967 8.3967 8.4484 8.4484 9.6458 9.6458 9.8888 9.8888 9.9088 9.9088 10.9563 10.9563 11.2734 11.2734 11.6096 11.6096 11.6684 11.6684 11.7257 11.7257 11.7785 11.7785 12.1390 12.1390 12.7682 12.7682 13.5081 13.5081 13.5640 13.5640 k = 0.0169 0.5000 0.0169 ( 1974 PWs) bands (ev): -0.2596 -0.2596 4.8692 4.8692 5.4554 5.4554 5.5534 5.5534 5.7726 5.7726 5.8256 5.8256 6.0328 6.0328 8.1186 8.1186 8.2192 8.2192 8.4103 8.4103 8.4346 8.4346 9.6341 9.6341 9.8868 9.8868 9.9068 9.9068 10.9590 10.9590 11.2736 11.2736 11.6320 11.6320 11.6712 11.6712 11.7158 11.7158 11.7648 11.7648 12.1387 12.1387 12.7793 12.7793 13.5101 13.5101 13.5480 13.5480 k = 0.0085 0.5000 0.0085 ( 1980 PWs) bands (ev): -0.2625 -0.2625 4.8666 4.8666 5.4551 5.4551 5.5535 5.5535 5.7724 5.7724 5.8256 5.8256 6.0330 6.0330 8.1221 8.1221 8.2346 8.2346 8.4186 8.4186 8.4250 8.4250 9.6270 9.6270 9.8856 9.8856 9.9056 9.9056 10.9607 10.9607 11.2738 11.2738 11.6524 11.6524 11.6723 11.6723 11.7033 11.7033 11.7566 11.7566 12.1386 12.1386 12.7863 12.7863 13.5086 13.5086 13.5407 13.5407 k = 0.0000 0.5000-0.0000 ( 1984 PWs) bands (ev): -0.2634 -0.2634 4.8657 4.8657 5.4550 5.4550 5.5535 5.5535 5.7723 5.7723 5.8255 5.8255 6.0331 6.0331 8.1233 8.1233 8.2400 8.2400 8.4208 8.4208 8.4220 8.4220 9.6245 9.6245 9.8852 9.8852 9.9052 9.9052 10.9612 10.9612 11.2738 11.2738 11.6649 11.6649 11.6707 11.6707 11.6952 11.6952 11.7541 11.7541 12.1385 12.1385 12.7887 12.7887 13.5074 13.5074 13.5390 13.5390 k = 0.5000 0.5000-0.0000 ( 1956 PWs) bands (ev): 0.5882 0.5882 5.5038 5.5038 5.5436 5.5436 5.6663 5.6663 5.6782 5.6782 5.8338 5.8338 5.8479 5.8479 5.9828 5.9828 7.5735 7.5735 7.6333 7.6333 9.4732 9.4732 9.4779 9.4779 10.1328 10.1328 10.7526 10.7526 10.8010 10.8010 10.8948 10.8948 10.9828 10.9828 11.6660 11.6660 11.8245 11.8245 11.8795 11.8795 12.1343 12.1343 12.7290 12.7290 13.3144 13.3144 13.3819 13.3819 k = 0.5000 0.5000 0.0119 ( 1960 PWs) bands (ev): 0.5892 0.5892 5.5018 5.5018 5.5424 5.5424 5.6664 5.6664 5.6763 5.6763 5.8358 5.8358 5.8504 5.8504 5.9830 5.9830 7.5712 7.5712 7.6331 7.6331 9.4741 9.4741 9.4788 9.4788 10.1337 10.1337 10.7526 10.7526 10.8011 10.8011 10.8958 10.8958 10.9836 10.9836 11.6593 11.6593 11.8314 11.8314 11.8776 11.8776 12.1344 12.1344 12.7287 12.7287 13.3141 13.3141 13.3816 13.3816 k = 0.5000 0.5000 0.0238 ( 1968 PWs) bands (ev): 0.5923 0.5923 5.4959 5.4959 5.5386 5.5386 5.6667 5.6667 5.6708 5.6708 5.8416 5.8416 5.8574 5.8574 5.9834 5.9834 7.5642 7.5642 7.6325 7.6325 9.4767 9.4767 9.4813 9.4813 10.1365 10.1365 10.7527 10.7527 10.8015 10.8015 10.8987 10.8987 10.9861 10.9861 11.6416 11.6416 11.8492 11.8492 11.8719 11.8719 12.1343 12.1343 12.7278 12.7278 13.3133 13.3133 13.3807 13.3807 k = 0.5000 0.5000 0.0357 ( 1976 PWs) bands (ev): 0.5974 0.5974 5.4865 5.4865 5.5323 5.5323 5.6630 5.6630 5.6673 5.6673 5.8507 5.8507 5.8678 5.8678 5.9843 5.9843 7.5527 7.5527 7.6315 7.6315 9.4811 9.4811 9.4856 9.4856 10.1414 10.1414 10.7529 10.7529 10.8023 10.8023 10.9034 10.9034 10.9901 10.9901 11.6176 11.6176 11.8624 11.8624 11.8736 11.8736 12.1345 12.1345 12.7263 12.7263 13.3119 13.3119 13.3793 13.3793 k = 0.5000 0.5000 0.0476 ( 1976 PWs) bands (ev): 0.6045 0.6045 5.4742 5.4742 5.5235 5.5235 5.6541 5.6541 5.6684 5.6684 5.8626 5.8626 5.8803 5.8803 5.9861 5.9861 7.5368 7.5368 7.6301 7.6301 9.4873 9.4873 9.4917 9.4917 10.1482 10.1482 10.7533 10.7533 10.8034 10.8034 10.9101 10.9101 10.9960 10.9960 11.5906 11.5906 11.8495 11.8495 11.9015 11.9015 12.1348 12.1348 12.7243 12.7243 13.3100 13.3100 13.3772 13.3772 k = 0.5000 0.5000 0.0595 ( 1976 PWs) bands (ev): 0.6137 0.6137 5.4594 5.4594 5.5120 5.5120 5.6450 5.6450 5.6701 5.6701 5.8765 5.8765 5.8934 5.8934 5.9888 5.9888 7.5164 7.5164 7.6284 7.6284 9.4954 9.4954 9.4996 9.4996 10.1569 10.1569 10.7539 10.7539 10.8048 10.8048 10.9185 10.9185 11.0034 11.0034 11.5620 11.5620 11.8332 11.8332 11.9313 11.9313 12.1351 12.1351 12.7216 12.7216 13.3074 13.3074 13.3746 13.3746 k = 0.5000 0.5000 0.0714 ( 1976 PWs) bands (ev): 0.6249 0.6249 5.4426 5.4426 5.4982 5.4982 5.6363 5.6363 5.6723 5.6723 5.8920 5.8920 5.9059 5.9059 5.9931 5.9931 7.4918 7.4918 7.6263 7.6263 9.5054 9.5054 9.5094 9.5094 10.1675 10.1675 10.7548 10.7548 10.8065 10.8065 10.9286 10.9286 11.0123 11.0123 11.5326 11.5326 11.8137 11.8137 11.9620 11.9620 12.1355 12.1355 12.7183 12.7183 13.3043 13.3043 13.3713 13.3713 k = 0.5000 0.5000 0.0833 ( 1988 PWs) bands (ev): 0.6381 0.6381 5.4243 5.4243 5.4823 5.4823 5.6280 5.6280 5.6750 5.6750 5.9084 5.9084 5.9166 5.9166 5.9996 5.9996 7.4630 7.4630 7.6239 7.6239 9.5172 9.5172 9.5209 9.5209 10.1799 10.1799 10.7557 10.7557 10.8083 10.8083 10.9401 10.9401 11.0227 11.0227 11.5027 11.5027 11.7913 11.7913 11.9933 11.9933 12.1358 12.1358 12.7144 12.7144 13.3005 13.3005 13.3673 13.3673 k = 0.5000 0.5000 0.0952 ( 1988 PWs) bands (ev): 0.6532 0.6532 5.4050 5.4050 5.4648 5.4648 5.6202 5.6202 5.6783 5.6783 5.9250 5.9250 5.9256 5.9256 6.0086 6.0086 7.4304 7.4304 7.6212 7.6212 9.5310 9.5310 9.5345 9.5345 10.1942 10.1942 10.7571 10.7571 10.8105 10.8105 10.9530 10.9530 11.0344 11.0344 11.4730 11.4730 11.7665 11.7665 12.0249 12.0249 12.1363 12.1363 12.7099 12.7099 13.2961 13.2961 13.3627 13.3627 k = 0.5000 0.5000 0.1071 ( 1988 PWs) bands (ev): 0.6702 0.6702 5.3849 5.3849 5.4459 5.4459 5.6126 5.6126 5.6821 5.6821 5.9307 5.9307 5.9431 5.9431 6.0201 6.0201 7.3941 7.3941 7.6183 7.6183 9.5469 9.5469 9.5501 9.5501 10.2103 10.2103 10.7587 10.7587 10.8130 10.8130 10.9673 10.9673 11.0473 11.0473 11.4434 11.4434 11.7395 11.7395 12.0566 12.0566 12.1369 12.1369 12.7046 12.7046 13.2910 13.2910 13.3573 13.3573 k = 0.5000 0.5000 0.1190 ( 1996 PWs) bands (ev): 0.6891 0.6891 5.3643 5.3643 5.4261 5.4261 5.6051 5.6051 5.6864 5.6864 5.9339 5.9339 5.9607 5.9607 6.0335 6.0335 7.3543 7.3543 7.6151 7.6151 9.5649 9.5649 9.5678 9.5678 10.2281 10.2281 10.7604 10.7604 10.8156 10.8156 10.9826 10.9826 11.0613 11.0613 11.4139 11.4139 11.7106 11.7106 12.0881 12.0881 12.1373 12.1373 12.6987 12.6987 13.2852 13.2852 13.3512 13.3512 k = 0.5000 0.5000 0.1310 ( 1996 PWs) bands (ev): 0.7098 0.7098 5.3433 5.3433 5.4057 5.4057 5.5975 5.5975 5.6911 5.6911 5.9354 5.9354 5.9782 5.9782 6.0482 6.0482 7.3113 7.3113 7.6118 7.6118 9.5851 9.5851 9.5876 9.5876 10.2476 10.2476 10.7626 10.7626 10.8186 10.8186 10.9989 10.9989 11.0764 11.0764 11.3850 11.3850 11.6802 11.6802 12.1194 12.1194 12.1380 12.1380 12.6920 12.6920 13.2785 13.2785 13.3442 13.3442 k = 0.5000 0.5000 0.1429 ( 1996 PWs) bands (ev): 0.7323 0.7323 5.3223 5.3223 5.3849 5.3849 5.5897 5.5897 5.6962 5.6962 5.9356 5.9356 5.9954 5.9954 6.0635 6.0635 7.2654 7.2654 7.6084 7.6084 9.6074 9.6074 9.6097 9.6097 10.2688 10.2688 10.7650 10.7650 10.8217 10.8217 11.0161 11.0161 11.0923 11.0923 11.3567 11.3567 11.6487 11.6487 12.1387 12.1387 12.1505 12.1505 12.6846 12.6846 13.2711 13.2711 13.3364 13.3364 k = 0.5000 0.5000 0.1548 ( 1988 PWs) bands (ev): 0.7565 0.7565 5.3012 5.3012 5.3639 5.3639 5.5815 5.5815 5.7016 5.7016 5.9349 5.9349 6.0123 6.0123 6.0791 6.0791 7.2170 7.2170 7.6049 7.6049 9.6321 9.6321 9.6339 9.6339 10.2917 10.2917 10.7677 10.7677 10.8251 10.8251 11.0340 11.0340 11.1089 11.1089 11.3289 11.3289 11.6162 11.6162 12.1396 12.1396 12.1813 12.1813 12.6765 12.6765 13.2628 13.2628 13.3278 13.3278 k = 0.5000 0.5000 0.1667 ( 1980 PWs) bands (ev): 0.7824 0.7824 5.2802 5.2802 5.3429 5.3429 5.5726 5.5726 5.7073 5.7073 5.9333 5.9333 6.0288 6.0288 6.0945 6.0945 7.1664 7.1664 7.6012 7.6012 9.6590 9.6590 9.6605 9.6605 10.3161 10.3161 10.7706 10.7706 10.8286 10.8286 11.0525 11.0525 11.1260 11.1260 11.3020 11.3020 11.5833 11.5833 12.1406 12.1406 12.2117 12.2117 12.6676 12.6676 13.2536 13.2536 13.3181 13.3181 k = 0.5000 0.5000 0.1786 ( 1988 PWs) bands (ev): 0.8099 0.8099 5.2594 5.2594 5.3219 5.3219 5.5630 5.5630 5.7133 5.7133 5.9312 5.9312 6.0446 6.0446 6.1095 6.1095 7.1139 7.1139 7.5976 7.5976 9.6882 9.6882 9.6893 9.6893 10.3418 10.3418 10.7735 10.7735 10.8320 10.8320 11.0713 11.0713 11.1432 11.1432 11.2759 11.2759 11.5501 11.5501 12.1414 12.1414 12.2414 12.2414 12.6577 12.6577 13.2434 13.2434 13.3073 13.3073 k = 0.5000 0.5000 0.1905 ( 1988 PWs) bands (ev): 0.8388 0.8388 5.2389 5.2389 5.3012 5.3012 5.5525 5.5525 5.7194 5.7194 5.9286 5.9286 6.0598 6.0598 6.1241 6.1241 7.0601 7.0601 7.5939 7.5939 9.7198 9.7198 9.7206 9.7206 10.3691 10.3691 10.7767 10.7767 10.8358 10.8358 11.0902 11.0902 11.1600 11.1600 11.2512 11.2512 11.5169 11.5169 12.1422 12.1422 12.2705 12.2705 12.6470 12.6470 13.2320 13.2320 13.2954 13.2954 k = 0.5000 0.5000 0.2024 ( 1988 PWs) bands (ev): 0.8691 0.8691 5.2187 5.2187 5.2808 5.2808 5.5409 5.5409 5.7258 5.7258 5.9255 5.9255 6.0743 6.0743 6.1380 6.1380 7.0053 7.0053 7.5903 7.5903 9.7537 9.7537 9.7541 9.7541 10.3978 10.3978 10.7801 10.7801 10.8396 10.8396 11.1092 11.1092 11.1746 11.1746 11.2296 11.2296 11.4840 11.4840 12.1431 12.1431 12.2990 12.2990 12.6355 12.6355 13.2196 13.2196 13.2823 13.2823 k = 0.5000 0.5000 0.2143 ( 1980 PWs) bands (ev): 0.9008 0.9008 5.1990 5.1990 5.2607 5.2607 5.5283 5.5283 5.7323 5.7323 5.9221 5.9221 6.0883 6.0883 6.1513 6.1513 6.9501 6.9501 7.5868 7.5868 9.7901 9.7901 9.7901 9.7901 10.4278 10.4278 10.7838 10.7838 10.8435 10.8435 11.1279 11.1279 11.1792 11.1792 11.2188 11.2188 11.4519 11.4519 12.1441 12.1441 12.3267 12.3267 12.6230 12.6230 13.2060 13.2060 13.2680 13.2680 k = 0.5000 0.5000 0.2262 ( 1988 PWs) bands (ev): 0.9336 0.9336 5.1797 5.1797 5.2410 5.2410 5.5143 5.5143 5.7388 5.7388 5.9183 5.9183 6.1013 6.1013 6.1638 6.1638 6.8946 6.8946 7.5834 7.5834 9.8284 9.8284 9.8287 9.8287 10.4589 10.4589 10.7872 10.7872 10.8473 10.8473 11.1460 11.1460 11.1657 11.1657 11.2267 11.2267 11.4205 11.4205 12.1450 12.1450 12.3535 12.3535 12.6097 12.6097 13.1910 13.1910 13.2523 13.2523 k = 0.5000 0.5000 0.2381 ( 1972 PWs) bands (ev): 0.9676 0.9676 5.1610 5.1610 5.2220 5.2220 5.4989 5.4989 5.7454 5.7454 5.9143 5.9143 6.1138 6.1138 6.1757 6.1757 6.8400 6.8400 7.5801 7.5801 9.8691 9.8691 9.8698 9.8698 10.4916 10.4916 10.7911 10.7911 10.8513 10.8513 11.1457 11.1457 11.1635 11.1635 11.2417 11.2417 11.3905 11.3905 12.1460 12.1460 12.3795 12.3795 12.5957 12.5957 13.1747 13.1747 13.2352 13.2352 k = 0.5000 0.5000 0.2500 ( 1972 PWs) bands (ev): 1.0025 1.0025 5.1429 5.1429 5.2033 5.2033 5.4819 5.4819 5.7519 5.7519 5.9100 5.9100 6.1254 6.1254 6.1866 6.1866 6.7861 6.7861 7.5770 7.5770 9.9120 9.9120 9.9131 9.9131 10.5251 10.5251 10.7948 10.7948 10.8552 10.8552 11.1249 11.1249 11.1794 11.1794 11.2578 11.2578 11.3621 11.3621 12.1469 12.1469 12.4041 12.4041 12.5808 12.5808 13.1570 13.1570 13.2166 13.2166 k = 0.5000 0.5000 0.2619 ( 1976 PWs) bands (ev): 1.0381 1.0381 5.1253 5.1253 5.1852 5.1852 5.4632 5.4632 5.7584 5.7584 5.9054 5.9054 6.1362 6.1362 6.1968 6.1968 6.7337 6.7337 7.5740 7.5740 9.9571 9.9571 9.9586 9.9586 10.5595 10.5595 10.7986 10.7986 10.8591 10.8591 11.1044 11.1044 11.1929 11.1929 11.2738 11.2738 11.3364 11.3364 12.1478 12.1478 12.4272 12.4272 12.5655 12.5655 13.1378 13.1378 13.1964 13.1964 k = 0.5000 0.5000 0.2738 ( 1976 PWs) bands (ev): 1.0744 1.0744 5.1084 5.1084 5.1678 5.1678 5.4427 5.4427 5.7648 5.7648 5.9006 5.9006 6.1464 6.1464 6.2061 6.2061 6.6832 6.6832 7.5712 7.5712 10.0044 10.0044 10.0063 10.0063 10.5949 10.5949 10.8024 10.8024 10.8628 10.8628 11.0847 11.0847 11.2025 11.2025 11.2891 11.2891 11.3149 11.3149 12.1487 12.1487 12.4479 12.4479 12.5506 12.5506 13.1170 13.1170 13.1746 13.1746 k = 0.5000 0.5000 0.2857 ( 1960 PWs) bands (ev): 1.1112 1.1112 5.0923 5.0923 5.1510 5.1510 5.4204 5.4204 5.7711 5.7711 5.8957 5.8957 6.1559 6.1559 6.2147 6.2147 6.6350 6.6350 7.5687 7.5687 10.0537 10.0537 10.0561 10.0561 10.6311 10.6311 10.8062 10.8062 10.8666 10.8666 11.0659 11.0659 11.2055 11.2055 11.3004 11.3004 11.3035 11.3035 12.1499 12.1499 12.4641 12.4641 12.5383 12.5383 13.0948 13.0948 13.1512 13.1512 k = 0.5000 0.5000 0.2976 ( 1960 PWs) bands (ev): 1.1483 1.1483 5.0768 5.0768 5.1348 5.1348 5.3963 5.3963 5.7773 5.7773 5.8906 5.8906 6.1645 6.1645 6.2224 6.2224 6.5896 6.5896 7.5664 7.5664 10.1050 10.1050 10.1079 10.1079 10.6678 10.6678 10.8099 10.8099 10.8702 10.8702 11.0481 11.0481 11.1994 11.1994 11.2947 11.2947 11.3166 11.3166 12.1507 12.1507 12.4700 12.4700 12.5340 12.5340 13.0711 13.0711 13.1262 13.1262 k = 0.5000 0.5000 0.3095 ( 1960 PWs) bands (ev): 1.1855 1.1855 5.0621 5.0621 5.1192 5.1192 5.3703 5.3703 5.7833 5.7833 5.8854 5.8854 6.1725 6.1725 6.2293 6.2293 6.5473 6.5473 7.5642 7.5642 10.1581 10.1581 10.1615 10.1615 10.7049 10.7049 10.8135 10.8135 10.8736 10.8736 11.0313 11.0313 11.1859 11.1859 11.2965 11.2965 11.3282 11.3282 12.1515 12.1515 12.4621 12.4621 12.5414 12.5414 13.0458 13.0458 13.0996 13.0996 k = 0.5000 0.5000 0.3214 ( 1952 PWs) bands (ev): 1.2225 1.2225 5.0482 5.0482 5.1043 5.1043 5.3428 5.3428 5.7891 5.7891 5.8803 5.8803 6.1798 6.1798 6.2353 6.2353 6.5083 6.5083 7.5623 7.5623 10.2129 10.2129 10.2169 10.2169 10.7423 10.7423 10.8171 10.8171 10.8770 10.8770 11.0157 11.0157 11.1687 11.1687 11.3018 11.3018 11.3382 11.3382 12.1524 12.1524 12.4455 12.4455 12.5555 12.5555 13.0193 13.0193 13.0715 13.0715 k = 0.5000 0.5000 0.3333 ( 1952 PWs) bands (ev): 1.2591 1.2591 5.0350 5.0350 5.0900 5.0900 5.3139 5.3139 5.7946 5.7946 5.8752 5.8752 6.1865 6.1865 6.2404 6.2404 6.4729 6.4729 7.5605 7.5605 10.2691 10.2691 10.2737 10.2737 10.7794 10.7794 10.8205 10.8205 10.8804 10.8804 11.0014 11.0014 11.1502 11.1502 11.3078 11.3078 11.3461 11.3461 12.1532 12.1532 12.4249 12.4249 12.5714 12.5714 12.9914 12.9914 13.0421 13.0421 k = 0.5000 0.5000 0.3452 ( 1944 PWs) bands (ev): 1.2951 1.2951 5.0227 5.0227 5.0763 5.0763 5.2840 5.2840 5.8000 5.8000 5.8702 5.8702 6.1926 6.1926 6.2446 6.2446 6.4412 6.4412 7.5590 7.5590 10.3266 10.3266 10.3319 10.3319 10.8155 10.8155 10.8239 10.8239 10.8847 10.8847 10.9884 10.9884 11.1318 11.1318 11.3130 11.3130 11.3518 11.3518 12.1539 12.1539 12.4023 12.4023 12.5873 12.5873 12.9626 12.9626 13.0116 13.0116 k = 0.5000 0.5000 0.3571 ( 1944 PWs) bands (ev): 1.3302 1.3302 5.0111 5.0111 5.0631 5.0631 5.2536 5.2536 5.8049 5.8049 5.8654 5.8654 6.1981 6.1981 6.2478 6.2478 6.4133 6.4133 7.5577 7.5577 10.3850 10.3850 10.3911 10.3911 10.8270 10.8270 10.8475 10.8475 10.8920 10.8920 10.9769 10.9769 11.1142 11.1142 11.3167 11.3167 11.3549 11.3549 12.1546 12.1546 12.3783 12.3783 12.6027 12.6027 12.9329 12.9329 12.9801 12.9801 k = 0.5000 0.5000 0.3690 ( 1944 PWs) bands (ev): 1.3641 1.3641 5.0004 5.0004 5.0504 5.0504 5.2232 5.2232 5.8095 5.8095 5.8608 5.8608 6.2029 6.2029 6.2500 6.2500 6.3891 6.3891 7.5565 7.5565 10.4442 10.4442 10.4511 10.4511 10.8299 10.8299 10.8673 10.8673 10.9104 10.9104 10.9671 10.9671 11.0976 11.0976 11.3182 11.3182 11.3552 11.3552 12.1552 12.1552 12.3536 12.3536 12.6171 12.6171 12.9029 12.9029 12.9482 12.9482 k = 0.5000 0.5000 0.3810 ( 1936 PWs) bands (ev): 1.3966 1.3966 4.9907 4.9907 5.0381 5.0381 5.1936 5.1936 5.8138 5.8138 5.8566 5.8566 6.2073 6.2073 6.2510 6.2510 6.3687 6.3687 7.5555 7.5555 10.5038 10.5038 10.5116 10.5116 10.8326 10.8326 10.8741 10.8741 10.9400 10.9400 10.9595 10.9595 11.0824 11.0824 11.3172 11.3172 11.3526 11.3526 12.1557 12.1557 12.3285 12.3285 12.6305 12.6305 12.8730 12.8730 12.9162 12.9162 k = 0.5000 0.5000 0.3929 ( 1944 PWs) bands (ev): 1.4271 1.4271 4.9817 4.9817 5.0259 5.0259 5.1653 5.1653 5.8176 5.8176 5.8526 5.8526 6.2111 6.2111 6.2506 6.2506 6.3521 6.3521 7.5547 7.5547 10.5633 10.5633 10.5720 10.5720 10.8350 10.8350 10.8759 10.8759 10.9509 10.9509 10.9753 10.9753 11.0683 11.0683 11.3133 11.3133 11.3465 11.3465 12.1562 12.1562 12.3033 12.3033 12.6426 12.6426 12.8435 12.8435 12.8844 12.8844 k = 0.5000 0.5000 0.4048 ( 1944 PWs) bands (ev): 1.4556 1.4556 4.9737 4.9737 5.0139 5.0139 5.1391 5.1391 5.8211 5.8211 5.8490 5.8490 6.2145 6.2145 6.2489 6.2489 6.3392 6.3392 7.5540 7.5540 10.6225 10.6225 10.6321 10.6321 10.8372 10.8372 10.8763 10.8763 10.9463 10.9463 11.0079 11.0079 11.0561 11.0561 11.3062 11.3062 11.3369 11.3369 12.1566 12.1566 12.2785 12.2785 12.6533 12.6533 12.8151 12.8151 12.8537 12.8537 k = 0.5000 0.5000 0.4167 ( 1944 PWs) bands (ev): 1.4817 1.4817 4.9666 4.9666 5.0018 5.0018 5.1159 5.1159 5.8243 5.8243 5.8457 5.8457 6.2174 6.2174 6.2460 6.2460 6.3296 6.3296 7.5534 7.5534 10.6807 10.6807 10.6909 10.6909 10.8392 10.8392 10.8764 10.8764 10.9428 10.9428 11.0394 11.0394 11.0455 11.0455 11.2957 11.2957 11.3234 11.3234 12.1570 12.1570 12.2546 12.2546 12.6625 12.6625 12.7886 12.7886 12.8246 12.8246 k = 0.5000 0.5000 0.4286 ( 1944 PWs) bands (ev): 1.5051 1.5051 4.9605 4.9605 4.9897 4.9897 5.0960 5.0960 5.8270 5.8270 5.8428 5.8428 6.2199 6.2199 6.2423 6.2423 6.3229 6.3229 7.5529 7.5529 10.7372 10.7372 10.7468 10.7468 10.8410 10.8410 10.8779 10.8779 10.9404 10.9404 11.0367 11.0367 11.0687 11.0687 11.2816 11.2816 11.3060 11.3060 12.1573 12.1573 12.2320 12.2320 12.6698 12.6698 12.7647 12.7647 12.7976 12.7976 k = 0.5000 0.5000 0.4405 ( 1936 PWs) bands (ev): 1.5254 1.5254 4.9552 4.9552 4.9779 4.9779 5.0798 5.0798 5.8294 5.8294 5.8404 5.8404 6.2220 6.2220 6.2384 6.2384 6.3184 6.3184 7.5526 7.5526 10.7912 10.7912 10.7958 10.7958 10.8426 10.8426 10.8846 10.8846 10.9391 10.9391 11.0301 11.0301 11.0951 11.0951 11.2641 11.2641 11.2847 11.2847 12.1576 12.1576 12.2115 12.2115 12.6751 12.6751 12.7445 12.7445 12.7735 12.7735 k = 0.5000 0.5000 0.4524 ( 1928 PWs) bands (ev): 1.5424 1.5424 4.9510 4.9510 4.9668 4.9668 5.0673 5.0673 5.8313 5.8313 5.8385 5.8385 6.2237 6.2237 6.2346 6.2346 6.3155 6.3155 7.5523 7.5523 10.8281 10.8281 10.8411 10.8411 10.8440 10.8440 10.9053 10.9053 10.9391 10.9391 11.0262 11.0262 11.1179 11.1179 11.2434 11.2434 11.2594 11.2594 12.1578 12.1578 12.1936 12.1936 12.6773 12.6773 12.7292 12.7292 12.7529 12.7529 k = 0.5000 0.5000 0.4643 ( 1924 PWs) bands (ev): 1.5560 1.5560 4.9477 4.9477 4.9572 4.9572 5.0581 5.0581 5.8328 5.8328 5.8369 5.8369 6.2249 6.2249 6.2312 6.2312 6.3137 6.3137 7.5522 7.5522 10.8407 10.8407 10.8447 10.8447 10.8851 10.8851 10.9316 10.9316 10.9509 10.9509 11.0259 11.0259 11.1363 11.1363 11.2202 11.2202 11.2308 11.2308 12.1580 12.1580 12.1787 12.1787 12.6760 12.6760 12.7197 12.7197 12.7362 12.7362 k = 0.5000 0.5000 0.4762 ( 1908 PWs) bands (ev): 1.5658 1.5658 4.9454 4.9454 4.9498 4.9498 5.0520 5.0520 5.8340 5.8340 5.8358 5.8358 6.2259 6.2259 6.2288 6.2288 6.3126 6.3126 7.5521 7.5521 10.8446 10.8446 10.8455 10.8455 10.9191 10.9191 10.9349 10.9349 10.9908 10.9908 11.0307 11.0307 11.1496 11.1496 11.1964 11.1964 11.2005 11.2005 12.1584 12.1584 12.1677 12.1677 12.6724 12.6724 12.7157 12.7157 12.7240 12.7240 k = 0.5000 0.5000 0.4881 ( 1904 PWs) bands (ev): 1.5717 1.5717 4.9440 4.9440 4.9451 4.9451 5.0484 5.0484 5.8347 5.8347 5.8351 5.8351 6.2265 6.2265 6.2272 6.2272 6.3120 6.3120 7.5520 7.5520 10.8458 10.8458 10.8459 10.8459 10.9352 10.9352 10.9395 10.9395 11.0280 11.0280 11.0399 11.0399 11.1555 11.1555 11.1742 11.1742 11.1760 11.1760 12.1585 12.1585 12.1608 12.1608 12.6689 12.6689 12.7143 12.7143 12.7165 12.7165 k = 0.5000 0.5000 0.5000 ( 1904 PWs) bands (ev): 1.5737 1.5737 4.9435 4.9435 4.9435 4.9435 5.0472 5.0472 5.8349 5.8349 5.8349 5.8349 6.2267 6.2267 6.2267 6.2267 6.3119 6.3119 7.5520 7.5520 10.8460 10.8460 10.8460 10.8460 10.9353 10.9353 10.9459 10.9459 11.0453 11.0453 11.0453 11.0453 11.1510 11.1510 11.1673 11.1673 11.1673 11.1673 12.1585 12.1585 12.1585 12.1585 12.6675 12.6675 12.7140 12.7140 12.7140 12.7140 Writing output data file ZnFe3C.save init_run : 0.24s CPU 0.62s WALL ( 1 calls) electrons : 68.64s CPU 70.89s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.12s WALL ( 1 calls) potinit : 0.01s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 68.63s CPU 70.88s 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 : 0.05s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.04s WALL ( 322 calls) cegterg : 60.75s CPU 61.97s WALL ( 330 calls) Called by sum_band: Called by *egterg: h_psi : 30.34s CPU 31.42s WALL ( 4322 calls) s_psi : 3.58s CPU 3.68s WALL ( 4322 calls) g_psi : 0.08s CPU 0.08s WALL ( 3670 calls) cdiaghg : 26.37s CPU 26.63s WALL ( 3992 calls) cegterg:over : 2.52s CPU 2.56s WALL ( 3670 calls) cegterg:upda : 1.46s CPU 1.56s WALL ( 3670 calls) cegterg:last : 1.14s CPU 1.16s WALL ( 974 calls) cdiaghg:chol : 1.35s CPU 1.46s WALL ( 3992 calls) cdiaghg:inve : 0.90s CPU 0.99s WALL ( 3992 calls) cdiaghg:para : 1.46s CPU 1.53s WALL ( 7984 calls) Called by h_psi: h_psi:vloc : 22.50s CPU 23.56s WALL ( 4322 calls) h_psi:vnl : 7.76s CPU 7.79s WALL ( 4322 calls) add_vuspsi : 4.27s CPU 4.26s WALL ( 4322 calls) General routines calbec : 3.46s CPU 3.52s WALL ( 4322 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 20.68s CPU 21.49s WALL ( 643684 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.09s CPU 0.10s WALL ( 644 calls) Parallel routines fft_scatter : 12.88s CPU 13.53s WALL ( 643707 calls) PWSCF : 1m19.92s CPU 1m45.47s WALL This run was terminated on: 16:57:26 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=