Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:53:34 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: ./GeO2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 49 28 8 1573 689 112 Max 50 29 9 1576 715 115 Sum 1781 1041 305 56667 25173 4067 bravais-lattice index = 14 lattice parameter (alat) = 8.3235 a.u. unit-cell volume = 576.6548 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.323487 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 Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 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 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) O 6.00 15.99940 O( 1.00) 24 Sym. Ops., with inversion, found (18 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.5000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.5000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 120 deg rotation - cart. axis [-1,-1,-1] cryst. s( 5) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 5) = ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 6 120 deg rotation - cart. axis [-1,1,1] cryst. s( 6) = ( 0 0 -1 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) isym = 9 120 deg rotation - cart. axis [1,1,1] cryst. s( 9) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 10 120 deg rotation - cart. axis [-1,1,-1] cryst. s(10) = ( 0 -1 0 ) f =( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) f =( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) f =( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.5000000 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.5000000 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 17 inv. 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 inv. 120 deg rotation - cart. axis [-1,1,1] cryst. s(18) = ( 0 0 1 ) f =( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) cart. s(18) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) isym = 19 inv. 120 deg rotation - cart. axis [1,1,-1] cryst. s(19) = ( 0 0 1 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) cart. s(19) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) isym = 20 inv. 120 deg rotation - cart. axis [1,-1,1] cryst. s(20) = ( 0 0 -1 ) f =( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) cart. s(20) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) isym = 21 inv. 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 inv. 120 deg rotation - cart. axis [-1,1,-1] cryst. s(22) = ( 0 1 0 ) f =( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) cart. s(22) = ( 0.0000000 0.0000000 -1.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) isym = 23 inv. 120 deg rotation - cart. axis [1,-1,-1] cryst. s(23) = ( 0 1 0 ) f =( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) cart. s(23) = ( 0.0000000 -0.0000000 1.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) isym = 24 inv. 120 deg rotation - cart. axis [-1,-1,1] cryst. s(24) = ( 0 -1 0 ) f =( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) cart. s(24) = ( -0.0000000 0.0000000 1.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) double point group T_h (m-3) there are 14 classes and 6 irreducible representations the character table: E -E 3C2 4C3 -4C3 4C3' -4C3' i -i 3s_h 4S6' -4S6' -3C2 -3s_h G_5+ 2.00 -2.00 0.00 1.00 -1.00 1.00 -1.00 2.00 -2.00 0.00 1.00 -1.00 G_6+ 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 2.00 -2.00 0.00 -0.50 0.50 G_7+ 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 2.00 -2.00 0.00 -0.50 0.50 G_5- 2.00 -2.00 0.00 1.00 -1.00 1.00 -1.00 -2.00 2.00 0.00 -1.00 1.00 G_6- 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 -2.00 2.00 0.00 0.50 -0.50 G_7- 2.00 -2.00 0.00 -0.50 0.50 -0.50 0.50 -2.00 2.00 0.00 0.50 -0.50 4S6 -4S6 G_5+ 1.00 -1.00 G_6+ -0.50 0.50 G_7+ -0.50 0.50 G_5- -1.00 1.00 G_6- 0.50 -0.50 G_7- 0.50 -0.50 imaginary part E -E 3C2 4C3 -4C3 4C3' -4C3' i -i 3s_h 4S6' -4S6' -3C2 -3s_h G_5+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_6+ 0.00 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 0.00 0.87 -0.87 G_7+ 0.00 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 0.00 -0.87 0.87 G_5- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_6- 0.00 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 0.00 -0.87 0.87 G_7- 0.00 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 0.00 0.87 -0.87 4S6 -4S6 G_5+ 0.00 0.00 G_6+ -0.87 0.87 G_7+ 0.87 -0.87 G_5- 0.00 0.00 G_6- 0.87 -0.87 G_7- -0.87 0.87 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 3C2 -3C2 2 -2 3 -3 4 -4 180 deg rotation - cart. axis [0,0,1] 4C3 9 12 10 11 120 deg rotation - cart. axis [1,1,1] -4C3 -9 -12 -10 -11 120 deg rotation - cart. axis [1,1,1] E 4C3' 5 7 8 6 120 deg rotation - cart. axis [-1,-1,-1] -4C3' -5 -7 -8 -6 120 deg rotation - cart. axis [-1,-1,-1] E i 13 inversion -i -13 inversion E 3s_h-3s_h 14 -14 15 -15 16 -16 inv. 180 deg rotation - cart. axis [0,0,1] 4S6' 21 24 22 23 inv. 120 deg rotation - cart. axis [1,1,1] -4S6' -21 -24 -22 -23 inv. 120 deg rotation - cart. axis [1,1,1] E 4S6 17 19 20 18 inv. 120 deg rotation - cart. axis [-1,-1,-1] -4S6 -17 -19 -20 -18 inv. 120 deg rotation - cart. axis [-1,-1,-1] E Cartesian axes number of k points= 278 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035971 k( 2) = ( 0.0000000 0.0138889 -0.0000000), wk = 0.0035971 k( 3) = ( 0.0000000 0.0277778 -0.0000000), wk = 0.0035971 k( 4) = ( 0.0000000 0.0416667 -0.0000000), wk = 0.0035971 k( 5) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0035971 k( 6) = ( 0.0000000 0.0694444 -0.0000000), wk = 0.0035971 k( 7) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0035971 k( 8) = ( 0.0000000 0.0972222 -0.0000000), wk = 0.0035971 k( 9) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0035971 k( 10) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0035971 k( 11) = ( 0.0000000 0.1388889 -0.0000000), wk = 0.0035971 k( 12) = ( 0.0000000 0.1527778 -0.0000000), wk = 0.0035971 k( 13) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0035971 k( 14) = ( 0.0000000 0.1805556 -0.0000000), wk = 0.0035971 k( 15) = ( 0.0000000 0.1944444 -0.0000000), wk = 0.0035971 k( 16) = ( 0.0000000 0.2083333 -0.0000000), wk = 0.0035971 k( 17) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0035971 k( 18) = ( 0.0000000 0.2361111 -0.0000000), wk = 0.0035971 k( 19) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0035971 k( 20) = ( 0.0000000 0.2638889 -0.0000000), wk = 0.0035971 k( 21) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0035971 k( 22) = ( 0.0000000 0.2916667 -0.0000000), wk = 0.0035971 k( 23) = ( 0.0000000 0.3055556 -0.0000000), wk = 0.0035971 k( 24) = ( 0.0000000 0.3194444 -0.0000000), wk = 0.0035971 k( 25) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0035971 k( 26) = ( 0.0000000 0.3472222 -0.0000000), wk = 0.0035971 k( 27) = ( 0.0000000 0.3611111 -0.0000000), wk = 0.0035971 k( 28) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0035971 k( 29) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0035971 k( 30) = ( 0.0000000 0.4027778 -0.0000000), wk = 0.0035971 k( 31) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0035971 k( 32) = ( 0.0000000 0.4305556 -0.0000000), wk = 0.0035971 k( 33) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0035971 k( 34) = ( 0.0000000 0.4583333 -0.0000000), wk = 0.0035971 k( 35) = ( 0.0000000 0.4722222 -0.0000000), wk = 0.0035971 k( 36) = ( 0.0000000 0.4861111 -0.0000000), wk = 0.0035971 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0035971 k( 38) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0035971 k( 39) = ( 0.0138889 0.5000000 -0.0000000), wk = 0.0035971 k( 40) = ( 0.0277778 0.5000000 -0.0000000), wk = 0.0035971 k( 41) = ( 0.0416667 0.5000000 -0.0000000), wk = 0.0035971 k( 42) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0035971 k( 43) = ( 0.0694444 0.5000000 -0.0000000), wk = 0.0035971 k( 44) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0035971 k( 45) = ( 0.0972222 0.5000000 -0.0000000), wk = 0.0035971 k( 46) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0035971 k( 47) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0035971 k( 48) = ( 0.1388889 0.5000000 -0.0000000), wk = 0.0035971 k( 49) = ( 0.1527778 0.5000000 -0.0000000), wk = 0.0035971 k( 50) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0035971 k( 51) = ( 0.1805556 0.5000000 -0.0000000), wk = 0.0035971 k( 52) = ( 0.1944444 0.5000000 -0.0000000), wk = 0.0035971 k( 53) = ( 0.2083333 0.5000000 -0.0000000), wk = 0.0035971 k( 54) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0035971 k( 55) = ( 0.2361111 0.5000000 -0.0000000), wk = 0.0035971 k( 56) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0035971 k( 57) = ( 0.2638889 0.5000000 -0.0000000), wk = 0.0035971 k( 58) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0035971 k( 59) = ( 0.2916667 0.5000000 -0.0000000), wk = 0.0035971 k( 60) = ( 0.3055556 0.5000000 -0.0000000), wk = 0.0035971 k( 61) = ( 0.3194444 0.5000000 -0.0000000), wk = 0.0035971 k( 62) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0035971 k( 63) = ( 0.3472222 0.5000000 -0.0000000), wk = 0.0035971 k( 64) = ( 0.3611111 0.5000000 -0.0000000), wk = 0.0035971 k( 65) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0035971 k( 66) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0035971 k( 67) = ( 0.4027778 0.5000000 -0.0000000), wk = 0.0035971 k( 68) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0035971 k( 69) = ( 0.4305556 0.5000000 -0.0000000), wk = 0.0035971 k( 70) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0035971 k( 71) = ( 0.4583333 0.5000000 -0.0000000), wk = 0.0035971 k( 72) = ( 0.4722222 0.5000000 -0.0000000), wk = 0.0035971 k( 73) = ( 0.4861111 0.5000000 -0.0000000), wk = 0.0035971 k( 74) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035971 k( 75) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035971 k( 76) = ( 0.4901961 0.4901961 -0.0000000), wk = 0.0035971 k( 77) = ( 0.4803922 0.4803922 -0.0000000), wk = 0.0035971 k( 78) = ( 0.4705882 0.4705882 -0.0000000), wk = 0.0035971 k( 79) = ( 0.4607843 0.4607843 -0.0000000), wk = 0.0035971 k( 80) = ( 0.4509804 0.4509804 -0.0000000), wk = 0.0035971 k( 81) = ( 0.4411765 0.4411765 -0.0000000), wk = 0.0035971 k( 82) = ( 0.4313726 0.4313725 -0.0000000), wk = 0.0035971 k( 83) = ( 0.4215686 0.4215686 -0.0000000), wk = 0.0035971 k( 84) = ( 0.4117647 0.4117647 -0.0000000), wk = 0.0035971 k( 85) = ( 0.4019608 0.4019608 -0.0000000), wk = 0.0035971 k( 86) = ( 0.3921569 0.3921569 -0.0000000), wk = 0.0035971 k( 87) = ( 0.3823529 0.3823529 -0.0000000), wk = 0.0035971 k( 88) = ( 0.3725490 0.3725490 -0.0000000), wk = 0.0035971 k( 89) = ( 0.3627451 0.3627451 -0.0000000), wk = 0.0035971 k( 90) = ( 0.3529412 0.3529412 -0.0000000), wk = 0.0035971 k( 91) = ( 0.3431373 0.3431372 -0.0000000), wk = 0.0035971 k( 92) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0035971 k( 93) = ( 0.3235294 0.3235294 -0.0000000), wk = 0.0035971 k( 94) = ( 0.3137255 0.3137255 -0.0000000), wk = 0.0035971 k( 95) = ( 0.3039216 0.3039216 -0.0000000), wk = 0.0035971 k( 96) = ( 0.2941177 0.2941176 -0.0000000), wk = 0.0035971 k( 97) = ( 0.2843137 0.2843137 -0.0000000), wk = 0.0035971 k( 98) = ( 0.2745098 0.2745098 -0.0000000), wk = 0.0035971 k( 99) = ( 0.2647059 0.2647059 -0.0000000), wk = 0.0035971 k( 100) = ( 0.2549020 0.2549020 -0.0000000), wk = 0.0035971 k( 101) = ( 0.2450980 0.2450980 -0.0000000), wk = 0.0035971 k( 102) = ( 0.2352941 0.2352941 -0.0000000), wk = 0.0035971 k( 103) = ( 0.2254902 0.2254902 -0.0000000), wk = 0.0035971 k( 104) = ( 0.2156863 0.2156863 -0.0000000), wk = 0.0035971 k( 105) = ( 0.2058823 0.2058823 -0.0000000), wk = 0.0035971 k( 106) = ( 0.1960784 0.1960784 -0.0000000), wk = 0.0035971 k( 107) = ( 0.1862745 0.1862745 -0.0000000), wk = 0.0035971 k( 108) = ( 0.1764706 0.1764706 -0.0000000), wk = 0.0035971 k( 109) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0035971 k( 110) = ( 0.1568627 0.1568627 -0.0000000), wk = 0.0035971 k( 111) = ( 0.1470588 0.1470588 -0.0000000), wk = 0.0035971 k( 112) = ( 0.1372549 0.1372549 -0.0000000), wk = 0.0035971 k( 113) = ( 0.1274510 0.1274510 -0.0000000), wk = 0.0035971 k( 114) = ( 0.1176471 0.1176471 -0.0000000), wk = 0.0035971 k( 115) = ( 0.1078431 0.1078431 -0.0000000), wk = 0.0035971 k( 116) = ( 0.0980392 0.0980392 -0.0000000), wk = 0.0035971 k( 117) = ( 0.0882353 0.0882353 -0.0000000), wk = 0.0035971 k( 118) = ( 0.0784314 0.0784314 -0.0000000), wk = 0.0035971 k( 119) = ( 0.0686275 0.0686275 -0.0000000), wk = 0.0035971 k( 120) = ( 0.0588235 0.0588235 -0.0000000), wk = 0.0035971 k( 121) = ( 0.0490196 0.0490196 -0.0000000), wk = 0.0035971 k( 122) = ( 0.0392157 0.0392157 -0.0000000), wk = 0.0035971 k( 123) = ( 0.0294118 0.0294118 -0.0000000), wk = 0.0035971 k( 124) = ( 0.0196078 0.0196078 -0.0000000), wk = 0.0035971 k( 125) = ( 0.0098039 0.0098039 -0.0000000), wk = 0.0035971 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035971 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035971 k( 128) = ( 0.0080645 0.0080645 0.0080645), wk = 0.0035971 k( 129) = ( 0.0161290 0.0161290 0.0161290), wk = 0.0035971 k( 130) = ( 0.0241936 0.0241935 0.0241935), wk = 0.0035971 k( 131) = ( 0.0322581 0.0322581 0.0322581), wk = 0.0035971 k( 132) = ( 0.0403226 0.0403226 0.0403226), wk = 0.0035971 k( 133) = ( 0.0483871 0.0483871 0.0483871), wk = 0.0035971 k( 134) = ( 0.0564516 0.0564516 0.0564516), wk = 0.0035971 k( 135) = ( 0.0645161 0.0645161 0.0645161), wk = 0.0035971 k( 136) = ( 0.0725806 0.0725806 0.0725806), wk = 0.0035971 k( 137) = ( 0.0806452 0.0806452 0.0806452), wk = 0.0035971 k( 138) = ( 0.0887097 0.0887097 0.0887097), wk = 0.0035971 k( 139) = ( 0.0967742 0.0967742 0.0967742), wk = 0.0035971 k( 140) = ( 0.1048387 0.1048387 0.1048387), wk = 0.0035971 k( 141) = ( 0.1129032 0.1129032 0.1129032), wk = 0.0035971 k( 142) = ( 0.1209677 0.1209677 0.1209677), wk = 0.0035971 k( 143) = ( 0.1290323 0.1290323 0.1290323), wk = 0.0035971 k( 144) = ( 0.1370968 0.1370968 0.1370968), wk = 0.0035971 k( 145) = ( 0.1451613 0.1451613 0.1451613), wk = 0.0035971 k( 146) = ( 0.1532258 0.1532258 0.1532258), wk = 0.0035971 k( 147) = ( 0.1612903 0.1612903 0.1612903), wk = 0.0035971 k( 148) = ( 0.1693548 0.1693548 0.1693548), wk = 0.0035971 k( 149) = ( 0.1774194 0.1774193 0.1774193), wk = 0.0035971 k( 150) = ( 0.1854839 0.1854839 0.1854839), wk = 0.0035971 k( 151) = ( 0.1935484 0.1935484 0.1935484), wk = 0.0035971 k( 152) = ( 0.2016129 0.2016129 0.2016129), wk = 0.0035971 k( 153) = ( 0.2096774 0.2096774 0.2096774), wk = 0.0035971 k( 154) = ( 0.2177419 0.2177419 0.2177419), wk = 0.0035971 k( 155) = ( 0.2258064 0.2258064 0.2258064), wk = 0.0035971 k( 156) = ( 0.2338710 0.2338710 0.2338710), wk = 0.0035971 k( 157) = ( 0.2419355 0.2419355 0.2419355), wk = 0.0035971 k( 158) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035971 k( 159) = ( 0.2580645 0.2580645 0.2580645), wk = 0.0035971 k( 160) = ( 0.2661290 0.2661290 0.2661290), wk = 0.0035971 k( 161) = ( 0.2741936 0.2741936 0.2741935), wk = 0.0035971 k( 162) = ( 0.2822581 0.2822581 0.2822581), wk = 0.0035971 k( 163) = ( 0.2903226 0.2903226 0.2903226), wk = 0.0035971 k( 164) = ( 0.2983871 0.2983871 0.2983871), wk = 0.0035971 k( 165) = ( 0.3064516 0.3064516 0.3064516), wk = 0.0035971 k( 166) = ( 0.3145161 0.3145161 0.3145161), wk = 0.0035971 k( 167) = ( 0.3225807 0.3225806 0.3225806), wk = 0.0035971 k( 168) = ( 0.3306452 0.3306452 0.3306452), wk = 0.0035971 k( 169) = ( 0.3387097 0.3387097 0.3387097), wk = 0.0035971 k( 170) = ( 0.3467742 0.3467742 0.3467742), wk = 0.0035971 k( 171) = ( 0.3548387 0.3548387 0.3548387), wk = 0.0035971 k( 172) = ( 0.3629032 0.3629032 0.3629032), wk = 0.0035971 k( 173) = ( 0.3709677 0.3709677 0.3709677), wk = 0.0035971 k( 174) = ( 0.3790323 0.3790323 0.3790323), wk = 0.0035971 k( 175) = ( 0.3870968 0.3870968 0.3870968), wk = 0.0035971 k( 176) = ( 0.3951613 0.3951613 0.3951613), wk = 0.0035971 k( 177) = ( 0.4032258 0.4032258 0.4032258), wk = 0.0035971 k( 178) = ( 0.4112903 0.4112903 0.4112903), wk = 0.0035971 k( 179) = ( 0.4193548 0.4193548 0.4193548), wk = 0.0035971 k( 180) = ( 0.4274193 0.4274193 0.4274193), wk = 0.0035971 k( 181) = ( 0.4354839 0.4354839 0.4354839), wk = 0.0035971 k( 182) = ( 0.4435484 0.4435484 0.4435484), wk = 0.0035971 k( 183) = ( 0.4516129 0.4516129 0.4516129), wk = 0.0035971 k( 184) = ( 0.4596774 0.4596774 0.4596774), wk = 0.0035971 k( 185) = ( 0.4677419 0.4677419 0.4677419), wk = 0.0035971 k( 186) = ( 0.4758064 0.4758064 0.4758064), wk = 0.0035971 k( 187) = ( 0.4838710 0.4838710 0.4838710), wk = 0.0035971 k( 188) = ( 0.4919355 0.4919355 0.4919355), wk = 0.0035971 k( 189) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035971 k( 190) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035971 k( 191) = ( 0.4901961 0.5000000 0.4901961), wk = 0.0035971 k( 192) = ( 0.4803922 0.5000000 0.4803922), wk = 0.0035971 k( 193) = ( 0.4705882 0.5000000 0.4705882), wk = 0.0035971 k( 194) = ( 0.4607843 0.5000000 0.4607843), wk = 0.0035971 k( 195) = ( 0.4509804 0.5000000 0.4509804), wk = 0.0035971 k( 196) = ( 0.4411765 0.5000000 0.4411765), wk = 0.0035971 k( 197) = ( 0.4313726 0.5000000 0.4313725), wk = 0.0035971 k( 198) = ( 0.4215686 0.5000000 0.4215686), wk = 0.0035971 k( 199) = ( 0.4117647 0.5000000 0.4117647), wk = 0.0035971 k( 200) = ( 0.4019608 0.5000000 0.4019608), wk = 0.0035971 k( 201) = ( 0.3921569 0.5000000 0.3921569), wk = 0.0035971 k( 202) = ( 0.3823529 0.5000000 0.3823529), wk = 0.0035971 k( 203) = ( 0.3725490 0.5000000 0.3725490), wk = 0.0035971 k( 204) = ( 0.3627451 0.5000000 0.3627451), wk = 0.0035971 k( 205) = ( 0.3529412 0.5000000 0.3529412), wk = 0.0035971 k( 206) = ( 0.3431373 0.5000000 0.3431372), wk = 0.0035971 k( 207) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0035971 k( 208) = ( 0.3235294 0.5000000 0.3235294), wk = 0.0035971 k( 209) = ( 0.3137255 0.5000000 0.3137255), wk = 0.0035971 k( 210) = ( 0.3039216 0.5000000 0.3039216), wk = 0.0035971 k( 211) = ( 0.2941177 0.5000000 0.2941176), wk = 0.0035971 k( 212) = ( 0.2843137 0.5000000 0.2843137), wk = 0.0035971 k( 213) = ( 0.2745098 0.5000000 0.2745098), wk = 0.0035971 k( 214) = ( 0.2647059 0.5000000 0.2647059), wk = 0.0035971 k( 215) = ( 0.2549020 0.5000000 0.2549020), wk = 0.0035971 k( 216) = ( 0.2450980 0.5000000 0.2450980), wk = 0.0035971 k( 217) = ( 0.2352941 0.5000000 0.2352941), wk = 0.0035971 k( 218) = ( 0.2254902 0.5000000 0.2254902), wk = 0.0035971 k( 219) = ( 0.2156863 0.5000000 0.2156863), wk = 0.0035971 k( 220) = ( 0.2058823 0.5000000 0.2058823), wk = 0.0035971 k( 221) = ( 0.1960784 0.5000000 0.1960784), wk = 0.0035971 k( 222) = ( 0.1862745 0.5000000 0.1862745), wk = 0.0035971 k( 223) = ( 0.1764706 0.5000000 0.1764706), wk = 0.0035971 k( 224) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0035971 k( 225) = ( 0.1568627 0.5000000 0.1568627), wk = 0.0035971 k( 226) = ( 0.1470588 0.5000000 0.1470588), wk = 0.0035971 k( 227) = ( 0.1372549 0.5000000 0.1372549), wk = 0.0035971 k( 228) = ( 0.1274510 0.5000000 0.1274510), wk = 0.0035971 k( 229) = ( 0.1176471 0.5000000 0.1176471), wk = 0.0035971 k( 230) = ( 0.1078431 0.5000000 0.1078431), wk = 0.0035971 k( 231) = ( 0.0980392 0.5000000 0.0980392), wk = 0.0035971 k( 232) = ( 0.0882353 0.5000000 0.0882353), wk = 0.0035971 k( 233) = ( 0.0784314 0.5000000 0.0784314), wk = 0.0035971 k( 234) = ( 0.0686275 0.5000000 0.0686274), wk = 0.0035971 k( 235) = ( 0.0588235 0.5000000 0.0588235), wk = 0.0035971 k( 236) = ( 0.0490196 0.5000000 0.0490196), wk = 0.0035971 k( 237) = ( 0.0392157 0.5000000 0.0392157), wk = 0.0035971 k( 238) = ( 0.0294118 0.5000000 0.0294118), wk = 0.0035971 k( 239) = ( 0.0196078 0.5000000 0.0196078), wk = 0.0035971 k( 240) = ( 0.0098039 0.5000000 0.0098039), wk = 0.0035971 k( 241) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0035971 k( 242) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035971 k( 243) = ( 0.5000000 0.5000000 0.0138889), wk = 0.0035971 k( 244) = ( 0.5000000 0.5000000 0.0277778), wk = 0.0035971 k( 245) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0035971 k( 246) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0035971 k( 247) = ( 0.5000000 0.5000000 0.0694444), wk = 0.0035971 k( 248) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0035971 k( 249) = ( 0.5000000 0.5000000 0.0972222), wk = 0.0035971 k( 250) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0035971 k( 251) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0035971 k( 252) = ( 0.5000000 0.5000000 0.1388889), wk = 0.0035971 k( 253) = ( 0.5000000 0.5000000 0.1527778), wk = 0.0035971 k( 254) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0035971 k( 255) = ( 0.5000000 0.5000000 0.1805556), wk = 0.0035971 k( 256) = ( 0.5000000 0.5000000 0.1944444), wk = 0.0035971 k( 257) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0035971 k( 258) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0035971 k( 259) = ( 0.5000000 0.5000000 0.2361111), wk = 0.0035971 k( 260) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0035971 k( 261) = ( 0.5000000 0.5000000 0.2638889), wk = 0.0035971 k( 262) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0035971 k( 263) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0035971 k( 264) = ( 0.5000000 0.5000000 0.3055556), wk = 0.0035971 k( 265) = ( 0.5000000 0.5000000 0.3194444), wk = 0.0035971 k( 266) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0035971 k( 267) = ( 0.5000000 0.5000000 0.3472222), wk = 0.0035971 k( 268) = ( 0.5000000 0.5000000 0.3611111), wk = 0.0035971 k( 269) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0035971 k( 270) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0035971 k( 271) = ( 0.5000000 0.5000000 0.4027778), wk = 0.0035971 k( 272) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0035971 k( 273) = ( 0.5000000 0.5000000 0.4305556), wk = 0.0035971 k( 274) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0035971 k( 275) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0035971 k( 276) = ( 0.5000000 0.5000000 0.4722222), wk = 0.0035971 k( 277) = ( 0.5000000 0.5000000 0.4861111), wk = 0.0035971 k( 278) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035971 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035971 k( 2) = ( 0.0000000 0.0138889 0.0000000), wk = 0.0035971 k( 3) = ( 0.0000000 0.0277778 0.0000000), wk = 0.0035971 k( 4) = ( 0.0000000 0.0416667 0.0000000), wk = 0.0035971 k( 5) = ( 0.0000000 0.0555556 0.0000000), wk = 0.0035971 k( 6) = ( 0.0000000 0.0694444 0.0000000), wk = 0.0035971 k( 7) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0035971 k( 8) = ( 0.0000000 0.0972222 0.0000000), wk = 0.0035971 k( 9) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0035971 k( 10) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0035971 k( 11) = ( 0.0000000 0.1388889 0.0000000), wk = 0.0035971 k( 12) = ( 0.0000000 0.1527778 0.0000000), wk = 0.0035971 k( 13) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0035971 k( 14) = ( 0.0000000 0.1805556 0.0000000), wk = 0.0035971 k( 15) = ( 0.0000000 0.1944444 0.0000000), wk = 0.0035971 k( 16) = ( 0.0000000 0.2083333 0.0000000), wk = 0.0035971 k( 17) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0035971 k( 18) = ( 0.0000000 0.2361111 0.0000000), wk = 0.0035971 k( 19) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0035971 k( 20) = ( 0.0000000 0.2638889 0.0000000), wk = 0.0035971 k( 21) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0035971 k( 22) = ( 0.0000000 0.2916667 0.0000000), wk = 0.0035971 k( 23) = ( 0.0000000 0.3055556 0.0000000), wk = 0.0035971 k( 24) = ( 0.0000000 0.3194444 0.0000000), wk = 0.0035971 k( 25) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0035971 k( 26) = ( 0.0000000 0.3472222 0.0000000), wk = 0.0035971 k( 27) = ( 0.0000000 0.3611111 0.0000000), wk = 0.0035971 k( 28) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0035971 k( 29) = ( 0.0000000 0.3888889 0.0000000), wk = 0.0035971 k( 30) = ( 0.0000000 0.4027778 0.0000000), wk = 0.0035971 k( 31) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0035971 k( 32) = ( 0.0000000 0.4305556 0.0000000), wk = 0.0035971 k( 33) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0035971 k( 34) = ( 0.0000000 0.4583333 0.0000000), wk = 0.0035971 k( 35) = ( 0.0000000 0.4722222 0.0000000), wk = 0.0035971 k( 36) = ( 0.0000000 0.4861111 0.0000000), wk = 0.0035971 k( 37) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035971 k( 38) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035971 k( 39) = ( 0.0138889 0.5000000 0.0000000), wk = 0.0035971 k( 40) = ( 0.0277778 0.5000000 0.0000000), wk = 0.0035971 k( 41) = ( 0.0416667 0.5000000 0.0000000), wk = 0.0035971 k( 42) = ( 0.0555556 0.5000000 0.0000000), wk = 0.0035971 k( 43) = ( 0.0694444 0.5000000 0.0000000), wk = 0.0035971 k( 44) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0035971 k( 45) = ( 0.0972222 0.5000000 0.0000000), wk = 0.0035971 k( 46) = ( 0.1111111 0.5000000 0.0000000), wk = 0.0035971 k( 47) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0035971 k( 48) = ( 0.1388889 0.5000000 0.0000000), wk = 0.0035971 k( 49) = ( 0.1527778 0.5000000 0.0000000), wk = 0.0035971 k( 50) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0035971 k( 51) = ( 0.1805556 0.5000000 0.0000000), wk = 0.0035971 k( 52) = ( 0.1944444 0.5000000 0.0000000), wk = 0.0035971 k( 53) = ( 0.2083333 0.5000000 0.0000000), wk = 0.0035971 k( 54) = ( 0.2222222 0.5000000 0.0000000), wk = 0.0035971 k( 55) = ( 0.2361111 0.5000000 0.0000000), wk = 0.0035971 k( 56) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0035971 k( 57) = ( 0.2638889 0.5000000 0.0000000), wk = 0.0035971 k( 58) = ( 0.2777778 0.5000000 0.0000000), wk = 0.0035971 k( 59) = ( 0.2916667 0.5000000 0.0000000), wk = 0.0035971 k( 60) = ( 0.3055556 0.5000000 0.0000000), wk = 0.0035971 k( 61) = ( 0.3194444 0.5000000 0.0000000), wk = 0.0035971 k( 62) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0035971 k( 63) = ( 0.3472222 0.5000000 -0.0000000), wk = 0.0035971 k( 64) = ( 0.3611111 0.5000000 0.0000000), wk = 0.0035971 k( 65) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0035971 k( 66) = ( 0.3888889 0.5000000 0.0000000), wk = 0.0035971 k( 67) = ( 0.4027778 0.5000000 0.0000000), wk = 0.0035971 k( 68) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0035971 k( 69) = ( 0.4305556 0.5000000 0.0000000), wk = 0.0035971 k( 70) = ( 0.4444444 0.5000000 0.0000000), wk = 0.0035971 k( 71) = ( 0.4583333 0.5000000 0.0000000), wk = 0.0035971 k( 72) = ( 0.4722222 0.5000000 0.0000000), wk = 0.0035971 k( 73) = ( 0.4861111 0.5000000 0.0000000), wk = 0.0035971 k( 74) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035971 k( 75) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035971 k( 76) = ( 0.4901961 0.4901961 0.0000000), wk = 0.0035971 k( 77) = ( 0.4803922 0.4803922 0.0000000), wk = 0.0035971 k( 78) = ( 0.4705882 0.4705882 0.0000000), wk = 0.0035971 k( 79) = ( 0.4607843 0.4607843 0.0000000), wk = 0.0035971 k( 80) = ( 0.4509804 0.4509804 0.0000000), wk = 0.0035971 k( 81) = ( 0.4411765 0.4411765 0.0000000), wk = 0.0035971 k( 82) = ( 0.4313726 0.4313726 0.0000000), wk = 0.0035971 k( 83) = ( 0.4215686 0.4215686 0.0000000), wk = 0.0035971 k( 84) = ( 0.4117647 0.4117647 0.0000000), wk = 0.0035971 k( 85) = ( 0.4019608 0.4019608 0.0000000), wk = 0.0035971 k( 86) = ( 0.3921569 0.3921569 0.0000000), wk = 0.0035971 k( 87) = ( 0.3823529 0.3823529 0.0000000), wk = 0.0035971 k( 88) = ( 0.3725490 0.3725490 0.0000000), wk = 0.0035971 k( 89) = ( 0.3627451 0.3627451 0.0000000), wk = 0.0035971 k( 90) = ( 0.3529412 0.3529412 0.0000000), wk = 0.0035971 k( 91) = ( 0.3431373 0.3431373 0.0000000), wk = 0.0035971 k( 92) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035971 k( 93) = ( 0.3235294 0.3235294 0.0000000), wk = 0.0035971 k( 94) = ( 0.3137255 0.3137255 0.0000000), wk = 0.0035971 k( 95) = ( 0.3039216 0.3039216 0.0000000), wk = 0.0035971 k( 96) = ( 0.2941177 0.2941177 0.0000000), wk = 0.0035971 k( 97) = ( 0.2843137 0.2843137 0.0000000), wk = 0.0035971 k( 98) = ( 0.2745098 0.2745098 0.0000000), wk = 0.0035971 k( 99) = ( 0.2647059 0.2647059 0.0000000), wk = 0.0035971 k( 100) = ( 0.2549020 0.2549020 0.0000000), wk = 0.0035971 k( 101) = ( 0.2450980 0.2450980 0.0000000), wk = 0.0035971 k( 102) = ( 0.2352941 0.2352941 0.0000000), wk = 0.0035971 k( 103) = ( 0.2254902 0.2254902 0.0000000), wk = 0.0035971 k( 104) = ( 0.2156863 0.2156863 0.0000000), wk = 0.0035971 k( 105) = ( 0.2058823 0.2058823 0.0000000), wk = 0.0035971 k( 106) = ( 0.1960784 0.1960784 0.0000000), wk = 0.0035971 k( 107) = ( 0.1862745 0.1862745 0.0000000), wk = 0.0035971 k( 108) = ( 0.1764706 0.1764706 0.0000000), wk = 0.0035971 k( 109) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0035971 k( 110) = ( 0.1568627 0.1568627 0.0000000), wk = 0.0035971 k( 111) = ( 0.1470588 0.1470588 0.0000000), wk = 0.0035971 k( 112) = ( 0.1372549 0.1372549 0.0000000), wk = 0.0035971 k( 113) = ( 0.1274510 0.1274510 0.0000000), wk = 0.0035971 k( 114) = ( 0.1176471 0.1176471 0.0000000), wk = 0.0035971 k( 115) = ( 0.1078431 0.1078431 0.0000000), wk = 0.0035971 k( 116) = ( 0.0980392 0.0980392 0.0000000), wk = 0.0035971 k( 117) = ( 0.0882353 0.0882353 0.0000000), wk = 0.0035971 k( 118) = ( 0.0784314 0.0784314 0.0000000), wk = 0.0035971 k( 119) = ( 0.0686275 0.0686275 0.0000000), wk = 0.0035971 k( 120) = ( 0.0588235 0.0588235 0.0000000), wk = 0.0035971 k( 121) = ( 0.0490196 0.0490196 0.0000000), wk = 0.0035971 k( 122) = ( 0.0392157 0.0392157 0.0000000), wk = 0.0035971 k( 123) = ( 0.0294118 0.0294118 0.0000000), wk = 0.0035971 k( 124) = ( 0.0196078 0.0196078 0.0000000), wk = 0.0035971 k( 125) = ( 0.0098039 0.0098039 0.0000000), wk = 0.0035971 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035971 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035971 k( 128) = ( 0.0080645 0.0080645 0.0080645), wk = 0.0035971 k( 129) = ( 0.0161290 0.0161290 0.0161290), wk = 0.0035971 k( 130) = ( 0.0241936 0.0241936 0.0241936), wk = 0.0035971 k( 131) = ( 0.0322581 0.0322581 0.0322581), wk = 0.0035971 k( 132) = ( 0.0403226 0.0403226 0.0403226), wk = 0.0035971 k( 133) = ( 0.0483871 0.0483871 0.0483871), wk = 0.0035971 k( 134) = ( 0.0564516 0.0564516 0.0564516), wk = 0.0035971 k( 135) = ( 0.0645161 0.0645161 0.0645161), wk = 0.0035971 k( 136) = ( 0.0725806 0.0725806 0.0725806), wk = 0.0035971 k( 137) = ( 0.0806452 0.0806452 0.0806452), wk = 0.0035971 k( 138) = ( 0.0887097 0.0887097 0.0887097), wk = 0.0035971 k( 139) = ( 0.0967742 0.0967742 0.0967742), wk = 0.0035971 k( 140) = ( 0.1048387 0.1048387 0.1048387), wk = 0.0035971 k( 141) = ( 0.1129032 0.1129032 0.1129032), wk = 0.0035971 k( 142) = ( 0.1209677 0.1209677 0.1209677), wk = 0.0035971 k( 143) = ( 0.1290323 0.1290323 0.1290323), wk = 0.0035971 k( 144) = ( 0.1370968 0.1370968 0.1370968), wk = 0.0035971 k( 145) = ( 0.1451613 0.1451613 0.1451613), wk = 0.0035971 k( 146) = ( 0.1532258 0.1532258 0.1532258), wk = 0.0035971 k( 147) = ( 0.1612903 0.1612903 0.1612903), wk = 0.0035971 k( 148) = ( 0.1693548 0.1693548 0.1693548), wk = 0.0035971 k( 149) = ( 0.1774194 0.1774194 0.1774194), wk = 0.0035971 k( 150) = ( 0.1854839 0.1854839 0.1854839), wk = 0.0035971 k( 151) = ( 0.1935484 0.1935484 0.1935484), wk = 0.0035971 k( 152) = ( 0.2016129 0.2016129 0.2016129), wk = 0.0035971 k( 153) = ( 0.2096774 0.2096774 0.2096774), wk = 0.0035971 k( 154) = ( 0.2177419 0.2177419 0.2177419), wk = 0.0035971 k( 155) = ( 0.2258064 0.2258064 0.2258064), wk = 0.0035971 k( 156) = ( 0.2338710 0.2338710 0.2338710), wk = 0.0035971 k( 157) = ( 0.2419355 0.2419355 0.2419355), wk = 0.0035971 k( 158) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035971 k( 159) = ( 0.2580645 0.2580645 0.2580645), wk = 0.0035971 k( 160) = ( 0.2661290 0.2661290 0.2661290), wk = 0.0035971 k( 161) = ( 0.2741936 0.2741936 0.2741936), wk = 0.0035971 k( 162) = ( 0.2822581 0.2822581 0.2822581), wk = 0.0035971 k( 163) = ( 0.2903226 0.2903226 0.2903226), wk = 0.0035971 k( 164) = ( 0.2983871 0.2983871 0.2983871), wk = 0.0035971 k( 165) = ( 0.3064516 0.3064516 0.3064516), wk = 0.0035971 k( 166) = ( 0.3145161 0.3145161 0.3145161), wk = 0.0035971 k( 167) = ( 0.3225807 0.3225807 0.3225807), wk = 0.0035971 k( 168) = ( 0.3306452 0.3306452 0.3306452), wk = 0.0035971 k( 169) = ( 0.3387097 0.3387097 0.3387097), wk = 0.0035971 k( 170) = ( 0.3467742 0.3467742 0.3467742), wk = 0.0035971 k( 171) = ( 0.3548387 0.3548387 0.3548387), wk = 0.0035971 k( 172) = ( 0.3629032 0.3629032 0.3629032), wk = 0.0035971 k( 173) = ( 0.3709677 0.3709677 0.3709677), wk = 0.0035971 k( 174) = ( 0.3790323 0.3790323 0.3790323), wk = 0.0035971 k( 175) = ( 0.3870968 0.3870968 0.3870968), wk = 0.0035971 k( 176) = ( 0.3951613 0.3951613 0.3951613), wk = 0.0035971 k( 177) = ( 0.4032258 0.4032258 0.4032258), wk = 0.0035971 k( 178) = ( 0.4112903 0.4112903 0.4112903), wk = 0.0035971 k( 179) = ( 0.4193548 0.4193548 0.4193548), wk = 0.0035971 k( 180) = ( 0.4274193 0.4274193 0.4274193), wk = 0.0035971 k( 181) = ( 0.4354839 0.4354839 0.4354839), wk = 0.0035971 k( 182) = ( 0.4435484 0.4435484 0.4435484), wk = 0.0035971 k( 183) = ( 0.4516129 0.4516129 0.4516129), wk = 0.0035971 k( 184) = ( 0.4596774 0.4596774 0.4596774), wk = 0.0035971 k( 185) = ( 0.4677419 0.4677419 0.4677419), wk = 0.0035971 k( 186) = ( 0.4758064 0.4758064 0.4758064), wk = 0.0035971 k( 187) = ( 0.4838710 0.4838710 0.4838710), wk = 0.0035971 k( 188) = ( 0.4919355 0.4919355 0.4919355), wk = 0.0035971 k( 189) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035971 k( 190) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035971 k( 191) = ( 0.4901961 0.5000000 0.4901961), wk = 0.0035971 k( 192) = ( 0.4803922 0.5000000 0.4803922), wk = 0.0035971 k( 193) = ( 0.4705882 0.5000000 0.4705882), wk = 0.0035971 k( 194) = ( 0.4607843 0.5000000 0.4607843), wk = 0.0035971 k( 195) = ( 0.4509804 0.5000000 0.4509804), wk = 0.0035971 k( 196) = ( 0.4411765 0.5000000 0.4411765), wk = 0.0035971 k( 197) = ( 0.4313726 0.5000000 0.4313726), wk = 0.0035971 k( 198) = ( 0.4215686 0.5000000 0.4215686), wk = 0.0035971 k( 199) = ( 0.4117647 0.5000000 0.4117647), wk = 0.0035971 k( 200) = ( 0.4019608 0.5000000 0.4019608), wk = 0.0035971 k( 201) = ( 0.3921569 0.5000000 0.3921569), wk = 0.0035971 k( 202) = ( 0.3823529 0.5000000 0.3823529), wk = 0.0035971 k( 203) = ( 0.3725490 0.5000000 0.3725490), wk = 0.0035971 k( 204) = ( 0.3627451 0.5000000 0.3627451), wk = 0.0035971 k( 205) = ( 0.3529412 0.5000000 0.3529412), wk = 0.0035971 k( 206) = ( 0.3431373 0.5000000 0.3431373), wk = 0.0035971 k( 207) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0035971 k( 208) = ( 0.3235294 0.5000000 0.3235294), wk = 0.0035971 k( 209) = ( 0.3137255 0.5000000 0.3137255), wk = 0.0035971 k( 210) = ( 0.3039216 0.5000000 0.3039216), wk = 0.0035971 k( 211) = ( 0.2941177 0.5000000 0.2941177), wk = 0.0035971 k( 212) = ( 0.2843137 0.5000000 0.2843137), wk = 0.0035971 k( 213) = ( 0.2745098 0.5000000 0.2745098), wk = 0.0035971 k( 214) = ( 0.2647059 0.5000000 0.2647059), wk = 0.0035971 k( 215) = ( 0.2549020 0.5000000 0.2549020), wk = 0.0035971 k( 216) = ( 0.2450980 0.5000000 0.2450980), wk = 0.0035971 k( 217) = ( 0.2352941 0.5000000 0.2352941), wk = 0.0035971 k( 218) = ( 0.2254902 0.5000000 0.2254902), wk = 0.0035971 k( 219) = ( 0.2156863 0.5000000 0.2156863), wk = 0.0035971 k( 220) = ( 0.2058823 0.5000000 0.2058823), wk = 0.0035971 k( 221) = ( 0.1960784 0.5000000 0.1960784), wk = 0.0035971 k( 222) = ( 0.1862745 0.5000000 0.1862745), wk = 0.0035971 k( 223) = ( 0.1764706 0.5000000 0.1764706), wk = 0.0035971 k( 224) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0035971 k( 225) = ( 0.1568627 0.5000000 0.1568627), wk = 0.0035971 k( 226) = ( 0.1470588 0.5000000 0.1470588), wk = 0.0035971 k( 227) = ( 0.1372549 0.5000000 0.1372549), wk = 0.0035971 k( 228) = ( 0.1274510 0.5000000 0.1274510), wk = 0.0035971 k( 229) = ( 0.1176471 0.5000000 0.1176471), wk = 0.0035971 k( 230) = ( 0.1078431 0.5000000 0.1078431), wk = 0.0035971 k( 231) = ( 0.0980392 0.5000000 0.0980392), wk = 0.0035971 k( 232) = ( 0.0882353 0.5000000 0.0882353), wk = 0.0035971 k( 233) = ( 0.0784314 0.5000000 0.0784314), wk = 0.0035971 k( 234) = ( 0.0686275 0.5000000 0.0686275), wk = 0.0035971 k( 235) = ( 0.0588235 0.5000000 0.0588235), wk = 0.0035971 k( 236) = ( 0.0490196 0.5000000 0.0490196), wk = 0.0035971 k( 237) = ( 0.0392157 0.5000000 0.0392157), wk = 0.0035971 k( 238) = ( 0.0294118 0.5000000 0.0294118), wk = 0.0035971 k( 239) = ( 0.0196078 0.5000000 0.0196078), wk = 0.0035971 k( 240) = ( 0.0098039 0.5000000 0.0098039), wk = 0.0035971 k( 241) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035971 k( 242) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035971 k( 243) = ( 0.5000000 0.5000000 0.0138889), wk = 0.0035971 k( 244) = ( 0.5000000 0.5000000 0.0277778), wk = 0.0035971 k( 245) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0035971 k( 246) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0035971 k( 247) = ( 0.5000000 0.5000000 0.0694444), wk = 0.0035971 k( 248) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0035971 k( 249) = ( 0.5000000 0.5000000 0.0972222), wk = 0.0035971 k( 250) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0035971 k( 251) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0035971 k( 252) = ( 0.5000000 0.5000000 0.1388889), wk = 0.0035971 k( 253) = ( 0.5000000 0.5000000 0.1527778), wk = 0.0035971 k( 254) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0035971 k( 255) = ( 0.5000000 0.5000000 0.1805556), wk = 0.0035971 k( 256) = ( 0.5000000 0.5000000 0.1944444), wk = 0.0035971 k( 257) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0035971 k( 258) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0035971 k( 259) = ( 0.5000000 0.5000000 0.2361111), wk = 0.0035971 k( 260) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0035971 k( 261) = ( 0.5000000 0.5000000 0.2638889), wk = 0.0035971 k( 262) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0035971 k( 263) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0035971 k( 264) = ( 0.5000000 0.5000000 0.3055556), wk = 0.0035971 k( 265) = ( 0.5000000 0.5000000 0.3194444), wk = 0.0035971 k( 266) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0035971 k( 267) = ( 0.5000000 0.5000000 0.3472222), wk = 0.0035971 k( 268) = ( 0.5000000 0.5000000 0.3611111), wk = 0.0035971 k( 269) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0035971 k( 270) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0035971 k( 271) = ( 0.5000000 0.5000000 0.4027778), wk = 0.0035971 k( 272) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0035971 k( 273) = ( 0.5000000 0.5000000 0.4305556), wk = 0.0035971 k( 274) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0035971 k( 275) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0035971 k( 276) = ( 0.5000000 0.5000000 0.4722222), wk = 0.0035971 k( 277) = ( 0.5000000 0.5000000 0.4861111), wk = 0.0035971 k( 278) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035971 Dense grid: 56667 G-vectors FFT dimensions: ( 48, 48, 48) Smooth grid: 25173 G-vectors FFT dimensions: ( 40, 40, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.21 Mb ( 182, 76) NL pseudopotentials 0.23 Mb ( 91, 168) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.01 Mb ( 1576) G-vector shells 0.00 Mb ( 351) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.84 Mb ( 182, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.39 Mb ( 168, 2, 76) The potential is recalculated from file : ./GeO2.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.8 secs Computing kpt #: 2 total cpu time spent up to now is 2.7 secs Computing kpt #: 3 total cpu time spent up to now is 3.5 secs Computing kpt #: 4 total cpu time spent up to now is 4.3 secs Computing kpt #: 5 total cpu time spent up to now is 5.2 secs Computing kpt #: 6 total cpu time spent up to now is 6.0 secs Computing kpt #: 7 total cpu time spent up to now is 6.8 secs Computing kpt #: 8 total cpu time spent up to now is 7.7 secs Computing kpt #: 9 total cpu time spent up to now is 8.4 secs Computing kpt #: 10 total cpu time spent up to now is 9.2 secs Computing kpt #: 11 total cpu time spent up to now is 10.0 secs Computing kpt #: 12 total cpu time spent up to now is 10.7 secs Computing kpt #: 13 total cpu time spent up to now is 11.4 secs Computing kpt #: 14 total cpu time spent up to now is 12.2 secs Computing kpt #: 15 total cpu time spent up to now is 12.9 secs Computing kpt #: 16 total cpu time spent up to now is 13.7 secs Computing kpt #: 17 total cpu time spent up to now is 14.7 secs Computing kpt #: 18 total cpu time spent up to now is 15.5 secs Computing kpt #: 19 total cpu time spent up to now is 16.4 secs Computing kpt #: 20 total cpu time spent up to now is 17.3 secs Computing kpt #: 21 total cpu time spent up to now is 18.2 secs Computing kpt #: 22 total cpu time spent up to now is 19.0 secs Computing kpt #: 23 total cpu time spent up to now is 19.9 secs Computing kpt #: 24 total cpu time spent up to now is 20.8 secs Computing kpt #: 25 total cpu time spent up to now is 21.7 secs Computing kpt #: 26 total cpu time spent up to now is 22.5 secs Computing kpt #: 27 total cpu time spent up to now is 23.3 secs Computing kpt #: 28 total cpu time spent up to now is 24.2 secs Computing kpt #: 29 total cpu time spent up to now is 25.0 secs Computing kpt #: 30 total cpu time spent up to now is 25.8 secs Computing kpt #: 31 total cpu time spent up to now is 26.7 secs Computing kpt #: 32 total cpu time spent up to now is 27.5 secs Computing kpt #: 33 total cpu time spent up to now is 28.4 secs Computing kpt #: 34 total cpu time spent up to now is 29.2 secs Computing kpt #: 35 total cpu time spent up to now is 30.1 secs Computing kpt #: 36 total cpu time spent up to now is 30.9 secs Computing kpt #: 37 total cpu time spent up to now is 31.7 secs Computing kpt #: 38 total cpu time spent up to now is 32.5 secs Computing kpt #: 39 total cpu time spent up to now is 33.3 secs Computing kpt #: 40 total cpu time spent up to now is 34.1 secs Computing kpt #: 41 total cpu time spent up to now is 34.9 secs Computing kpt #: 42 total cpu time spent up to now is 35.7 secs Computing kpt #: 43 total cpu time spent up to now is 36.5 secs Computing kpt #: 44 total cpu time spent up to now is 37.3 secs Computing kpt #: 45 total cpu time spent up to now is 38.1 secs Computing kpt #: 46 total cpu time spent up to now is 38.9 secs Computing kpt #: 47 total cpu time spent up to now is 39.7 secs Computing kpt #: 48 total cpu time spent up to now is 40.5 secs Computing kpt #: 49 total cpu time spent up to now is 41.3 secs Computing kpt #: 50 total cpu time spent up to now is 42.1 secs Computing kpt #: 51 total cpu time spent up to now is 42.9 secs Computing kpt #: 52 total cpu time spent up to now is 43.7 secs Computing kpt #: 53 total cpu time spent up to now is 44.4 secs Computing kpt #: 54 total cpu time spent up to now is 45.2 secs Computing kpt #: 55 total cpu time spent up to now is 46.0 secs Computing kpt #: 56 total cpu time spent up to now is 46.7 secs Computing kpt #: 57 total cpu time spent up to now is 47.5 secs Computing kpt #: 58 total cpu time spent up to now is 48.2 secs Computing kpt #: 59 total cpu time spent up to now is 49.0 secs Computing kpt #: 60 total cpu time spent up to now is 49.7 secs Computing kpt #: 61 total cpu time spent up to now is 50.5 secs Computing kpt #: 62 total cpu time spent up to now is 51.2 secs Computing kpt #: 63 total cpu time spent up to now is 52.0 secs Computing kpt #: 64 total cpu time spent up to now is 52.8 secs Computing kpt #: 65 total cpu time spent up to now is 53.5 secs Computing kpt #: 66 total cpu time spent up to now is 54.3 secs Computing kpt #: 67 total cpu time spent up to now is 55.1 secs Computing kpt #: 68 total cpu time spent up to now is 55.9 secs Computing kpt #: 69 total cpu time spent up to now is 56.6 secs Computing kpt #: 70 total cpu time spent up to now is 57.4 secs Computing kpt #: 71 total cpu time spent up to now is 58.2 secs Computing kpt #: 72 total cpu time spent up to now is 59.1 secs Computing kpt #: 73 total cpu time spent up to now is 59.9 secs Computing kpt #: 74 total cpu time spent up to now is 60.7 secs Computing kpt #: 75 total cpu time spent up to now is 61.6 secs Computing kpt #: 76 total cpu time spent up to now is 62.4 secs Computing kpt #: 77 total cpu time spent up to now is 63.2 secs Computing kpt #: 78 total cpu time spent up to now is 64.0 secs Computing kpt #: 79 total cpu time spent up to now is 64.9 secs Computing kpt #: 80 total cpu time spent up to now is 65.8 secs Computing kpt #: 81 total cpu time spent up to now is 66.7 secs Computing kpt #: 82 total cpu time spent up to now is 67.6 secs Computing kpt #: 83 total cpu time spent up to now is 68.5 secs Computing kpt #: 84 total cpu time spent up to now is 69.4 secs Computing kpt #: 85 total cpu time spent up to now is 70.3 secs Computing kpt #: 86 total cpu time spent up to now is 71.2 secs Computing kpt #: 87 total cpu time spent up to now is 72.1 secs Computing kpt #: 88 total cpu time spent up to now is 73.0 secs Computing kpt #: 89 total cpu time spent up to now is 73.9 secs Computing kpt #: 90 total cpu time spent up to now is 74.7 secs Computing kpt #: 91 total cpu time spent up to now is 75.6 secs Computing kpt #: 92 total cpu time spent up to now is 76.5 secs Computing kpt #: 93 total cpu time spent up to now is 77.4 secs Computing kpt #: 94 total cpu time spent up to now is 78.3 secs Computing kpt #: 95 total cpu time spent up to now is 79.2 secs Computing kpt #: 96 total cpu time spent up to now is 80.0 secs Computing kpt #: 97 total cpu time spent up to now is 80.9 secs Computing kpt #: 98 total cpu time spent up to now is 81.8 secs Computing kpt #: 99 total cpu time spent up to now is 82.6 secs Computing kpt #: 100 total cpu time spent up to now is 83.4 secs Computing kpt #: 101 total cpu time spent up to now is 84.2 secs Computing kpt #: 102 total cpu time spent up to now is 85.0 secs Computing kpt #: 103 total cpu time spent up to now is 85.8 secs Computing kpt #: 104 total cpu time spent up to now is 86.6 secs Computing kpt #: 105 total cpu time spent up to now is 87.3 secs Computing kpt #: 106 total cpu time spent up to now is 88.1 secs Computing kpt #: 107 total cpu time spent up to now is 88.9 secs Computing kpt #: 108 total cpu time spent up to now is 89.7 secs Computing kpt #: 109 total cpu time spent up to now is 90.5 secs Computing kpt #: 110 total cpu time spent up to now is 91.3 secs Computing kpt #: 111 total cpu time spent up to now is 92.0 secs Computing kpt #: 112 total cpu time spent up to now is 92.8 secs Computing kpt #: 113 total cpu time spent up to now is 93.6 secs Computing kpt #: 114 total cpu time spent up to now is 94.3 secs Computing kpt #: 115 total cpu time spent up to now is 95.2 secs Computing kpt #: 116 total cpu time spent up to now is 96.0 secs Computing kpt #: 117 total cpu time spent up to now is 96.7 secs Computing kpt #: 118 total cpu time spent up to now is 97.6 secs Computing kpt #: 119 total cpu time spent up to now is 98.4 secs Computing kpt #: 120 total cpu time spent up to now is 99.2 secs Computing kpt #: 121 total cpu time spent up to now is 100.0 secs Computing kpt #: 122 total cpu time spent up to now is 100.9 secs Computing kpt #: 123 total cpu time spent up to now is 101.7 secs Computing kpt #: 124 total cpu time spent up to now is 102.6 secs Computing kpt #: 125 total cpu time spent up to now is 103.5 secs Computing kpt #: 126 total cpu time spent up to now is 104.3 secs Computing kpt #: 127 total cpu time spent up to now is 105.1 secs Computing kpt #: 128 total cpu time spent up to now is 105.9 secs Computing kpt #: 129 total cpu time spent up to now is 106.8 secs Computing kpt #: 130 total cpu time spent up to now is 107.6 secs Computing kpt #: 131 total cpu time spent up to now is 108.5 secs Computing kpt #: 132 total cpu time spent up to now is 109.3 secs Computing kpt #: 133 total cpu time spent up to now is 110.1 secs Computing kpt #: 134 total cpu time spent up to now is 111.0 secs Computing kpt #: 135 total cpu time spent up to now is 111.7 secs Computing kpt #: 136 total cpu time spent up to now is 112.5 secs Computing kpt #: 137 total cpu time spent up to now is 113.2 secs Computing kpt #: 138 total cpu time spent up to now is 114.0 secs Computing kpt #: 139 total cpu time spent up to now is 114.7 secs Computing kpt #: 140 total cpu time spent up to now is 115.5 secs Computing kpt #: 141 total cpu time spent up to now is 116.3 secs Computing kpt #: 142 total cpu time spent up to now is 117.0 secs Computing kpt #: 143 total cpu time spent up to now is 117.9 secs Computing kpt #: 144 total cpu time spent up to now is 118.8 secs Computing kpt #: 145 total cpu time spent up to now is 119.5 secs Computing kpt #: 146 total cpu time spent up to now is 120.2 secs Computing kpt #: 147 total cpu time spent up to now is 121.0 secs Computing kpt #: 148 total cpu time spent up to now is 121.7 secs Computing kpt #: 149 total cpu time spent up to now is 122.5 secs Computing kpt #: 150 total cpu time spent up to now is 123.2 secs Computing kpt #: 151 total cpu time spent up to now is 124.0 secs Computing kpt #: 152 total cpu time spent up to now is 124.7 secs Computing kpt #: 153 total cpu time spent up to now is 125.5 secs Computing kpt #: 154 total cpu time spent up to now is 126.3 secs Computing kpt #: 155 total cpu time spent up to now is 127.0 secs Computing kpt #: 156 total cpu time spent up to now is 127.8 secs Computing kpt #: 157 total cpu time spent up to now is 128.6 secs Computing kpt #: 158 total cpu time spent up to now is 129.3 secs Computing kpt #: 159 total cpu time spent up to now is 130.1 secs Computing kpt #: 160 total cpu time spent up to now is 130.9 secs Computing kpt #: 161 total cpu time spent up to now is 131.7 secs Computing kpt #: 162 total cpu time spent up to now is 132.4 secs Computing kpt #: 163 total cpu time spent up to now is 133.2 secs Computing kpt #: 164 total cpu time spent up to now is 134.0 secs Computing kpt #: 165 total cpu time spent up to now is 134.7 secs Computing kpt #: 166 total cpu time spent up to now is 135.5 secs Computing kpt #: 167 total cpu time spent up to now is 136.3 secs Computing kpt #: 168 total cpu time spent up to now is 137.1 secs Computing kpt #: 169 total cpu time spent up to now is 137.8 secs Computing kpt #: 170 total cpu time spent up to now is 138.6 secs Computing kpt #: 171 total cpu time spent up to now is 139.4 secs Computing kpt #: 172 total cpu time spent up to now is 140.2 secs Computing kpt #: 173 total cpu time spent up to now is 140.9 secs Computing kpt #: 174 total cpu time spent up to now is 141.7 secs Computing kpt #: 175 total cpu time spent up to now is 142.5 secs Computing kpt #: 176 total cpu time spent up to now is 143.2 secs Computing kpt #: 177 total cpu time spent up to now is 144.0 secs Computing kpt #: 178 total cpu time spent up to now is 144.8 secs Computing kpt #: 179 total cpu time spent up to now is 145.6 secs Computing kpt #: 180 total cpu time spent up to now is 146.4 secs Computing kpt #: 181 total cpu time spent up to now is 147.1 secs Computing kpt #: 182 total cpu time spent up to now is 147.9 secs Computing kpt #: 183 total cpu time spent up to now is 148.8 secs Computing kpt #: 184 total cpu time spent up to now is 149.7 secs Computing kpt #: 185 total cpu time spent up to now is 150.6 secs Computing kpt #: 186 total cpu time spent up to now is 151.5 secs Computing kpt #: 187 total cpu time spent up to now is 152.4 secs Computing kpt #: 188 total cpu time spent up to now is 153.3 secs Computing kpt #: 189 total cpu time spent up to now is 154.0 secs Computing kpt #: 190 total cpu time spent up to now is 154.8 secs Computing kpt #: 191 total cpu time spent up to now is 155.6 secs Computing kpt #: 192 total cpu time spent up to now is 156.5 secs Computing kpt #: 193 total cpu time spent up to now is 157.4 secs Computing kpt #: 194 total cpu time spent up to now is 158.2 secs Computing kpt #: 195 total cpu time spent up to now is 159.1 secs Computing kpt #: 196 total cpu time spent up to now is 159.8 secs Computing kpt #: 197 total cpu time spent up to now is 160.6 secs Computing kpt #: 198 total cpu time spent up to now is 161.4 secs Computing kpt #: 199 total cpu time spent up to now is 162.2 secs Computing kpt #: 200 total cpu time spent up to now is 163.0 secs Computing kpt #: 201 total cpu time spent up to now is 163.8 secs Computing kpt #: 202 total cpu time spent up to now is 164.6 secs Computing kpt #: 203 total cpu time spent up to now is 165.4 secs Computing kpt #: 204 total cpu time spent up to now is 166.1 secs Computing kpt #: 205 total cpu time spent up to now is 166.9 secs Computing kpt #: 206 total cpu time spent up to now is 167.7 secs Computing kpt #: 207 total cpu time spent up to now is 168.5 secs Computing kpt #: 208 total cpu time spent up to now is 169.2 secs Computing kpt #: 209 total cpu time spent up to now is 170.0 secs Computing kpt #: 210 total cpu time spent up to now is 170.8 secs Computing kpt #: 211 total cpu time spent up to now is 171.6 secs Computing kpt #: 212 total cpu time spent up to now is 172.4 secs Computing kpt #: 213 total cpu time spent up to now is 173.1 secs Computing kpt #: 214 total cpu time spent up to now is 173.9 secs Computing kpt #: 215 total cpu time spent up to now is 174.7 secs Computing kpt #: 216 total cpu time spent up to now is 175.5 secs Computing kpt #: 217 total cpu time spent up to now is 176.3 secs Computing kpt #: 218 total cpu time spent up to now is 177.0 secs Computing kpt #: 219 total cpu time spent up to now is 177.8 secs Computing kpt #: 220 total cpu time spent up to now is 178.6 secs Computing kpt #: 221 total cpu time spent up to now is 179.4 secs Computing kpt #: 222 total cpu time spent up to now is 180.2 secs Computing kpt #: 223 total cpu time spent up to now is 181.0 secs Computing kpt #: 224 total cpu time spent up to now is 181.7 secs Computing kpt #: 225 total cpu time spent up to now is 182.5 secs Computing kpt #: 226 total cpu time spent up to now is 183.3 secs Computing kpt #: 227 total cpu time spent up to now is 184.1 secs Computing kpt #: 228 total cpu time spent up to now is 184.9 secs Computing kpt #: 229 total cpu time spent up to now is 185.7 secs Computing kpt #: 230 total cpu time spent up to now is 186.5 secs Computing kpt #: 231 total cpu time spent up to now is 187.3 secs Computing kpt #: 232 total cpu time spent up to now is 188.1 secs Computing kpt #: 233 total cpu time spent up to now is 189.0 secs Computing kpt #: 234 total cpu time spent up to now is 189.8 secs Computing kpt #: 235 total cpu time spent up to now is 190.6 secs Computing kpt #: 236 total cpu time spent up to now is 191.4 secs Computing kpt #: 237 total cpu time spent up to now is 192.2 secs Computing kpt #: 238 total cpu time spent up to now is 193.1 secs Computing kpt #: 239 total cpu time spent up to now is 193.9 secs Computing kpt #: 240 total cpu time spent up to now is 194.7 secs Computing kpt #: 241 total cpu time spent up to now is 195.5 secs Computing kpt #: 242 total cpu time spent up to now is 196.3 secs Computing kpt #: 243 total cpu time spent up to now is 197.1 secs Computing kpt #: 244 total cpu time spent up to now is 197.9 secs Computing kpt #: 245 total cpu time spent up to now is 198.8 secs Computing kpt #: 246 total cpu time spent up to now is 199.6 secs Computing kpt #: 247 total cpu time spent up to now is 200.4 secs Computing kpt #: 248 total cpu time spent up to now is 201.3 secs Computing kpt #: 249 total cpu time spent up to now is 202.1 secs Computing kpt #: 250 total cpu time spent up to now is 202.9 secs Computing kpt #: 251 total cpu time spent up to now is 203.7 secs Computing kpt #: 252 total cpu time spent up to now is 204.5 secs Computing kpt #: 253 total cpu time spent up to now is 205.4 secs Computing kpt #: 254 total cpu time spent up to now is 206.3 secs Computing kpt #: 255 total cpu time spent up to now is 207.2 secs Computing kpt #: 256 total cpu time spent up to now is 208.1 secs Computing kpt #: 257 total cpu time spent up to now is 209.0 secs Computing kpt #: 258 total cpu time spent up to now is 209.9 secs Computing kpt #: 259 total cpu time spent up to now is 210.7 secs Computing kpt #: 260 total cpu time spent up to now is 211.6 secs Computing kpt #: 261 total cpu time spent up to now is 212.5 secs Computing kpt #: 262 total cpu time spent up to now is 213.4 secs Computing kpt #: 263 total cpu time spent up to now is 214.3 secs Computing kpt #: 264 total cpu time spent up to now is 215.1 secs Computing kpt #: 265 total cpu time spent up to now is 216.0 secs Computing kpt #: 266 total cpu time spent up to now is 216.9 secs Computing kpt #: 267 total cpu time spent up to now is 217.8 secs Computing kpt #: 268 total cpu time spent up to now is 218.6 secs Computing kpt #: 269 total cpu time spent up to now is 219.5 secs Computing kpt #: 270 total cpu time spent up to now is 220.4 secs Computing kpt #: 271 total cpu time spent up to now is 221.2 secs Computing kpt #: 272 total cpu time spent up to now is 222.1 secs Computing kpt #: 273 total cpu time spent up to now is 223.0 secs Computing kpt #: 274 total cpu time spent up to now is 223.9 secs Computing kpt #: 275 total cpu time spent up to now is 224.8 secs Computing kpt #: 276 total cpu time spent up to now is 225.7 secs Computing kpt #: 277 total cpu time spent up to now is 226.5 secs Computing kpt #: 278 total cpu time spent up to now is 227.2 secs ethr = 1.56E-08, avg # of iterations = 20.3 total cpu time spent up to now is 227.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3119 PWs) bands (ev): -10.6718 -10.6718 -6.8160 -6.8160 -6.8010 -6.8010 -6.8010 -6.8010 -5.6076 -5.6076 -5.6075 -5.6075 -5.6075 -5.6075 -4.4658 -4.4658 2.3805 2.3805 2.3845 2.3845 2.3845 2.3845 4.2741 4.2741 4.2741 4.2741 4.3084 4.3084 4.9803 4.9803 4.9803 4.9803 7.4228 7.4228 7.4431 7.4431 7.4431 7.4431 9.2921 9.2921 9.3954 9.3954 9.3954 9.3954 10.1239 10.1239 10.1239 10.1239 10.1274 10.1274 10.1710 10.1710 10.9063 10.9063 10.9063 10.9063 11.6181 11.6181 12.8481 12.8481 12.8736 12.8736 12.8736 12.8736 16.6788 16.6788 21.0492 21.0492 21.0650 21.0650 21.0650 21.0650 22.5932 22.5932 22.8258 22.8258 k = 0.0000 0.0139-0.0000 ( 3119 PWs) bands (ev): -10.6707 -10.6707 -6.8179 -6.8179 -6.8037 -6.8037 -6.8003 -6.8003 -5.6080 -5.6080 -5.6070 -5.6070 -5.6054 -5.6054 -4.4664 -4.4664 2.3783 2.3783 2.3821 2.3821 2.3863 2.3863 4.2743 4.2743 4.2760 4.2760 4.3096 4.3096 4.9787 4.9787 4.9857 4.9857 7.4240 7.4240 7.4430 7.4430 7.4459 7.4459 9.2893 9.2893 9.3916 9.3916 9.3928 9.3928 10.0706 10.0706 10.1277 10.1277 10.1303 10.1303 10.2257 10.2257 10.9021 10.9021 10.9063 10.9063 11.6181 11.6181 12.8468 12.8468 12.8716 12.8716 12.8732 12.8732 16.6836 16.6836 21.0454 21.0454 21.0603 21.0603 21.0633 21.0633 22.5955 22.5955 22.8266 22.8266 k = 0.0000 0.0278-0.0000 ( 3115 PWs) bands (ev): -10.6674 -10.6674 -6.8292 -6.8292 -6.8059 -6.8059 -6.7982 -6.7982 -5.6093 -5.6093 -5.6053 -5.6053 -5.5990 -5.5990 -4.4680 -4.4680 2.3678 2.3678 2.3770 2.3770 2.3939 2.3939 4.2751 4.2751 4.2816 4.2816 4.3135 4.3135 4.9742 4.9742 5.0017 5.0017 7.4261 7.4261 7.4429 7.4429 7.4555 7.4555 9.2810 9.2810 9.3803 9.3803 9.3853 9.3853 9.9989 9.9989 10.1383 10.1383 10.1426 10.1426 10.2983 10.2983 10.8895 10.8895 10.9064 10.9064 11.6182 11.6182 12.8426 12.8426 12.8663 12.8663 12.8720 12.8720 16.6979 16.6979 21.0297 21.0297 21.0506 21.0506 21.0583 21.0583 22.6021 22.6021 22.8291 22.8291 k = 0.0000 0.0417-0.0000 ( 3123 PWs) bands (ev): -10.6620 -10.6620 -6.8532 -6.8532 -6.8039 -6.8039 -6.7947 -6.7947 -5.6115 -5.6115 -5.6026 -5.6026 -5.5889 -5.5889 -4.4707 -4.4707 2.3497 2.3497 2.3690 2.3690 2.4071 2.4071 4.2758 4.2758 4.2895 4.2895 4.3219 4.3219 4.9667 4.9667 5.0281 5.0281 7.4273 7.4273 7.4426 7.4426 7.4733 7.4733 9.2674 9.2674 9.3622 9.3622 9.3740 9.3740 9.9268 9.9268 10.1549 10.1549 10.1624 10.1624 10.3719 10.3719 10.8682 10.8682 10.9065 10.9065 11.6185 11.6185 12.8335 12.8335 12.8594 12.8594 12.8703 12.8703 16.7214 16.7214 20.9987 20.9987 21.0398 21.0398 21.0504 21.0504 22.6121 22.6121 22.8331 22.8331 k = 0.0000 0.0556-0.0000 ( 3131 PWs) bands (ev): -10.6545 -10.6545 -6.8872 -6.8872 -6.7996 -6.7996 -6.7897 -6.7897 -5.6145 -5.6145 -5.5987 -5.5987 -5.5758 -5.5758 -4.4745 -4.4745 2.3249 2.3249 2.3579 2.3579 2.4257 2.4257 4.2763 4.2763 4.2983 4.2983 4.3365 4.3365 4.9566 4.9566 5.0641 5.0641 7.4274 7.4274 7.4423 7.4423 7.4991 7.4991 9.2488 9.2488 9.3380 9.3380 9.3602 9.3602 9.8553 9.8553 10.1766 10.1766 10.1885 10.1885 10.4455 10.4455 10.8380 10.8380 10.9066 10.9066 11.6192 11.6192 12.8182 12.8182 12.8526 12.8526 12.8682 12.8682 16.7538 16.7538 20.9554 20.9554 21.0258 21.0258 21.0399 21.0399 22.6245 22.6245 22.8385 22.8385 k = 0.0000 0.0694-0.0000 ( 3131 PWs) bands (ev): -10.6447 -10.6447 -6.9296 -6.9296 -6.7939 -6.7939 -6.7833 -6.7833 -5.6185 -5.6185 -5.5937 -5.5937 -5.5606 -5.5606 -4.4793 -4.4793 2.2942 2.2942 2.3439 2.3439 2.4498 2.4498 4.2762 4.2762 4.3076 4.3076 4.3578 4.3578 4.9440 4.9440 5.1091 5.1091 7.4262 7.4262 7.4415 7.4415 7.5324 7.5324 9.2251 9.2251 9.3089 9.3089 9.3459 9.3459 9.7850 9.7850 10.2024 10.2024 10.2196 10.2196 10.5187 10.5187 10.7986 10.7986 10.9068 10.9068 11.6206 11.6206 12.7973 12.7973 12.8456 12.8456 12.8659 12.8659 16.7945 16.7945 20.9024 20.9024 21.0082 21.0082 21.0268 21.0268 22.6381 22.6381 22.8450 22.8450 k = 0.0000 0.0833-0.0000 ( 3122 PWs) bands (ev): -10.6328 -10.6328 -6.9793 -6.9793 -6.7869 -6.7869 -6.7752 -6.7752 -5.6233 -5.6233 -5.5876 -5.5876 -5.5441 -5.5441 -4.4851 -4.4851 2.2585 2.2585 2.3269 2.3269 2.4793 2.4793 4.2757 4.2757 4.3180 4.3180 4.3851 4.3851 4.9292 4.9292 5.1620 5.1620 7.4238 7.4238 7.4401 7.4401 7.5725 7.5725 9.1961 9.1961 9.2762 9.2762 9.3328 9.3328 9.7160 9.7160 10.2311 10.2311 10.2545 10.2545 10.5913 10.5913 10.7498 10.7498 10.9069 10.9069 11.6226 11.6226 12.7720 12.7720 12.8377 12.8377 12.8635 12.8635 16.8431 16.8431 20.8413 20.8413 20.9870 20.9870 21.0110 21.0110 22.6523 22.6523 22.8524 22.8524 k = 0.0000 0.0972-0.0000 ( 3130 PWs) bands (ev): -10.6188 -10.6188 -7.0353 -7.0353 -6.7787 -6.7787 -6.7656 -6.7656 -5.6290 -5.6290 -5.5805 -5.5805 -5.5272 -5.5272 -4.4920 -4.4920 2.2186 2.2186 2.3070 2.3070 2.5143 2.5143 4.2750 4.2750 4.3297 4.3297 4.4178 4.4178 4.9127 4.9127 5.2221 5.2221 7.4200 7.4200 7.4374 7.4374 7.6190 7.6190 9.1608 9.1608 9.2422 9.2422 9.3222 9.3222 9.6488 9.6488 10.2618 10.2618 10.2920 10.2920 10.6630 10.6630 10.6918 10.6918 10.9069 10.9069 11.6252 11.6252 12.7434 12.7434 12.8284 12.8284 12.8610 12.8610 16.8987 16.8987 20.7737 20.7737 20.9623 20.9623 20.9921 20.9921 22.6665 22.6665 22.8603 22.8603 k = 0.0000 0.1111-0.0000 ( 3126 PWs) bands (ev): -10.6026 -10.6026 -7.0967 -7.0967 -6.7694 -6.7694 -6.7544 -6.7544 -5.6356 -5.6356 -5.5723 -5.5723 -5.5107 -5.5107 -4.4999 -4.4999 2.1753 2.1753 2.2844 2.2844 2.5549 2.5549 4.2743 4.2743 4.3431 4.3431 4.4552 4.4552 4.8946 4.8946 5.2882 5.2882 7.4149 7.4149 7.4329 7.4329 7.6715 7.6715 9.1184 9.1184 9.2093 9.2093 9.3154 9.3154 9.5836 9.5836 10.2933 10.2933 10.3313 10.3313 10.6244 10.6244 10.7339 10.7339 10.9069 10.9069 11.6280 11.6280 12.7123 12.7123 12.8175 12.8175 12.8585 12.8585 16.9608 16.9608 20.7010 20.7010 20.9344 20.9344 20.9702 20.9702 22.6804 22.6804 22.8685 22.8685 k = 0.0000 0.1250-0.0000 ( 3118 PWs) bands (ev): -10.5843 -10.5843 -7.1627 -7.1627 -6.7590 -6.7590 -6.7417 -6.7417 -5.6431 -5.6431 -5.5630 -5.5630 -5.4951 -5.4951 -4.5088 -4.5088 2.1293 2.1293 2.2592 2.2592 2.6010 2.6010 4.2738 4.2738 4.3581 4.3581 4.4969 4.4969 4.8755 4.8755 5.3594 5.3594 7.4084 7.4084 7.4261 7.4261 7.7294 7.7294 9.0681 9.0681 9.1792 9.1792 9.3130 9.3130 9.5208 9.5208 10.3248 10.3248 10.3717 10.3717 10.5485 10.5485 10.8035 10.8035 10.9068 10.9068 11.6307 11.6307 12.6797 12.6797 12.8051 12.8051 12.8558 12.8558 17.0287 17.0287 20.6245 20.6245 20.9035 20.9035 20.9449 20.9449 22.6938 22.6938 22.8765 22.8765 k = 0.0000 0.1389-0.0000 ( 3118 PWs) bands (ev): -10.5638 -10.5638 -7.2325 -7.2325 -6.7476 -6.7476 -6.7274 -6.7274 -5.6516 -5.6516 -5.5527 -5.5527 -5.4812 -5.4812 -4.5187 -4.5187 2.0815 2.0815 2.2316 2.2316 2.6528 2.6528 4.2736 4.2736 4.3748 4.3748 4.5425 4.5425 4.8555 4.8555 5.4348 5.4348 7.4004 7.4004 7.4166 7.4166 7.7922 7.7922 9.0107 9.0107 9.1527 9.1527 9.3156 9.3156 9.4608 9.4608 10.3553 10.3553 10.4115 10.4115 10.4655 10.4655 10.8710 10.8710 10.9071 10.9071 11.6325 11.6325 12.6466 12.6466 12.7911 12.7911 12.8528 12.8528 17.1016 17.1016 20.5454 20.5454 20.8698 20.8698 20.9162 20.9162 22.7063 22.7063 22.8843 22.8843 k = 0.0000 0.1528-0.0000 ( 3122 PWs) bands (ev): -10.5412 -10.5412 -7.3057 -7.3057 -6.7351 -6.7351 -6.7116 -6.7116 -5.6610 -5.6610 -5.5414 -5.5414 -5.4692 -5.4692 -4.5295 -4.5295 2.0325 2.0325 2.2018 2.2018 2.7101 2.7101 4.2740 4.2740 4.3931 4.3931 4.5915 4.5915 4.8352 4.8352 5.5134 5.5134 7.3906 7.3906 7.4042 7.4042 7.8596 7.8596 8.9467 8.9467 9.1302 9.1302 9.3234 9.3234 9.4038 9.4038 10.3662 10.3662 10.3890 10.3890 10.4557 10.4557 10.9036 10.9036 10.9407 10.9407 11.6327 11.6327 12.6136 12.6136 12.7755 12.7755 12.8497 12.8497 17.1790 17.1790 20.4647 20.4647 20.8337 20.8337 20.8839 20.8839 22.7179 22.7179 22.8917 22.8917 k = 0.0000 0.1667-0.0000 ( 3118 PWs) bands (ev): -10.5165 -10.5165 -7.3817 -7.3817 -6.7215 -6.7215 -6.6943 -6.6943 -5.6713 -5.6713 -5.5291 -5.5291 -5.4595 -5.4595 -4.5413 -4.5413 1.9830 1.9830 2.1699 2.1699 2.7731 2.7731 4.2751 4.2751 4.4129 4.4129 4.6433 4.6433 4.8150 4.8150 5.5942 5.5942 7.3791 7.3791 7.3887 7.3887 7.9309 7.9309 8.8771 8.8771 9.1118 9.1118 9.3366 9.3366 9.3502 9.3502 10.2708 10.2708 10.4134 10.4134 10.4959 10.4959 10.9030 10.9030 11.0053 11.0053 11.6306 11.6306 12.5819 12.5819 12.7582 12.7582 12.8462 12.8462 17.2602 17.2602 20.3831 20.3831 20.7952 20.7952 20.8481 20.8481 22.7283 22.7283 22.8987 22.8987 k = 0.0000 0.1806-0.0000 ( 3118 PWs) bands (ev): -10.4897 -10.4897 -7.4599 -7.4599 -6.7070 -6.7070 -6.6755 -6.6755 -5.6825 -5.6825 -5.5159 -5.5159 -5.4524 -5.4524 -4.5539 -4.5539 1.9334 1.9334 2.1362 2.1362 2.8416 2.8416 4.2770 4.2770 4.4343 4.4343 4.6967 4.6967 4.7961 4.7961 5.6764 5.6764 7.3655 7.3655 7.3705 7.3705 8.0059 8.0059 8.8022 8.8022 9.0978 9.0978 9.3006 9.3006 9.3549 9.3549 10.1659 10.1659 10.4381 10.4381 10.5361 10.5361 10.9011 10.9011 11.0690 11.0690 11.6254 11.6254 12.5522 12.5522 12.7392 12.7392 12.8425 12.8425 17.3446 17.3446 20.3015 20.3015 20.7546 20.7546 20.8086 20.8086 22.7370 22.7370 22.9052 22.9052 k = 0.0000 0.1944-0.0000 ( 3106 PWs) bands (ev): -10.4608 -10.4608 -7.5401 -7.5401 -6.6914 -6.6914 -6.6554 -6.6554 -5.6947 -5.6947 -5.5017 -5.5017 -5.4481 -5.4481 -4.5675 -4.5675 1.8843 1.8843 2.1010 2.1010 2.9157 2.9157 4.2797 4.2797 4.4571 4.4571 4.7433 4.7433 4.7864 4.7864 5.7592 5.7592 7.3468 7.3468 7.3528 7.3528 8.0841 8.0841 8.7224 8.7224 9.0885 9.0885 9.2554 9.2554 9.3781 9.3781 10.0555 10.0555 10.4600 10.4600 10.5756 10.5756 10.8984 10.8984 11.1310 11.1310 11.6164 11.6164 12.5254 12.5254 12.7186 12.7186 12.8385 12.8385 17.4318 17.4318 20.2207 20.2207 20.7120 20.7120 20.7655 20.7655 22.7436 22.7436 22.9111 22.9111 k = 0.0000 0.2083-0.0000 ( 3122 PWs) bands (ev): -10.4297 -10.4297 -7.6217 -7.6217 -6.6748 -6.6748 -6.6339 -6.6339 -5.7079 -5.7079 -5.4866 -5.4866 -5.4467 -5.4467 -4.5819 -4.5819 1.8361 1.8361 2.0644 2.0644 2.9951 2.9951 4.2832 4.2832 4.4813 4.4813 4.7448 4.7448 4.8242 4.8242 5.8417 5.8417 7.3226 7.3226 7.3362 7.3362 8.1650 8.1650 8.6378 8.6378 9.0841 9.0841 9.2149 9.2149 9.4057 9.4057 9.9405 9.9405 10.4785 10.4785 10.6141 10.6141 10.8946 10.8946 11.1911 11.1911 11.6029 11.6029 12.5023 12.5023 12.6962 12.6962 12.8341 12.8341 17.5212 17.5212 20.1412 20.1412 20.6675 20.6675 20.7188 20.7188 22.7476 22.7476 22.9158 22.9158 k = 0.0000 0.2222-0.0000 ( 3122 PWs) bands (ev): -10.3966 -10.3966 -7.7046 -7.7046 -6.6573 -6.6573 -6.6110 -6.6110 -5.7220 -5.7220 -5.4706 -5.4706 -5.4482 -5.4482 -4.5971 -4.5971 1.7892 1.7892 2.0267 2.0267 3.0798 3.0798 4.2877 4.2877 4.5068 4.5068 4.7282 4.7282 4.8822 4.8822 5.9231 5.9231 7.2956 7.2956 7.3189 7.3189 8.2483 8.2483 8.5488 8.5488 9.0849 9.0849 9.1797 9.1797 9.4370 9.4370 9.8219 9.8219 10.4932 10.4932 10.6514 10.6514 10.8896 10.8896 11.2493 11.2493 11.5847 11.5847 12.4832 12.4832 12.6722 12.6722 12.8295 12.8295 17.6124 17.6124 20.0636 20.0636 20.6214 20.6214 20.6688 20.6688 22.7486 22.7486 22.9165 22.9165 k = 0.0000 0.2361-0.0000 ( 3122 PWs) bands (ev): -10.3615 -10.3615 -7.7884 -7.7884 -6.6388 -6.6388 -6.5868 -6.5868 -5.7370 -5.7370 -5.4541 -5.4541 -5.4523 -5.4523 -4.6131 -4.6131 1.7438 1.7438 1.9881 1.9881 3.1697 3.1697 4.2930 4.2930 4.5333 4.5333 4.7105 4.7105 4.9430 4.9430 6.0026 6.0026 7.2664 7.2664 7.3008 7.3008 8.3334 8.3334 8.4552 8.4552 9.0909 9.0909 9.1504 9.1504 9.4715 9.4715 9.7005 9.7005 10.5039 10.5039 10.6875 10.6875 10.8830 10.8830 11.3054 11.3054 11.5617 11.5617 12.4687 12.4687 12.6466 12.6466 12.8244 12.8244 17.7049 17.7049 19.9886 19.9886 20.5736 20.5736 20.6156 20.6156 22.7463 22.7463 22.9105 22.9105 k = 0.0000 0.2500-0.0000 ( 3118 PWs) bands (ev): -10.3243 -10.3243 -7.8729 -7.8729 -6.6194 -6.6194 -6.5613 -6.5613 -5.7530 -5.7530 -5.4601 -5.4601 -5.4360 -5.4360 -4.6299 -4.6299 1.7004 1.7004 1.9490 1.9490 3.2645 3.2645 4.2992 4.2992 4.5605 4.5605 4.6937 4.6937 5.0048 5.0048 6.0796 6.0796 7.2354 7.2354 7.2823 7.2823 8.3569 8.3569 8.4203 8.4203 9.1020 9.1020 9.1275 9.1275 9.5083 9.5083 9.5774 9.5774 10.5102 10.5102 10.7221 10.7221 10.8744 10.8744 11.3594 11.3594 11.5341 11.5341 12.4587 12.4587 12.6193 12.6193 12.8190 12.8190 17.7986 17.7986 19.9167 19.9167 20.5243 20.5243 20.5593 20.5593 22.7410 22.7410 22.9037 22.9037 k = 0.0000 0.2639-0.0000 ( 3126 PWs) bands (ev): -10.2850 -10.2850 -7.9578 -7.9578 -6.5992 -6.5992 -6.5347 -6.5347 -5.7699 -5.7699 -5.4704 -5.4704 -5.4176 -5.4176 -4.6474 -4.6474 1.6591 1.6591 1.9095 1.9095 3.3639 3.3639 4.3062 4.3062 4.5876 4.5876 4.6787 4.6787 5.0666 5.0666 6.1531 6.1531 7.2032 7.2032 7.2641 7.2641 8.2544 8.2544 8.5079 8.5079 9.1097 9.1097 9.1199 9.1199 9.4525 9.4525 9.5473 9.5473 10.5119 10.5119 10.7554 10.7554 10.8634 10.8634 11.4111 11.4111 11.5027 11.5027 12.4531 12.4531 12.5905 12.5905 12.8132 12.8132 17.8928 17.8928 19.8482 19.8482 20.4735 20.4735 20.5004 20.5004 22.7333 22.7333 22.8990 22.8990 k = 0.0000 0.2778-0.0000 ( 3126 PWs) bands (ev): -10.2437 -10.2437 -8.0429 -8.0429 -6.5782 -6.5782 -6.5068 -6.5068 -5.7877 -5.7877 -5.4835 -5.4835 -5.3984 -5.3984 -4.6656 -4.6656 1.6201 1.6201 1.8700 1.8700 3.4679 3.4679 4.3140 4.3140 4.6114 4.6114 4.6689 4.6689 5.1278 5.1278 6.2228 6.2228 7.1700 7.1700 7.2468 7.2468 8.1473 8.1473 8.5964 8.5964 9.1013 9.1013 9.1408 9.1408 9.3280 9.3280 9.5866 9.5866 10.5089 10.5089 10.7871 10.7871 10.8495 10.8495 11.4588 11.4588 11.4702 11.4702 12.4515 12.4515 12.5602 12.5602 12.8070 12.8070 17.9875 17.9875 19.7838 19.7838 20.4213 20.4213 20.4392 20.4392 22.7244 22.7244 22.8968 22.8968 k = 0.0000 0.2917-0.0000 ( 3126 PWs) bands (ev): -10.2004 -10.2004 -8.1282 -8.1282 -6.5564 -6.5564 -6.4779 -6.4779 -5.8064 -5.8064 -5.4992 -5.4992 -5.3785 -5.3785 -4.6845 -4.6845 1.5837 1.5837 1.8306 1.8306 3.5759 3.5759 4.3224 4.3224 4.6215 4.6215 4.6745 4.6745 5.1877 5.1877 6.2879 6.2879 7.1365 7.1365 7.2311 7.2311 8.0357 8.0357 8.6851 8.6851 9.0995 9.0995 9.1674 9.1674 9.2040 9.2040 9.6261 9.6261 10.5010 10.5010 10.8172 10.8172 10.8319 10.8319 11.4312 11.4312 11.5087 11.5087 12.4534 12.4534 12.5286 12.5286 12.8003 12.8003 18.0823 18.0823 19.7239 19.7239 20.3674 20.3674 20.3764 20.3764 22.7156 22.7156 22.8967 22.8967 k = 0.0000 0.3056-0.0000 ( 3134 PWs) bands (ev): -10.1551 -10.1551 -8.2133 -8.2133 -6.5338 -6.5338 -6.4478 -6.4478 -5.8259 -5.8259 -5.5175 -5.5175 -5.3580 -5.3580 -4.7041 -4.7041 1.5500 1.5500 1.7916 1.7916 3.6877 3.6877 4.3315 4.3315 4.6154 4.6154 4.6979 4.6979 5.2458 5.2458 6.3482 6.3482 7.1028 7.1028 7.2178 7.2178 7.9196 7.9196 8.7735 8.7735 9.0774 9.0774 9.1091 9.1091 9.1989 9.1989 9.6647 9.6647 10.4880 10.4880 10.8099 10.8099 10.8458 10.8458 11.3943 11.3943 11.5538 11.5538 12.4585 12.4585 12.4957 12.4957 12.7933 12.7933 18.1770 18.1770 19.6687 19.6687 20.3094 20.3094 20.3147 20.3147 22.7077 22.7077 22.8983 22.8983 k = 0.0000 0.3194-0.0000 ( 3134 PWs) bands (ev): -10.1079 -10.1079 -8.2981 -8.2981 -6.5105 -6.5105 -6.4168 -6.4168 -5.8463 -5.8463 -5.5382 -5.5382 -5.3368 -5.3368 -4.7242 -4.7242 1.5191 1.5191 1.7533 1.7533 3.8027 3.8027 4.3410 4.3410 4.6044 4.6044 4.7278 4.7278 5.3014 5.3014 6.4031 6.4031 7.0694 7.0694 7.2079 7.2079 7.7991 7.7991 8.8611 8.8611 8.9577 8.9577 9.1216 9.1216 9.2350 9.2350 9.7018 9.7018 10.4701 10.4701 10.7827 10.7827 10.8728 10.8728 11.3580 11.3580 11.5968 11.5968 12.4618 12.4618 12.4661 12.4661 12.7857 12.7857 18.2713 18.2713 19.6187 19.6187 20.2447 20.2447 20.2575 20.2575 22.7018 22.7018 22.9013 22.9013 k = 0.0000 0.3333-0.0000 ( 3134 PWs) bands (ev): -10.0586 -10.0586 -8.3826 -8.3826 -6.4866 -6.4866 -6.3847 -6.3847 -5.8675 -5.8675 -5.5612 -5.5612 -5.3150 -5.3150 -4.7450 -4.7450 1.4912 1.4912 1.7158 1.7158 3.9206 3.9206 4.3510 4.3510 4.5925 4.5925 4.7598 4.7598 5.3542 5.3542 6.4528 6.4528 7.0366 7.0366 7.2021 7.2021 7.6745 7.6745 8.8382 8.8382 8.9474 8.9474 9.1444 9.1444 9.2755 9.2755 9.7365 9.7365 10.4471 10.4471 10.7500 10.7500 10.8983 10.8983 11.3235 11.3235 11.6378 11.6378 12.4270 12.4270 12.4757 12.4757 12.7778 12.7778 18.3650 18.3650 19.5741 19.5741 20.1784 20.1784 20.1997 20.1997 22.6984 22.6984 22.9054 22.9054 k = 0.0000 0.3472-0.0000 ( 3126 PWs) bands (ev): -10.0075 -10.0075 -8.4665 -8.4665 -6.4621 -6.4621 -6.3518 -6.3518 -5.8895 -5.8895 -5.5862 -5.5862 -5.2928 -5.2928 -4.7663 -4.7663 1.4664 1.4664 1.6795 1.6795 4.0405 4.0405 4.3613 4.3613 4.5809 4.5809 4.7925 4.7925 5.4036 5.4036 6.4970 6.4970 7.0047 7.0047 7.2014 7.2014 7.5460 7.5460 8.7212 8.7212 9.0311 9.0311 9.1760 9.1760 9.3201 9.3201 9.7681 9.7681 10.4191 10.4191 10.7111 10.7111 10.9222 10.9222 11.2916 11.2916 11.6766 11.6766 12.3915 12.3915 12.4870 12.4870 12.7693 12.7693 18.4579 18.4579 19.5353 19.5353 20.1120 20.1120 20.1408 20.1408 22.6979 22.6979 22.9105 22.9105 k = 0.0000 0.3611-0.0000 ( 3126 PWs) bands (ev): -9.9545 -9.9545 -8.5498 -8.5498 -6.4371 -6.4371 -6.3181 -6.3181 -5.9122 -5.9122 -5.6131 -5.6131 -5.2700 -5.2700 -4.7881 -4.7881 1.4446 1.4446 1.6444 1.6444 4.1616 4.1616 4.3719 4.3719 4.5697 4.5697 4.8255 4.8255 5.4498 5.4498 6.5361 6.5361 6.9739 6.9739 7.2061 7.2061 7.4144 7.4144 8.6069 8.6069 9.1110 9.1110 9.2171 9.2171 9.3687 9.3687 9.7959 9.7959 10.3862 10.3862 10.6661 10.6661 10.9447 10.9447 11.2630 11.2630 11.7136 11.7136 12.3556 12.3556 12.4996 12.4996 12.7604 12.7604 18.5499 18.5499 19.5025 19.5025 20.0460 20.0460 20.0805 20.0805 22.7005 22.7005 22.9162 22.9162 k = 0.0000 0.3750-0.0000 ( 3138 PWs) bands (ev): -9.8996 -9.8996 -8.6323 -8.6323 -6.4116 -6.4116 -6.2836 -6.2836 -5.9356 -5.9356 -5.6419 -5.6419 -5.2468 -5.2468 -4.8104 -4.8104 1.4261 1.4261 1.6108 1.6108 4.2829 4.2829 4.3826 4.3826 4.5591 4.5591 4.8583 4.8583 5.4927 5.4927 6.5703 6.5703 6.9443 6.9443 7.2141 7.2141 7.2831 7.2831 8.4957 8.4957 9.1850 9.1850 9.2685 9.2685 9.4209 9.4209 9.8191 9.8191 10.3486 10.3486 10.6152 10.6152 10.9657 10.9657 11.2378 11.2378 11.7487 11.7487 12.3195 12.3195 12.5131 12.5131 12.7510 12.7510 18.6409 18.6409 19.4758 19.4758 19.9809 19.9809 20.0188 20.0188 22.7063 22.7063 22.9226 22.9226 k = 0.0000 0.3889-0.0000 ( 3138 PWs) bands (ev): -9.8428 -9.8428 -8.7139 -8.7139 -6.3856 -6.3856 -6.2484 -6.2484 -5.9596 -5.9596 -5.6721 -5.6721 -5.2232 -5.2232 -4.8331 -4.8331 1.4107 1.4107 1.5789 1.5789 4.3921 4.3921 4.4039 4.4039 4.5494 4.5494 4.8903 4.8903 5.5333 5.5333 6.6001 6.6001 6.9161 6.9161 7.1358 7.1358 7.2429 7.2429 8.3876 8.3876 9.2525 9.2525 9.3301 9.3301 9.4764 9.4764 9.8371 9.8371 10.3064 10.3064 10.5591 10.5591 10.9853 10.9853 11.2158 11.2158 11.7821 11.7821 12.2834 12.2834 12.5272 12.5272 12.7411 12.7411 18.7306 18.7306 19.4554 19.4554 19.9173 19.9173 19.9557 19.9557 22.7153 22.7153 22.9292 22.9292 k = 0.0000 0.4028-0.0000 ( 3138 PWs) bands (ev): -9.7842 -9.7842 -8.7946 -8.7946 -6.3592 -6.3592 -6.2126 -6.2126 -5.9842 -5.9842 -5.7038 -5.7038 -5.1992 -5.1992 -4.8563 -4.8563 1.3986 1.3986 1.5488 1.5488 4.4038 4.4038 4.5144 4.5144 4.5454 4.5454 4.9212 4.9212 5.5729 5.5729 6.6261 6.6261 6.8888 6.8888 6.9990 6.9990 7.2674 7.2674 8.2827 8.2827 9.3157 9.3157 9.3981 9.3981 9.5351 9.5351 9.8493 9.8493 10.2600 10.2600 10.4983 10.4983 11.0036 11.0036 11.1967 11.1967 11.8142 11.8142 12.2477 12.2477 12.5418 12.5418 12.7307 12.7307 18.8190 18.8190 19.4414 19.4414 19.8556 19.8556 19.8912 19.8912 22.7276 22.7276 22.9358 22.9358 k = 0.0000 0.4167-0.0000 ( 3138 PWs) bands (ev): -9.7238 -9.7238 -8.8742 -8.8742 -6.3326 -6.3326 -6.1764 -6.1764 -6.0092 -6.0092 -5.7368 -5.7368 -5.1750 -5.1750 -4.8798 -4.8798 1.3897 1.3897 1.5208 1.5208 4.4144 4.4144 4.5272 4.5272 4.6351 4.6351 4.9502 4.9502 5.6135 5.6135 6.6487 6.6487 6.8461 6.8461 6.8766 6.8766 7.3012 7.3012 8.1813 8.1813 9.3779 9.3779 9.4681 9.4681 9.5965 9.5965 9.8550 9.8550 10.2097 10.2097 10.4337 10.4337 11.0207 11.0207 11.1800 11.1800 11.8450 11.8450 12.2125 12.2125 12.5567 12.5567 12.7199 12.7199 18.9060 18.9060 19.4339 19.4339 19.7964 19.7964 19.8253 19.8253 22.7428 22.7428 22.9415 22.9415 k = 0.0000 0.4306-0.0000 ( 3154 PWs) bands (ev): -9.6617 -9.6617 -8.9527 -8.9527 -6.3056 -6.3056 -6.1398 -6.1398 -6.0347 -6.0347 -5.7708 -5.7708 -5.1505 -5.1505 -4.9037 -4.9037 1.3841 1.3841 1.4949 1.4949 4.4249 4.4249 4.5187 4.5187 4.7378 4.7378 4.9766 4.9766 5.6584 5.6584 6.6683 6.6683 6.7144 6.7144 6.8447 6.8447 7.3427 7.3427 8.0833 8.0833 9.4405 9.4405 9.5373 9.5373 9.6605 9.6605 9.8538 9.8538 10.1559 10.1559 10.3662 10.3662 11.0366 11.0366 11.1651 11.1651 11.8748 11.8748 12.1780 12.1780 12.5717 12.5717 12.7085 12.7085 18.9915 18.9915 19.4327 19.4327 19.7398 19.7398 19.7582 19.7582 22.7607 22.7607 22.9447 22.9447 k = 0.0000 0.4444-0.0000 ( 3146 PWs) bands (ev): -9.5978 -9.5978 -9.0300 -9.0300 -6.2785 -6.2785 -6.1037 -6.1037 -6.0597 -6.0597 -5.8058 -5.8058 -5.1259 -5.1259 -4.9278 -4.9278 1.3817 1.3817 1.4714 1.4714 4.4352 4.4352 4.5099 4.5099 4.8289 4.8289 4.9995 4.9995 5.7112 5.7112 6.5744 6.5744 6.6870 6.6870 6.8226 6.8226 7.3916 7.3916 7.9888 7.9888 9.5033 9.5033 9.6046 9.6046 9.7268 9.7268 9.8453 9.8453 10.0992 10.0992 10.2964 10.2964 11.0515 11.0515 11.1516 11.1516 11.9040 11.9040 12.1444 12.1444 12.5867 12.5867 12.6967 12.6967 19.0755 19.0755 19.4380 19.4380 19.6840 19.6840 19.6922 19.6922 22.7811 22.7811 22.9429 22.9429 k = 0.0000 0.4583-0.0000 ( 3146 PWs) bands (ev): -9.5323 -9.5323 -9.1061 -9.1061 -6.2512 -6.2512 -6.0908 -6.0908 -6.0618 -6.0618 -5.8415 -5.8415 -5.1011 -5.1011 -4.9522 -4.9522 1.3825 1.3825 1.4504 1.4504 4.4452 4.4452 4.5010 4.5010 4.9045 4.9045 5.0175 5.0175 5.7757 5.7757 6.4370 6.4370 6.7035 6.7035 6.8026 6.8026 7.4473 7.4473 7.8981 7.8981 9.5654 9.5654 9.6695 9.6695 9.7949 9.7949 9.8291 9.8291 10.0401 10.0401 10.2252 10.2252 11.0655 11.0655 11.1390 11.1390 11.9328 11.9328 12.1118 12.1118 12.6015 12.6015 12.6843 12.6843 19.1578 19.1578 19.4494 19.4494 19.6167 19.6167 19.6401 19.6401 22.8034 22.8034 22.9340 22.9340 k = 0.0000 0.4722-0.0000 ( 3146 PWs) bands (ev): -9.4651 -9.4651 -9.1808 -9.1808 -6.2239 -6.2239 -6.1156 -6.1156 -6.0263 -6.0263 -5.8779 -5.8779 -5.0762 -5.0762 -4.9768 -4.9768 1.3864 1.3864 1.4320 1.4320 4.4550 4.4550 4.4920 4.4920 4.9621 4.9621 5.0290 5.0290 5.8547 5.8547 6.3034 6.3034 6.7193 6.7193 6.7841 6.7841 7.5093 7.5093 7.8113 7.8113 9.6251 9.6251 9.7322 9.7322 9.8049 9.8049 9.8647 9.8647 9.9795 9.9795 10.1529 10.1529 11.0787 11.0787 11.1270 11.1270 11.9614 11.9614 12.0801 12.0801 12.6162 12.6162 12.6715 12.6715 19.2384 19.2384 19.4666 19.4666 19.5452 19.5452 19.5953 19.5953 22.8271 22.8271 22.9187 22.9187 k = 0.0000 0.4861-0.0000 ( 3170 PWs) bands (ev): -9.3963 -9.3963 -9.2541 -9.2541 -6.1966 -6.1966 -6.1423 -6.1423 -5.9891 -5.9891 -5.9147 -5.9147 -5.0513 -5.0513 -5.0015 -5.0015 1.3934 1.3934 1.4162 1.4162 4.4645 4.4645 4.4830 4.4830 5.0013 5.0013 5.0319 5.0319 5.9487 5.9487 6.1757 6.1757 6.7348 6.7348 6.7668 6.7668 7.5772 7.5772 7.7286 7.7286 9.6805 9.6805 9.7691 9.7691 9.7967 9.7967 9.9178 9.9178 9.9360 9.9360 10.0803 10.0803 11.0912 11.0912 11.1151 11.1151 11.9902 11.9902 12.0493 12.0493 12.6305 12.6305 12.6582 12.6582 19.3172 19.3172 19.4676 19.4676 19.4939 19.4939 19.5554 19.5554 22.8515 22.8515 22.8986 22.8986 k = 0.0000 0.5000-0.0000 ( 3178 PWs) bands (ev): -9.3259 -9.3259 -9.3259 -9.3259 -6.1693 -6.1693 -6.1693 -6.1693 -5.9518 -5.9518 -5.9518 -5.9518 -5.0264 -5.0264 -5.0264 -5.0264 1.4033 1.4033 1.4033 1.4033 4.4739 4.4739 4.4739 4.4739 5.0237 5.0237 5.0237 5.0237 6.0566 6.0566 6.0566 6.0566 6.7505 6.7505 6.7505 6.7505 7.6505 7.6505 7.6505 7.6505 9.7294 9.7294 9.7294 9.7294 9.8565 9.8565 9.8565 9.8565 10.0078 10.0078 10.0078 10.0078 11.1033 11.1033 11.1033 11.1033 12.0194 12.0194 12.0194 12.0194 12.6445 12.6445 12.6445 12.6445 19.3943 19.3943 19.3943 19.3943 19.5209 19.5209 19.5209 19.5209 22.8758 22.8758 22.8758 22.8758 k = 0.0000 0.5000-0.0000 ( 3178 PWs) bands (ev): -9.3259 -9.3259 -9.3259 -9.3259 -6.1693 -6.1693 -6.1693 -6.1693 -5.9518 -5.9518 -5.9518 -5.9518 -5.0264 -5.0264 -5.0264 -5.0264 1.4033 1.4033 1.4033 1.4033 4.4739 4.4739 4.4739 4.4739 5.0237 5.0237 5.0237 5.0237 6.0566 6.0566 6.0566 6.0566 6.7505 6.7505 6.7505 6.7505 7.6505 7.6505 7.6505 7.6505 9.7294 9.7294 9.7294 9.7294 9.8565 9.8565 9.8565 9.8565 10.0078 10.0078 10.0078 10.0078 11.1033 11.1033 11.1033 11.1033 12.0194 12.0194 12.0194 12.0194 12.6445 12.6445 12.6445 12.6445 19.3943 19.3943 19.3943 19.3943 19.5209 19.5209 19.5209 19.5209 22.8758 22.8758 22.8758 22.8758 k = 0.0139 0.5000-0.0000 ( 3174 PWs) bands (ev): -9.3249 -9.3249 -9.3249 -9.3249 -6.1720 -6.1720 -6.1720 -6.1720 -5.9513 -5.9513 -5.9513 -5.9513 -5.0265 -5.0265 -5.0265 -5.0265 1.4061 1.4061 1.4061 1.4061 4.4731 4.4731 4.4731 4.4731 5.0185 5.0185 5.0185 5.0185 6.0591 6.0591 6.0591 6.0591 6.7543 6.7543 6.7543 6.7543 7.6531 7.6531 7.6531 7.6531 9.7253 9.7253 9.7253 9.7253 9.8594 9.8594 9.8594 9.8594 10.0083 10.0083 10.0083 10.0083 11.0995 11.0995 11.0995 11.0995 12.0193 12.0193 12.0193 12.0193 12.6443 12.6443 12.6443 12.6443 19.3949 19.3949 19.3949 19.3949 19.5216 19.5216 19.5216 19.5216 22.8758 22.8758 22.8758 22.8758 k = 0.0278 0.5000-0.0000 ( 3158 PWs) bands (ev): -9.3219 -9.3219 -9.3219 -9.3219 -6.1799 -6.1799 -6.1799 -6.1799 -5.9498 -5.9498 -5.9498 -5.9498 -5.0269 -5.0269 -5.0269 -5.0269 1.4143 1.4143 1.4143 1.4143 4.4707 4.4707 4.4707 4.4707 5.0033 5.0033 5.0033 5.0033 6.0664 6.0664 6.0664 6.0664 6.7657 6.7657 6.7657 6.7657 7.6608 7.6608 7.6608 7.6608 9.7139 9.7139 9.7139 9.7139 9.8672 9.8672 9.8672 9.8672 10.0096 10.0096 10.0096 10.0096 11.0884 11.0884 11.0884 11.0884 12.0190 12.0190 12.0190 12.0190 12.6435 12.6435 12.6435 12.6435 19.3969 19.3969 19.3969 19.3969 19.5238 19.5238 19.5238 19.5238 22.8759 22.8759 22.8759 22.8759 k = 0.0417 0.5000-0.0000 ( 3146 PWs) bands (ev): -9.3168 -9.3168 -9.3168 -9.3168 -6.1929 -6.1929 -6.1929 -6.1929 -5.9472 -5.9472 -5.9472 -5.9472 -5.0277 -5.0277 -5.0277 -5.0277 1.4280 1.4280 1.4280 1.4280 4.4669 4.4669 4.4669 4.4669 4.9785 4.9785 4.9785 4.9785 6.0781 6.0781 6.0781 6.0781 6.7845 6.7845 6.7845 6.7845 7.6734 7.6734 7.6734 7.6734 9.6972 9.6972 9.6972 9.6972 9.8779 9.8779 9.8779 9.8779 10.0117 10.0117 10.0117 10.0117 11.0699 11.0699 11.0699 11.0699 12.0185 12.0185 12.0185 12.0185 12.6422 12.6422 12.6422 12.6422 19.4000 19.4000 19.4000 19.4000 19.5275 19.5275 19.5275 19.5275 22.8759 22.8759 22.8759 22.8759 k = 0.0556 0.5000-0.0000 ( 3152 PWs) bands (ev): -9.3097 -9.3097 -9.3097 -9.3097 -6.2111 -6.2111 -6.2111 -6.2111 -5.9437 -5.9437 -5.9437 -5.9437 -5.0288 -5.0288 -5.0288 -5.0288 1.4468 1.4468 1.4468 1.4468 4.4621 4.4621 4.4621 4.4621 4.9452 4.9452 4.9452 4.9452 6.0935 6.0935 6.0935 6.0935 6.8103 6.8103 6.8103 6.8103 7.6908 7.6908 7.6908 7.6908 9.6767 9.6767 9.6767 9.6767 9.8900 9.8900 9.8900 9.8900 10.0144 10.0144 10.0144 10.0144 11.0445 11.0445 11.0445 11.0445 12.0177 12.0177 12.0177 12.0177 12.6402 12.6402 12.6402 12.6402 19.4041 19.4041 19.4041 19.4041 19.5325 19.5325 19.5325 19.5325 22.8756 22.8756 22.8756 22.8756 k = 0.0694 0.5000-0.0000 ( 3146 PWs) bands (ev): -9.3006 -9.3006 -9.3006 -9.3006 -6.2341 -6.2341 -6.2341 -6.2341 -5.9391 -5.9391 -5.9391 -5.9391 -5.0303 -5.0303 -5.0303 -5.0303 1.4707 1.4707 1.4707 1.4707 4.4567 4.4567 4.4567 4.4567 4.9042 4.9042 4.9042 4.9042 6.1118 6.1118 6.1118 6.1118 6.8428 6.8428 6.8428 6.8428 7.7127 7.7127 7.7127 7.7127 9.6536 9.6536 9.6536 9.6536 9.9027 9.9027 9.9027 9.9027 10.0173 10.0173 10.0173 10.0173 11.0126 11.0126 11.0126 11.0126 12.0167 12.0167 12.0167 12.0167 12.6375 12.6375 12.6375 12.6375 19.4092 19.4092 19.4092 19.4092 19.5388 19.5388 19.5388 19.5388 22.8747 22.8747 22.8747 22.8747 k = 0.0833 0.5000-0.0000 ( 3150 PWs) bands (ev): -9.2894 -9.2894 -9.2894 -9.2894 -6.2619 -6.2619 -6.2619 -6.2619 -5.9336 -5.9336 -5.9336 -5.9336 -5.0323 -5.0323 -5.0323 -5.0323 1.4994 1.4994 1.4994 1.4994 4.4510 4.4510 4.4510 4.4510 4.8567 4.8567 4.8567 4.8567 6.1323 6.1323 6.1323 6.1323 6.8814 6.8814 6.8814 6.8814 7.7387 7.7387 7.7387 7.7387 9.6283 9.6283 9.6283 9.6283 9.9152 9.9152 9.9152 9.9152 10.0203 10.0203 10.0203 10.0203 10.9749 10.9749 10.9749 10.9749 12.0154 12.0154 12.0154 12.0154 12.6339 12.6339 12.6339 12.6339 19.4150 19.4150 19.4150 19.4150 19.5463 19.5463 19.5463 19.5463 22.8728 22.8728 22.8728 22.8728 k = 0.0972 0.5000-0.0000 ( 3150 PWs) bands (ev): -9.2762 -9.2762 -9.2762 -9.2762 -6.2942 -6.2942 -6.2942 -6.2942 -5.9270 -5.9270 -5.9270 -5.9270 -5.0349 -5.0349 -5.0349 -5.0349 1.5326 1.5326 1.5326 1.5326 4.4458 4.4458 4.4458 4.4458 4.8036 4.8036 4.8036 4.8036 6.1542 6.1542 6.1542 6.1542 6.9256 6.9256 6.9256 6.9256 7.7683 7.7683 7.7683 7.7683 9.6015 9.6015 9.6015 9.6015 9.9275 9.9275 9.9275 9.9275 10.0226 10.0226 10.0226 10.0226 10.9323 10.9323 10.9323 10.9323 12.0140 12.0140 12.0140 12.0140 12.6295 12.6295 12.6295 12.6295 19.4214 19.4214 19.4214 19.4214 19.5549 19.5549 19.5549 19.5549 22.8696 22.8696 22.8696 22.8696 k = 0.1111 0.5000-0.0000 ( 3142 PWs) bands (ev): -9.2611 -9.2611 -9.2611 -9.2611 -6.3307 -6.3307 -6.3307 -6.3307 -5.9195 -5.9195 -5.9195 -5.9195 -5.0379 -5.0379 -5.0379 -5.0379 1.5699 1.5699 1.5699 1.5699 4.4415 4.4415 4.4415 4.4415 4.7460 4.7460 4.7460 4.7460 6.1772 6.1772 6.1772 6.1772 6.9749 6.9749 6.9749 6.9749 7.8012 7.8012 7.8012 7.8012 9.5733 9.5733 9.5733 9.5733 9.9394 9.9394 9.9394 9.9394 10.0236 10.0236 10.0236 10.0236 10.8857 10.8857 10.8857 10.8857 12.0123 12.0123 12.0123 12.0123 12.6240 12.6240 12.6240 12.6240 19.4281 19.4281 19.4281 19.4281 19.5645 19.5645 19.5645 19.5645 22.8649 22.8649 22.8649 22.8649 k = 0.1250 0.5000-0.0000 ( 3138 PWs) bands (ev): -9.2439 -9.2439 -9.2439 -9.2439 -6.3712 -6.3712 -6.3712 -6.3712 -5.9110 -5.9110 -5.9110 -5.9110 -5.0417 -5.0417 -5.0417 -5.0417 1.6110 1.6110 1.6110 1.6110 4.4387 4.4387 4.4387 4.4387 4.6847 4.6847 4.6847 4.6847 6.2006 6.2006 6.2006 6.2006 7.0285 7.0285 7.0285 7.0285 7.8368 7.8368 7.8368 7.8368 9.5441 9.5441 9.5441 9.5441 9.9507 9.9507 9.9507 9.9507 10.0224 10.0224 10.0224 10.0224 10.8364 10.8364 10.8364 10.8364 12.0105 12.0105 12.0105 12.0105 12.6174 12.6174 12.6174 12.6174 19.4349 19.4349 19.4349 19.4349 19.5749 19.5749 19.5749 19.5749 22.8588 22.8588 22.8588 22.8588 k = 0.1389 0.5000-0.0000 ( 3130 PWs) bands (ev): -9.2247 -9.2247 -9.2247 -9.2247 -6.4154 -6.4154 -6.4154 -6.4154 -5.9016 -5.9016 -5.9016 -5.9016 -5.0461 -5.0461 -5.0461 -5.0461 1.6553 1.6553 1.6553 1.6553 4.4380 4.4380 4.4380 4.4380 4.6205 4.6205 4.6205 4.6205 6.2242 6.2242 6.2242 6.2242 7.0858 7.0858 7.0858 7.0858 7.8747 7.8747 7.8747 7.8747 9.5140 9.5140 9.5140 9.5140 9.9615 9.9615 9.9615 9.9615 10.0178 10.0178 10.0178 10.0178 10.7861 10.7861 10.7861 10.7861 12.0085 12.0085 12.0085 12.0085 12.6095 12.6095 12.6095 12.6095 19.4416 19.4416 19.4416 19.4416 19.5860 19.5860 19.5860 19.5860 22.8517 22.8517 22.8517 22.8517 k = 0.1528 0.5000-0.0000 ( 3130 PWs) bands (ev): -9.2036 -9.2036 -9.2036 -9.2036 -6.4630 -6.4630 -6.4630 -6.4630 -5.8913 -5.8913 -5.8913 -5.8913 -5.0513 -5.0513 -5.0513 -5.0513 1.7025 1.7025 1.7025 1.7025 4.4395 4.4395 4.4395 4.4395 4.5544 4.5544 4.5544 4.5544 6.2478 6.2478 6.2478 6.2478 7.1461 7.1461 7.1461 7.1461 7.9144 7.9144 7.9144 7.9144 9.4832 9.4832 9.4832 9.4832 9.9714 9.9714 9.9714 9.9714 10.0084 10.0084 10.0084 10.0084 10.7367 10.7367 10.7367 10.7367 12.0062 12.0062 12.0062 12.0062 12.6004 12.6004 12.6004 12.6004 19.4480 19.4480 19.4480 19.4480 19.5976 19.5976 19.5976 19.5976 22.8440 22.8440 22.8440 22.8440 k = 0.1667 0.5000-0.0000 ( 3126 PWs) bands (ev): -9.1805 -9.1805 -9.1805 -9.1805 -6.5138 -6.5138 -6.5138 -6.5138 -5.8800 -5.8800 -5.8800 -5.8800 -5.0572 -5.0572 -5.0572 -5.0572 1.7521 1.7521 1.7521 1.7521 4.4407 4.4407 4.4407 4.4407 4.4901 4.4901 4.4901 4.4901 6.2710 6.2710 6.2710 6.2710 7.2087 7.2087 7.2087 7.2087 7.9552 7.9552 7.9552 7.9552 9.4521 9.4521 9.4521 9.4521 9.9774 9.9774 9.9774 9.9774 9.9957 9.9957 9.9957 9.9957 10.6904 10.6904 10.6904 10.6904 12.0039 12.0039 12.0039 12.0039 12.5898 12.5898 12.5898 12.5898 19.4540 19.4540 19.4540 19.4540 19.6095 19.6095 19.6095 19.6095 22.8365 22.8365 22.8365 22.8365 k = 0.1806 0.5000-0.0000 ( 3134 PWs) bands (ev): -9.1554 -9.1554 -9.1554 -9.1554 -6.5675 -6.5675 -6.5675 -6.5675 -5.8679 -5.8679 -5.8679 -5.8679 -5.0640 -5.0640 -5.0640 -5.0640 1.8036 1.8036 1.8036 1.8036 4.4060 4.4060 4.4060 4.4060 4.4643 4.4643 4.4643 4.4643 6.2939 6.2939 6.2939 6.2939 7.2731 7.2731 7.2731 7.2731 7.9969 7.9969 7.9969 7.9969 9.4207 9.4207 9.4207 9.4207 9.9605 9.9605 9.9605 9.9605 9.9967 9.9967 9.9967 9.9967 10.6496 10.6496 10.6496 10.6496 12.0014 12.0014 12.0014 12.0014 12.5778 12.5778 12.5778 12.5778 19.4593 19.4593 19.4593 19.4593 19.6216 19.6216 19.6216 19.6216 22.8295 22.8295 22.8295 22.8295 k = 0.1944 0.5000-0.0000 ( 3134 PWs) bands (ev): -9.1284 -9.1284 -9.1284 -9.1284 -6.6238 -6.6238 -6.6238 -6.6238 -5.8549 -5.8549 -5.8549 -5.8549 -5.0716 -5.0716 -5.0716 -5.0716 1.8564 1.8564 1.8564 1.8564 4.3382 4.3382 4.3382 4.3382 4.4751 4.4751 4.4751 4.4751 6.3161 6.3161 6.3161 6.3161 7.3383 7.3383 7.3383 7.3383 8.0389 8.0389 8.0389 8.0389 9.3894 9.3894 9.3894 9.3894 9.9251 9.9251 9.9251 9.9251 10.0057 10.0057 10.0057 10.0057 10.6162 10.6162 10.6162 10.6162 11.9988 11.9988 11.9988 11.9988 12.5643 12.5643 12.5643 12.5643 19.4641 19.4641 19.4641 19.4641 19.6335 19.6335 19.6335 19.6335 22.8237 22.8237 22.8237 22.8237 k = 0.2083 0.5000-0.0000 ( 3136 PWs) bands (ev): -9.0994 -9.0994 -9.0994 -9.0994 -6.6824 -6.6824 -6.6824 -6.6824 -5.8411 -5.8411 -5.8411 -5.8411 -5.0800 -5.0800 -5.0800 -5.0800 1.9102 1.9102 1.9102 1.9102 4.2670 4.2670 4.2670 4.2670 4.4937 4.4937 4.4937 4.4937 6.3376 6.3376 6.3376 6.3376 7.4039 7.4039 7.4039 7.4039 8.0808 8.0808 8.0808 8.0808 9.3584 9.3584 9.3584 9.3584 9.8775 9.8775 9.8775 9.8775 10.0158 10.0158 10.0158 10.0158 10.5913 10.5913 10.5913 10.5913 11.9961 11.9961 11.9961 11.9961 12.5492 12.5492 12.5492 12.5492 19.4681 19.4681 19.4681 19.4681 19.6452 19.6452 19.6452 19.6452 22.8193 22.8193 22.8193 22.8193 k = 0.2222 0.5000-0.0000 ( 3128 PWs) bands (ev): -9.0686 -9.0686 -9.0686 -9.0686 -6.7431 -6.7431 -6.7431 -6.7431 -5.8264 -5.8264 -5.8264 -5.8264 -5.0893 -5.0893 -5.0893 -5.0893 1.9644 1.9644 1.9644 1.9644 4.1949 4.1949 4.1949 4.1949 4.5182 4.5182 4.5182 4.5182 6.3582 6.3582 6.3582 6.3582 7.4690 7.4690 7.4690 7.4690 8.1221 8.1221 8.1221 8.1221 9.3280 9.3280 9.3280 9.3280 9.8190 9.8190 9.8190 9.8190 10.0264 10.0264 10.0264 10.0264 10.5749 10.5749 10.5749 10.5749 11.9935 11.9935 11.9935 11.9935 12.5326 12.5326 12.5326 12.5326 19.4715 19.4715 19.4715 19.4715 19.6565 19.6565 19.6565 19.6565 22.8168 22.8168 22.8168 22.8168 k = 0.2361 0.5000-0.0000 ( 3130 PWs) bands (ev): -9.0358 -9.0358 -9.0358 -9.0358 -6.8057 -6.8057 -6.8057 -6.8057 -5.8111 -5.8111 -5.8111 -5.8111 -5.0994 -5.0994 -5.0994 -5.0994 2.0187 2.0187 2.0187 2.0187 4.1225 4.1225 4.1225 4.1225 4.5487 4.5487 4.5487 4.5487 6.3778 6.3778 6.3778 6.3778 7.5329 7.5329 7.5329 7.5329 8.1623 8.1623 8.1623 8.1623 9.2985 9.2985 9.2985 9.2985 9.7508 9.7508 9.7508 9.7508 10.0376 10.0376 10.0376 10.0376 10.5661 10.5661 10.5661 10.5661 11.9908 11.9908 11.9908 11.9908 12.5145 12.5145 12.5145 12.5145 19.4742 19.4742 19.4742 19.4742 19.6670 19.6670 19.6670 19.6670 22.8162 22.8162 22.8162 22.8162 k = 0.2500 0.5000-0.0000 ( 3134 PWs) bands (ev): -9.0012 -9.0012 -9.0012 -9.0012 -6.8698 -6.8698 -6.8698 -6.8698 -5.7949 -5.7949 -5.7949 -5.7949 -5.1104 -5.1104 -5.1104 -5.1104 2.0727 2.0727 2.0727 2.0727 4.0502 4.0502 4.0502 4.0502 4.5853 4.5853 4.5853 4.5853 6.3961 6.3961 6.3961 6.3961 7.5948 7.5948 7.5948 7.5948 8.2009 8.2009 8.2009 8.2009 9.2702 9.2702 9.2702 9.2702 9.6751 9.6751 9.6751 9.6751 10.0495 10.0495 10.0495 10.0495 10.5635 10.5635 10.5635 10.5635 11.9882 11.9882 11.9882 11.9882 12.4948 12.4948 12.4948 12.4948 19.4765 19.4765 19.4765 19.4765 19.6767 19.6767 19.6767 19.6767 22.8177 22.8177 22.8177 22.8177 k = 0.2639 0.5000-0.0000 ( 3130 PWs) bands (ev): -8.9647 -8.9647 -8.9647 -8.9647 -6.9353 -6.9353 -6.9353 -6.9353 -5.7781 -5.7781 -5.7781 -5.7781 -5.1223 -5.1223 -5.1223 -5.1223 2.1260 2.1260 2.1260 2.1260 3.9783 3.9783 3.9783 3.9783 4.6282 4.6282 4.6282 4.6282 6.4130 6.4130 6.4130 6.4130 7.6542 7.6542 7.6542 7.6542 8.2374 8.2374 8.2374 8.2374 9.2433 9.2433 9.2433 9.2433 9.5941 9.5941 9.5941 9.5941 10.0624 10.0624 10.0624 10.0624 10.5658 10.5658 10.5658 10.5658 11.9857 11.9857 11.9857 11.9857 12.4737 12.4737 12.4737 12.4737 19.4784 19.4784 19.4784 19.4784 19.6854 19.6854 19.6854 19.6854 22.8213 22.8213 22.8213 22.8213 k = 0.2778 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.9264 -8.9264 -8.9264 -8.9264 -7.0020 -7.0020 -7.0020 -7.0020 -5.7607 -5.7607 -5.7607 -5.7607 -5.1350 -5.1350 -5.1350 -5.1350 2.1784 2.1784 2.1784 2.1784 3.9069 3.9069 3.9069 3.9069 4.6774 4.6774 4.6774 4.6774 6.4280 6.4280 6.4280 6.4280 7.7103 7.7103 7.7103 7.7103 8.2712 8.2712 8.2712 8.2712 9.2180 9.2180 9.2180 9.2180 9.5098 9.5098 9.5098 9.5098 10.0765 10.0765 10.0765 10.0765 10.5713 10.5713 10.5713 10.5713 11.9835 11.9835 11.9835 11.9835 12.4511 12.4511 12.4511 12.4511 19.4801 19.4801 19.4801 19.4801 19.6928 19.6928 19.6928 19.6928 22.8269 22.8269 22.8269 22.8269 k = 0.2917 0.5000-0.0000 ( 3140 PWs) bands (ev): -8.8862 -8.8862 -8.8862 -8.8862 -7.0697 -7.0697 -7.0697 -7.0697 -5.7426 -5.7426 -5.7426 -5.7426 -5.1485 -5.1485 -5.1485 -5.1485 2.2298 2.2298 2.2298 2.2298 3.8362 3.8362 3.8362 3.8362 4.7329 4.7329 4.7329 4.7329 6.4410 6.4410 6.4410 6.4410 7.7624 7.7624 7.7624 7.7624 8.3015 8.3015 8.3015 8.3015 9.1948 9.1948 9.1948 9.1948 9.4246 9.4246 9.4246 9.4246 10.0920 10.0920 10.0920 10.0920 10.5789 10.5789 10.5789 10.5789 11.9814 11.9814 11.9814 11.9814 12.4273 12.4273 12.4273 12.4273 19.4819 19.4819 19.4819 19.4819 19.6989 19.6989 19.6989 19.6989 22.8346 22.8346 22.8346 22.8346 k = 0.3056 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.8443 -8.8443 -8.8443 -8.8443 -7.1381 -7.1381 -7.1381 -7.1381 -5.7239 -5.7239 -5.7239 -5.7239 -5.1628 -5.1628 -5.1628 -5.1628 2.2800 2.2800 2.2800 2.2800 3.7664 3.7664 3.7664 3.7664 4.7945 4.7945 4.7945 4.7945 6.4514 6.4514 6.4514 6.4514 7.8100 7.8100 7.8100 7.8100 8.3273 8.3273 8.3273 8.3273 9.1737 9.1737 9.1737 9.1737 9.3407 9.3407 9.3407 9.3407 10.1092 10.1092 10.1092 10.1092 10.5876 10.5876 10.5876 10.5876 11.9797 11.9797 11.9797 11.9797 12.4022 12.4022 12.4022 12.4022 19.4839 19.4839 19.4839 19.4839 19.7034 19.7034 19.7034 19.7034 22.8442 22.8442 22.8442 22.8442 k = 0.3194 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.8007 -8.8007 -8.8007 -8.8007 -7.2071 -7.2071 -7.2071 -7.2071 -5.7047 -5.7047 -5.7047 -5.7047 -5.1779 -5.1779 -5.1779 -5.1779 2.3291 2.3291 2.3291 2.3291 3.6977 3.6977 3.6977 3.6977 4.8620 4.8620 4.8620 4.8620 6.4587 6.4587 6.4587 6.4587 7.8526 7.8526 7.8526 7.8526 8.3476 8.3476 8.3476 8.3476 9.1547 9.1547 9.1547 9.1547 9.2606 9.2606 9.2606 9.2606 10.1281 10.1281 10.1281 10.1281 10.5964 10.5964 10.5964 10.5964 11.9785 11.9785 11.9785 11.9785 12.3761 12.3761 12.3761 12.3761 19.4864 19.4864 19.4864 19.4864 19.7064 19.7064 19.7064 19.7064 22.8555 22.8555 22.8555 22.8555 k = 0.3333 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.7553 -8.7553 -8.7553 -8.7553 -7.2764 -7.2764 -7.2764 -7.2764 -5.6850 -5.6850 -5.6850 -5.6850 -5.1937 -5.1937 -5.1937 -5.1937 2.3770 2.3770 2.3770 2.3770 3.6301 3.6301 3.6301 3.6301 4.9351 4.9351 4.9351 4.9351 6.4625 6.4625 6.4625 6.4625 7.8900 7.8900 7.8900 7.8900 8.3608 8.3608 8.3608 8.3608 9.1375 9.1375 9.1375 9.1375 9.1871 9.1871 9.1871 9.1871 10.1491 10.1491 10.1491 10.1491 10.6047 10.6047 10.6047 10.6047 11.9777 11.9777 11.9777 11.9777 12.3492 12.3492 12.3492 12.3492 19.4895 19.4895 19.4895 19.4895 19.7076 19.7076 19.7076 19.7076 22.8684 22.8684 22.8684 22.8684 k = 0.3472 0.5000-0.0000 ( 3130 PWs) bands (ev): -8.7082 -8.7082 -8.7082 -8.7082 -7.3461 -7.3461 -7.3461 -7.3461 -5.6648 -5.6648 -5.6648 -5.6648 -5.2102 -5.2102 -5.2102 -5.2102 2.4240 2.4240 2.4240 2.4240 3.5638 3.5638 3.5638 3.5638 5.0133 5.0133 5.0133 5.0133 6.4621 6.4621 6.4621 6.4621 7.9220 7.9220 7.9220 7.9220 8.3656 8.3656 8.3656 8.3656 9.1146 9.1146 9.1146 9.1146 9.1303 9.1303 9.1303 9.1303 10.1721 10.1721 10.1721 10.1721 10.6118 10.6118 10.6118 10.6118 11.9775 11.9775 11.9775 11.9775 12.3216 12.3216 12.3216 12.3216 19.4934 19.4934 19.4934 19.4934 19.7071 19.7071 19.7071 19.7071 22.8827 22.8827 22.8827 22.8827 k = 0.3611 0.5000-0.0000 ( 3134 PWs) bands (ev): -8.6594 -8.6594 -8.6594 -8.6594 -7.4158 -7.4158 -7.4158 -7.4158 -5.6443 -5.6443 -5.6443 -5.6443 -5.2274 -5.2274 -5.2274 -5.2274 2.4700 2.4700 2.4700 2.4700 3.4988 3.4988 3.4988 3.4988 5.0960 5.0960 5.0960 5.0960 6.4567 6.4567 6.4567 6.4567 7.9487 7.9487 7.9487 7.9487 8.3606 8.3606 8.3606 8.3606 9.0652 9.0652 9.0652 9.0652 9.1132 9.1132 9.1132 9.1132 10.1972 10.1972 10.1972 10.1972 10.6171 10.6171 10.6171 10.6171 11.9781 11.9781 11.9781 11.9781 12.2936 12.2936 12.2936 12.2936 19.4983 19.4983 19.4983 19.4983 19.7048 19.7048 19.7048 19.7048 22.8981 22.8981 22.8981 22.8981 k = 0.3750 0.5000-0.0000 ( 3138 PWs) bands (ev): -8.6090 -8.6090 -8.6090 -8.6090 -7.4854 -7.4854 -7.4854 -7.4854 -5.6234 -5.6234 -5.6234 -5.6234 -5.2453 -5.2453 -5.2453 -5.2453 2.5155 2.5155 2.5155 2.5155 3.4353 3.4353 3.4353 3.4353 5.1828 5.1828 5.1828 5.1828 6.4457 6.4457 6.4457 6.4457 7.9705 7.9705 7.9705 7.9705 8.3452 8.3452 8.3452 8.3452 9.0244 9.0244 9.0244 9.0244 9.1020 9.1020 9.1020 9.1020 10.2244 10.2244 10.2244 10.2244 10.6202 10.6202 10.6202 10.6202 11.9795 11.9795 11.9795 11.9795 12.2654 12.2654 12.2654 12.2654 19.5042 19.5042 19.5042 19.5042 19.7007 19.7007 19.7007 19.7007 22.9144 22.9144 22.9144 22.9144 k = 0.3889 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.5571 -8.5571 -8.5571 -8.5571 -7.5549 -7.5549 -7.5549 -7.5549 -5.6022 -5.6022 -5.6022 -5.6022 -5.2637 -5.2637 -5.2637 -5.2637 2.5605 2.5605 2.5605 2.5605 3.3732 3.3732 3.3732 3.3732 5.2728 5.2728 5.2728 5.2728 6.4283 6.4283 6.4283 6.4283 7.9880 7.9880 7.9880 7.9880 8.3205 8.3205 8.3205 8.3205 8.9963 8.9963 8.9963 8.9963 9.0924 9.0924 9.0924 9.0924 10.2535 10.2535 10.2535 10.2535 10.6207 10.6207 10.6207 10.6207 11.9819 11.9819 11.9819 11.9819 12.2375 12.2375 12.2375 12.2375 19.5114 19.5114 19.5114 19.5114 19.6950 19.6950 19.6950 19.6950 22.9315 22.9315 22.9315 22.9315 k = 0.4028 0.5000-0.0000 ( 3140 PWs) bands (ev): -8.5036 -8.5036 -8.5036 -8.5036 -7.6241 -7.6241 -7.6241 -7.6241 -5.5807 -5.5807 -5.5807 -5.5807 -5.2827 -5.2827 -5.2827 -5.2827 2.6052 2.6052 2.6052 2.6052 3.3126 3.3126 3.3126 3.3126 5.3654 5.3654 5.3654 5.3654 6.4037 6.4037 6.4037 6.4037 8.0017 8.0017 8.0017 8.0017 8.2886 8.2886 8.2886 8.2886 8.9798 8.9798 8.9798 8.9798 9.0836 9.0836 9.0836 9.0836 10.2842 10.2842 10.2842 10.2842 10.6182 10.6182 10.6182 10.6182 11.9854 11.9854 11.9854 11.9854 12.2100 12.2100 12.2100 12.2100 19.5197 19.5197 19.5197 19.5197 19.6876 19.6876 19.6876 19.6876 22.9490 22.9490 22.9490 22.9490 k = 0.4167 0.5000-0.0000 ( 3148 PWs) bands (ev): -8.4486 -8.4486 -8.4486 -8.4486 -7.6928 -7.6928 -7.6928 -7.6928 -5.5591 -5.5591 -5.5591 -5.5591 -5.3023 -5.3023 -5.3023 -5.3023 2.6500 2.6500 2.6500 2.6500 3.2535 3.2535 3.2535 3.2535 5.4597 5.4597 5.4597 5.4597 6.3715 6.3715 6.3715 6.3715 8.0126 8.0126 8.0126 8.0126 8.2525 8.2525 8.2525 8.2525 8.9727 8.9727 8.9727 8.9727 9.0753 9.0753 9.0753 9.0753 10.3162 10.3162 10.3162 10.3162 10.6125 10.6125 10.6125 10.6125 11.9902 11.9902 11.9902 11.9902 12.1832 12.1832 12.1832 12.1832 19.5291 19.5291 19.5291 19.5291 19.6787 19.6787 19.6787 19.6787 22.9667 22.9667 22.9667 22.9667 k = 0.4306 0.5000-0.0000 ( 3152 PWs) bands (ev): -8.3921 -8.3921 -8.3921 -8.3921 -7.7609 -7.7609 -7.7609 -7.7609 -5.5373 -5.5373 -5.5373 -5.5373 -5.3222 -5.3222 -5.3222 -5.3222 2.6949 2.6949 2.6949 2.6949 3.1960 3.1960 3.1960 3.1960 5.5548 5.5548 5.5548 5.5548 6.3310 6.3310 6.3310 6.3310 8.0216 8.0216 8.0216 8.0216 8.2153 8.2153 8.2153 8.2153 8.9727 8.9727 8.9727 8.9727 9.0670 9.0670 9.0670 9.0670 10.3490 10.3490 10.3490 10.3490 10.6032 10.6032 10.6032 10.6032 11.9964 11.9964 11.9964 11.9964 12.1576 12.1576 12.1576 12.1576 19.5397 19.5397 19.5397 19.5397 19.6685 19.6685 19.6685 19.6685 22.9843 22.9843 22.9843 22.9843 k = 0.4444 0.5000-0.0000 ( 3152 PWs) bands (ev): -8.3343 -8.3343 -8.3343 -8.3343 -7.8284 -7.8284 -7.8284 -7.8284 -5.5154 -5.5154 -5.5154 -5.5154 -5.3426 -5.3426 -5.3426 -5.3426 2.7404 2.7404 2.7404 2.7404 3.1400 3.1400 3.1400 3.1400 5.6499 5.6499 5.6499 5.6499 6.2822 6.2822 6.2822 6.2822 8.0298 8.0298 8.0298 8.0298 8.1795 8.1795 8.1795 8.1795 8.9776 8.9776 8.9776 8.9776 9.0585 9.0585 9.0585 9.0585 10.3821 10.3821 10.3821 10.3821 10.5905 10.5905 10.5905 10.5905 12.0041 12.0041 12.0041 12.0041 12.1332 12.1332 12.1332 12.1332 19.5512 19.5512 19.5512 19.5512 19.6571 19.6571 19.6571 19.6571 23.0014 23.0014 23.0014 23.0014 k = 0.4583 0.5000-0.0000 ( 3152 PWs) bands (ev): -8.2751 -8.2751 -8.2751 -8.2751 -7.8952 -7.8952 -7.8952 -7.8952 -5.4935 -5.4935 -5.4935 -5.4935 -5.3634 -5.3634 -5.3634 -5.3634 2.7864 2.7864 2.7864 2.7864 3.0856 3.0856 3.0856 3.0856 5.7438 5.7438 5.7438 5.7438 6.2251 6.2251 6.2251 6.2251 8.0382 8.0382 8.0382 8.0382 8.1470 8.1470 8.1470 8.1470 8.9855 8.9855 8.9855 8.9855 9.0494 9.0494 9.0494 9.0494 10.4148 10.4148 10.4148 10.4148 10.5742 10.5742 10.5742 10.5742 12.0135 12.0135 12.0135 12.0135 12.1105 12.1105 12.1105 12.1105 19.5636 19.5636 19.5636 19.5636 19.6447 19.6447 19.6447 19.6447 23.0172 23.0172 23.0172 23.0172 k = 0.4722 0.5000-0.0000 ( 3152 PWs) bands (ev): -8.2146 -8.2146 -8.2146 -8.2146 -7.9611 -7.9611 -7.9611 -7.9611 -5.4716 -5.4716 -5.4716 -5.4716 -5.3845 -5.3845 -5.3845 -5.3845 2.8332 2.8332 2.8332 2.8332 3.0327 3.0327 3.0327 3.0327 5.8355 5.8355 5.8355 5.8355 6.1602 6.1602 6.1602 6.1602 8.0479 8.0479 8.0479 8.0479 8.1187 8.1187 8.1187 8.1187 8.9952 8.9952 8.9952 8.9952 9.0398 9.0398 9.0398 9.0398 10.4467 10.4467 10.4467 10.4467 10.5545 10.5545 10.5545 10.5545 12.0248 12.0248 12.0248 12.0248 12.0895 12.0895 12.0895 12.0895 19.5767 19.5767 19.5767 19.5767 19.6317 19.6317 19.6317 19.6317 23.0309 23.0309 23.0309 23.0309 k = 0.4861 0.5000-0.0000 ( 3152 PWs) bands (ev): -8.1529 -8.1529 -8.1529 -8.1529 -8.0260 -8.0260 -8.0260 -8.0260 -5.4499 -5.4499 -5.4499 -5.4499 -5.4056 -5.4056 -5.4056 -5.4056 2.8807 2.8807 2.8807 2.8807 2.9815 2.9815 2.9815 2.9815 5.9237 5.9237 5.9237 5.9237 6.0883 6.0883 6.0883 6.0883 8.0598 8.0598 8.0598 8.0598 8.0952 8.0952 8.0952 8.0952 9.0055 9.0055 9.0055 9.0055 9.0300 9.0300 9.0300 9.0300 10.4771 10.4771 10.4771 10.4771 10.5315 10.5315 10.5315 10.5315 12.0378 12.0378 12.0378 12.0378 12.0704 12.0704 12.0704 12.0704 19.5902 19.5902 19.5902 19.5902 19.6182 19.6182 19.6182 19.6182 23.0407 23.0407 23.0407 23.0407 k = 0.5000 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.0902 -8.0902 -8.0902 -8.0902 -8.0898 -8.0898 -8.0898 -8.0898 -5.4320 -5.4320 -5.4320 -5.4320 -5.4234 -5.4234 -5.4234 -5.4234 2.9220 2.9220 2.9220 2.9220 2.9390 2.9390 2.9390 2.9390 5.9974 5.9974 5.9974 5.9974 6.0200 6.0200 6.0200 6.0200 8.0718 8.0718 8.0718 8.0718 8.0792 8.0792 8.0792 8.0792 9.0123 9.0123 9.0123 9.0123 9.0234 9.0234 9.0234 9.0234 10.5035 10.5035 10.5035 10.5035 10.5077 10.5077 10.5077 10.5077 12.0511 12.0511 12.0511 12.0511 12.0552 12.0552 12.0552 12.0552 19.6023 19.6023 19.6023 19.6023 19.6062 19.6062 19.6062 19.6062 23.0444 23.0444 23.0444 23.0444 k = 0.5000 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.0902 -8.0902 -8.0902 -8.0902 -8.0898 -8.0898 -8.0898 -8.0898 -5.4320 -5.4320 -5.4320 -5.4320 -5.4234 -5.4234 -5.4234 -5.4234 2.9220 2.9220 2.9220 2.9220 2.9390 2.9390 2.9390 2.9390 5.9974 5.9974 5.9974 5.9974 6.0200 6.0200 6.0200 6.0200 8.0718 8.0718 8.0718 8.0718 8.0792 8.0792 8.0792 8.0792 9.0123 9.0123 9.0123 9.0123 9.0234 9.0234 9.0234 9.0234 10.5035 10.5035 10.5035 10.5035 10.5077 10.5077 10.5077 10.5077 12.0511 12.0511 12.0511 12.0511 12.0552 12.0552 12.0552 12.0552 19.6023 19.6023 19.6023 19.6023 19.6062 19.6062 19.6062 19.6062 23.0444 23.0444 23.0444 23.0444 k = 0.4902 0.4902-0.0000 ( 3148 PWs) bands (ev): -8.1797 -8.1797 -8.0897 -8.0897 -8.0887 -8.0887 -7.9996 -7.9996 -5.4664 -5.4664 -5.4344 -5.4344 -5.4209 -5.4209 -5.3893 -5.3893 2.8506 2.8506 2.9213 2.9213 2.9390 2.9390 3.0124 3.0124 5.9162 5.9162 5.9818 5.9818 6.0282 6.0282 6.1045 6.1045 8.0416 8.0416 8.0706 8.0706 8.0767 8.0767 8.0985 8.0985 8.9947 8.9947 9.0166 9.0166 9.0300 9.0300 9.0462 9.0462 10.4839 10.4839 10.4873 10.4873 10.5200 10.5200 10.5284 10.5284 12.0320 12.0320 12.0522 12.0522 12.0564 12.0564 12.0742 12.0742 19.5855 19.5855 19.6021 19.6021 19.6056 19.6056 19.6221 19.6221 23.0249 23.0249 23.0603 23.0603 k = 0.4804 0.4804-0.0000 ( 3152 PWs) bands (ev): -8.2686 -8.2686 -8.0878 -8.0878 -8.0857 -8.0857 -7.9087 -7.9087 -5.5047 -5.5047 -5.4418 -5.4418 -5.4132 -5.4132 -5.3524 -5.3524 2.7743 2.7743 2.9101 2.9101 2.9480 2.9480 3.0948 3.0948 5.8292 5.8292 5.9501 5.9501 6.0375 6.0375 6.2016 6.2016 8.0010 8.0010 8.0631 8.0631 8.0713 8.0713 8.1085 8.1085 8.9838 8.9838 9.0229 9.0229 9.0523 9.0523 9.0769 9.0769 10.4602 10.4602 10.4695 10.4695 10.5295 10.5295 10.5529 10.5529 12.0109 12.0109 12.0538 12.0538 12.0617 12.0617 12.0948 12.0948 19.5660 19.5660 19.5998 19.5998 19.6060 19.6060 19.6389 19.6389 23.0026 23.0026 23.0727 23.0727 k = 0.4706 0.4706-0.0000 ( 3152 PWs) bands (ev): -8.3567 -8.3567 -8.0842 -8.0842 -8.0811 -8.0811 -7.8173 -7.8173 -5.5435 -5.5435 -5.4490 -5.4490 -5.4056 -5.4056 -5.3158 -5.3158 2.7000 2.7000 2.8988 2.8988 2.9554 2.9554 3.1793 3.1793 5.7459 5.7459 5.9126 5.9126 6.0380 6.0380 6.3018 6.3018 7.9547 7.9547 8.0562 8.0562 8.0575 8.0575 8.1051 8.1051 8.9834 8.9834 9.0395 9.0395 9.0804 9.0804 9.1107 9.1107 10.4315 10.4315 10.4550 10.4550 10.5342 10.5342 10.5788 10.5788 11.9897 11.9897 12.0577 12.0577 12.0694 12.0694 12.1153 12.1153 19.5451 19.5451 19.5972 19.5972 19.6058 19.6058 19.6553 19.6553 22.9783 22.9783 23.0815 23.0815 k = 0.4608 0.4608-0.0000 ( 3152 PWs) bands (ev): -8.4439 -8.4439 -8.0790 -8.0790 -8.0749 -8.0749 -7.7256 -7.7256 -5.5826 -5.5826 -5.4559 -5.4559 -5.3981 -5.3981 -5.2798 -5.2798 2.6279 2.6279 2.8875 2.8875 2.9613 2.9613 3.2655 3.2655 5.6668 5.6668 5.8706 5.8706 6.0288 6.0288 6.4044 6.4044 7.9047 7.9047 8.0327 8.0327 8.0513 8.0513 8.0904 8.0904 8.9945 8.9945 9.0640 9.0640 9.1132 9.1132 9.1470 9.1470 10.3984 10.3984 10.4439 10.4439 10.5341 10.5341 10.6061 10.6061 11.9683 11.9683 12.0636 12.0636 12.0793 12.0793 12.1358 12.1358 19.5227 19.5227 19.5945 19.5945 19.6048 19.6048 19.6712 19.6712 22.9525 22.9525 23.0818 23.0818 k = 0.4510 0.4510-0.0000 ( 3148 PWs) bands (ev): -8.5301 -8.5301 -8.0721 -8.0721 -8.0671 -8.0671 -7.6336 -7.6336 -5.6220 -5.6220 -5.4626 -5.4626 -5.3905 -5.3905 -5.2443 -5.2443 2.5583 2.5583 2.8762 2.8762 2.9654 2.9654 3.3533 3.3533 5.5924 5.5924 5.8251 5.8251 6.0097 6.0097 6.5088 6.5088 7.8523 7.8523 7.9993 7.9993 8.0341 8.0341 8.0797 8.0797 9.0162 9.0162 9.0917 9.0917 9.1498 9.1498 9.1872 9.1872 10.3611 10.3611 10.4365 10.4365 10.5293 10.5293 10.6342 10.6342 11.9468 11.9468 12.0716 12.0716 12.0912 12.0912 12.1562 12.1562 19.4988 19.4988 19.5920 19.5920 19.6031 19.6031 19.6870 19.6870 22.9256 22.9256 23.0740 23.0740 k = 0.4412 0.4412-0.0000 ( 3152 PWs) bands (ev): -8.6152 -8.6152 -8.0637 -8.0637 -8.0577 -8.0577 -7.5416 -7.5416 -5.6615 -5.6615 -5.4692 -5.4692 -5.3831 -5.3831 -5.2096 -5.2096 2.4911 2.4911 2.8650 2.8650 2.9675 2.9675 3.4423 3.4423 5.5229 5.5229 5.7768 5.7768 5.9809 5.9809 6.6144 6.6144 7.7987 7.7987 7.9573 7.9573 7.9940 7.9940 8.0876 8.0876 9.0466 9.0466 9.1170 9.1170 9.1893 9.1893 9.2335 9.2335 10.3200 10.3200 10.4327 10.4327 10.5200 10.5200 10.6631 10.6631 11.9253 11.9253 12.0814 12.0814 12.1049 12.1049 12.1766 12.1766 19.4730 19.4730 19.5900 19.5900 19.6010 19.6010 19.7026 19.7026 22.8981 22.8981 23.0656 23.0656 k = 0.4314 0.4314-0.0000 ( 3140 PWs) bands (ev): -8.6991 -8.6991 -8.0536 -8.0536 -8.0467 -8.0467 -7.4495 -7.4495 -5.7011 -5.7011 -5.4756 -5.4756 -5.3757 -5.3757 -5.1757 -5.1757 2.4264 2.4264 2.8541 2.8541 2.9674 2.9674 3.5324 3.5324 5.4586 5.4586 5.7265 5.7265 5.9432 5.9432 6.7206 6.7206 7.7448 7.7448 7.9080 7.9080 7.9408 7.9408 8.1078 8.1078 9.0829 9.0829 9.1361 9.1361 9.2312 9.2312 9.2873 9.2873 10.2754 10.2754 10.4327 10.4327 10.5066 10.5066 10.6924 10.6924 11.9038 11.9038 12.0930 12.0930 12.1201 12.1201 12.1972 12.1972 19.4453 19.4453 19.5885 19.5885 19.5988 19.5988 19.7184 19.7184 22.8703 22.8703 23.0570 23.0570 k = 0.4216 0.4216-0.0000 ( 3137 PWs) bands (ev): -8.7819 -8.7819 -8.0420 -8.0420 -8.0341 -8.0341 -7.3576 -7.3576 -5.7407 -5.7407 -5.4818 -5.4818 -5.3685 -5.3685 -5.1425 -5.1425 2.3643 2.3643 2.8434 2.8434 2.9647 2.9647 3.6232 3.6232 5.3996 5.3996 5.6748 5.6748 5.8976 5.8976 6.8263 6.8263 7.6914 7.6914 7.8526 7.8526 7.8803 7.8803 8.1370 8.1370 9.1215 9.1215 9.1486 9.1486 9.2755 9.2755 9.3473 9.3473 10.2276 10.2276 10.4360 10.4360 10.4894 10.4894 10.7220 10.7220 11.8823 11.8823 12.1062 12.1062 12.1366 12.1366 12.2179 12.2179 19.4156 19.4156 19.5878 19.5878 19.5967 19.5967 19.7344 19.7344 22.8424 22.8424 23.0486 23.0486 k = 0.4118 0.4118-0.0000 ( 3139 PWs) bands (ev): -8.8634 -8.8634 -8.0287 -8.0287 -8.0200 -8.0200 -7.2660 -7.2660 -5.7804 -5.7804 -5.4877 -5.4877 -5.3614 -5.3614 -5.1102 -5.1102 2.3049 2.3049 2.8330 2.8330 2.9595 2.9595 3.7144 3.7144 5.3459 5.3459 5.6222 5.6222 5.8452 5.8452 6.9298 6.9298 7.6388 7.6388 7.7923 7.7923 7.8167 7.8167 8.1743 8.1743 9.1446 9.1446 9.1699 9.1699 9.3223 9.3223 9.4114 9.4114 10.1771 10.1771 10.4422 10.4422 10.4689 10.4689 10.7516 10.7516 11.8609 11.8609 12.1209 12.1209 12.1539 12.1539 12.2388 12.2388 19.3836 19.3836 19.5875 19.5875 19.5957 19.5957 19.7507 19.7507 22.8149 22.8149 23.0403 23.0403 k = 0.4020 0.4020-0.0000 ( 3143 PWs) bands (ev): -8.9435 -8.9435 -8.0139 -8.0139 -8.0043 -8.0043 -7.1749 -7.1749 -5.8199 -5.8199 -5.4935 -5.4935 -5.3546 -5.3546 -5.0788 -5.0788 2.2483 2.2483 2.8230 2.8230 2.9516 2.9516 3.8056 3.8056 5.2977 5.2977 5.5693 5.5693 5.7876 5.7876 7.0281 7.0281 7.5874 7.5874 7.7287 7.7287 7.7539 7.7539 8.2187 8.2187 9.1426 9.1426 9.2085 9.2085 9.3716 9.3716 9.4773 9.4773 10.1241 10.1241 10.4449 10.4449 10.4514 10.4514 10.7811 10.7811 11.8396 11.8396 12.1371 12.1371 12.1717 12.1717 12.2602 12.2602 19.3493 19.3493 19.5872 19.5872 19.5966 19.5966 19.7677 19.7677 22.7880 22.7880 23.0322 23.0322 k = 0.3922 0.3922-0.0000 ( 3143 PWs) bands (ev): -9.0222 -9.0222 -7.9975 -7.9975 -7.9871 -7.9871 -7.0843 -7.0843 -5.8593 -5.8593 -5.4991 -5.4991 -5.3480 -5.3480 -5.0482 -5.0482 2.1944 2.1944 2.8134 2.8134 2.9408 2.9408 3.8963 3.8963 5.2547 5.2547 5.5164 5.5164 5.7263 5.7263 7.1154 7.1154 7.5374 7.5374 7.6633 7.6633 7.6988 7.6988 8.2694 8.2694 9.1320 9.1320 9.2471 9.2471 9.4233 9.4233 9.5435 9.5435 10.0689 10.0689 10.4192 10.4192 10.4616 10.4616 10.8104 10.8104 11.8186 11.8186 12.1547 12.1547 12.1898 12.1898 12.2820 12.2820 19.3126 19.3126 19.5870 19.5870 19.6000 19.6000 19.7853 19.7853 22.7621 22.7621 23.0245 23.0245 k = 0.3824 0.3824-0.0000 ( 3149 PWs) bands (ev): -9.0995 -9.0995 -7.9796 -7.9796 -7.9683 -7.9683 -6.9946 -6.9946 -5.8986 -5.8986 -5.5045 -5.5045 -5.3417 -5.3417 -5.0187 -5.0187 2.1435 2.1435 2.8041 2.8041 2.9273 2.9273 3.9857 3.9857 5.2167 5.2167 5.4640 5.4640 5.6630 5.6630 7.1797 7.1797 7.4883 7.4883 7.5971 7.5971 7.6644 7.6644 8.3253 8.3253 9.1149 9.1149 9.2832 9.2832 9.4769 9.4769 9.6083 9.6083 10.0119 10.0119 10.3913 10.3913 10.4732 10.4732 10.8395 10.8395 11.7979 11.7979 12.1736 12.1736 12.2078 12.2078 12.3043 12.3043 19.2732 19.2732 19.5875 19.5875 19.6057 19.6057 19.8039 19.8039 22.7374 22.7374 23.0173 23.0173 k = 0.3725 0.3725-0.0000 ( 3149 PWs) bands (ev): -9.1754 -9.1754 -7.9602 -7.9602 -7.9481 -7.9481 -6.9059 -6.9059 -5.9376 -5.9376 -5.5096 -5.5096 -5.3358 -5.3358 -4.9900 -4.9900 2.0954 2.0954 2.7951 2.7951 2.9112 2.9112 4.0730 4.0730 5.1833 5.1833 5.4126 5.4126 5.5993 5.5993 7.2049 7.2049 7.4385 7.4385 7.5319 7.5319 7.6685 7.6685 8.3855 8.3855 9.0922 9.0922 9.3165 9.3165 9.5319 9.5319 9.6708 9.6708 9.9533 9.9533 10.3622 10.3622 10.4852 10.4852 10.8681 10.8681 11.7776 11.7776 12.1939 12.1939 12.2255 12.2255 12.3273 12.3273 19.2312 19.2312 19.5894 19.5894 19.6137 19.6137 19.8235 19.8235 22.7143 22.7143 23.0106 23.0106 k = 0.3627 0.3627-0.0000 ( 3145 PWs) bands (ev): -9.2497 -9.2497 -7.9393 -7.9393 -7.9265 -7.9265 -6.8182 -6.8182 -5.9762 -5.9762 -5.5146 -5.5146 -5.3303 -5.3303 -4.9624 -4.9624 2.0503 2.0503 2.7864 2.7864 2.8926 2.8926 4.1571 4.1571 5.1538 5.1538 5.3627 5.3627 5.5371 5.5371 7.1857 7.1857 7.3848 7.3848 7.4720 7.4720 7.7167 7.7167 8.4492 8.4492 9.0644 9.0644 9.3467 9.3467 9.5873 9.5873 9.7297 9.7297 9.8937 9.8937 10.3326 10.3326 10.4969 10.4969 10.8963 10.8963 11.7577 11.7577 12.2154 12.2154 12.2427 12.2427 12.3508 12.3508 19.1864 19.1864 19.5931 19.5931 19.6239 19.6239 19.8444 19.8444 22.6929 22.6929 23.0045 23.0045 k = 0.3529 0.3529-0.0000 ( 3143 PWs) bands (ev): -9.3224 -9.3224 -7.9169 -7.9169 -7.9034 -7.9034 -6.7320 -6.7320 -6.0145 -6.0145 -5.5194 -5.5194 -5.3253 -5.3253 -4.9358 -4.9358 2.0082 2.0082 2.7779 2.7779 2.8717 2.8717 4.2364 4.2364 5.1273 5.1273 5.3149 5.3149 5.4783 5.4783 7.1358 7.1358 7.3229 7.3229 7.4222 7.4222 7.7961 7.7961 8.5153 8.5153 9.0321 9.0321 9.3739 9.3739 9.6422 9.6422 9.7839 9.7839 9.8337 9.8337 10.3035 10.3035 10.5076 10.5076 10.9241 10.9241 11.7382 11.7382 12.2382 12.2382 12.2592 12.2592 12.3750 12.3750 19.1387 19.1387 19.5989 19.5989 19.6366 19.6366 19.8666 19.8666 22.6734 22.6734 22.9990 22.9990 k = 0.3431 0.3431-0.0000 ( 3145 PWs) bands (ev): -9.3935 -9.3935 -7.8931 -7.8931 -7.8789 -7.8789 -6.6473 -6.6473 -6.0524 -6.0524 -5.5239 -5.5239 -5.3208 -5.3208 -4.9102 -4.9102 1.9693 1.9693 2.7696 2.7696 2.8489 2.8489 4.3092 4.3092 5.1026 5.1026 5.2702 5.2702 5.4252 5.4252 7.0702 7.0702 7.2530 7.2530 7.3833 7.3833 7.8920 7.8920 8.5829 8.5829 8.9957 8.9957 9.3982 9.3982 9.6957 9.6957 9.7707 9.7707 9.8358 9.8358 10.2758 10.2758 10.5168 10.5168 10.9515 10.9515 11.7193 11.7193 12.2621 12.2621 12.2749 12.2749 12.3995 12.3995 19.0879 19.0879 19.6071 19.6071 19.6516 19.6516 19.8905 19.8905 22.6561 22.6561 22.9941 22.9941 k = 0.3333 0.3333-0.0000 ( 3145 PWs) bands (ev): -9.4629 -9.4629 -7.8678 -7.8678 -7.8531 -7.8531 -6.5643 -6.5643 -6.0898 -6.0898 -5.5283 -5.5283 -5.3169 -5.3169 -4.8857 -4.8857 1.9335 1.9335 2.7612 2.7612 2.8244 2.8244 4.3730 4.3730 5.0780 5.0780 5.2299 5.2299 5.3802 5.3802 6.9980 6.9980 7.1780 7.1780 7.3528 7.3528 7.9959 7.9959 8.6511 8.6511 8.9557 8.9557 9.4197 9.4197 9.7087 9.7087 9.7478 9.7478 9.8802 9.8802 10.2508 10.2508 10.5239 10.5239 10.9785 10.9785 11.7009 11.7009 12.2866 12.2866 12.2904 12.2904 12.4245 12.4245 19.0341 19.0341 19.6181 19.6181 19.6691 19.6691 19.9160 19.9160 22.6412 22.6412 22.9899 22.9899 k = 0.3235 0.3235-0.0000 ( 3145 PWs) bands (ev): -9.5307 -9.5307 -7.8412 -7.8412 -7.8260 -7.8260 -6.4833 -6.4833 -6.1267 -6.1267 -5.5324 -5.5324 -5.3137 -5.3137 -4.8622 -4.8622 1.9010 1.9010 2.7528 2.7528 2.7988 2.7988 4.4252 4.4252 5.0516 5.0516 5.1956 5.1956 5.3456 5.3456 6.9241 6.9241 7.0998 7.0998 7.3292 7.3292 8.1035 8.1035 8.7188 8.7188 8.9124 8.9124 9.4385 9.4385 9.6474 9.6474 9.7957 9.7957 9.9194 9.9194 10.2302 10.2302 10.5287 10.5287 11.0051 11.0051 11.6831 11.6831 12.3034 12.3034 12.3138 12.3138 12.4496 12.4496 18.9772 18.9772 19.6321 19.6321 19.6891 19.6891 19.9434 19.9434 22.6286 22.6286 22.9861 22.9861 k = 0.3137 0.3137-0.0000 ( 3139 PWs) bands (ev): -9.5967 -9.5967 -7.8133 -7.8133 -7.7976 -7.7976 -6.4046 -6.4046 -6.1630 -6.1630 -5.5364 -5.5364 -5.3111 -5.3111 -4.8397 -4.8397 1.8718 1.8718 2.7441 2.7441 2.7723 2.7723 4.4633 4.4633 5.0218 5.0218 5.1683 5.1683 5.3234 5.3234 6.8518 6.8518 7.0199 7.0199 7.3117 7.3117 8.2127 8.2127 8.7845 8.7845 8.8665 8.8665 9.4545 9.4545 9.5859 9.5859 9.8396 9.8396 9.9530 9.9530 10.2155 10.2155 10.5307 10.5307 11.0316 11.0316 11.6657 11.6657 12.3167 12.3167 12.3407 12.3407 12.4748 12.4748 18.9171 18.9171 19.6492 19.6492 19.7118 19.7118 19.9727 19.9727 22.6186 22.6186 22.9827 22.9827 k = 0.3039 0.3039-0.0000 ( 3135 PWs) bands (ev): -9.6610 -9.6610 -7.7840 -7.7840 -7.7679 -7.7679 -6.3284 -6.3284 -6.1985 -6.1985 -5.5402 -5.5402 -5.3094 -5.3094 -4.8182 -4.8182 1.8460 1.8460 2.7347 2.7347 2.7456 2.7456 4.4857 4.4857 4.9885 4.9885 5.1480 5.1480 5.3141 5.3141 6.7836 6.7836 6.9388 6.9388 7.2999 7.2999 8.3218 8.3218 8.8143 8.8143 8.8510 8.8510 9.4679 9.4679 9.5253 9.5253 9.8787 9.8787 9.9808 9.9808 10.2086 10.2086 10.5298 10.5298 11.0579 11.0579 11.6486 11.6486 12.3291 12.3291 12.3685 12.3685 12.5000 12.5000 18.8538 18.8538 19.6697 19.6697 19.7369 19.7369 20.0041 20.0041 22.6111 22.6111 22.9795 22.9795 k = 0.2941 0.2941-0.0000 ( 3135 PWs) bands (ev): -9.7235 -9.7235 -7.7535 -7.7535 -7.7371 -7.7371 -6.2574 -6.2574 -6.2308 -6.2308 -5.5438 -5.5438 -5.3084 -5.3084 -4.7977 -4.7977 1.8237 1.8237 2.7167 2.7167 2.7269 2.7269 4.4927 4.4927 4.9524 4.9524 5.1335 5.1335 5.3161 5.3161 6.7219 6.7219 6.8568 6.8568 7.2937 7.2937 8.4297 8.4297 8.7644 8.7644 8.9084 8.9084 9.4609 9.4609 9.4838 9.4838 9.9128 9.9128 10.0029 10.0029 10.2104 10.2104 10.5260 10.5260 11.0842 11.0842 11.6316 11.6316 12.3407 12.3407 12.3968 12.3968 12.5249 12.5249 18.7873 18.7873 19.6936 19.6936 19.7647 19.7647 20.0375 20.0375 22.6061 22.6061 22.9761 22.9761 k = 0.2843 0.2843-0.0000 ( 3141 PWs) bands (ev): -9.7842 -9.7842 -7.7219 -7.7219 -7.7051 -7.7051 -6.2694 -6.2694 -6.1823 -6.1823 -5.5472 -5.5472 -5.3083 -5.3083 -4.7781 -4.7781 1.8049 1.8049 2.6901 2.6901 2.7165 2.7165 4.4864 4.4864 4.9148 4.9148 5.1229 5.1229 5.3258 5.3258 6.6691 6.6691 6.7744 6.7744 7.2930 7.2930 8.5354 8.5354 8.7111 8.7111 8.9610 8.9610 9.4034 9.4034 9.4931 9.4931 9.9427 9.9427 10.0194 10.0194 10.2210 10.2210 10.5191 10.5191 11.1105 11.1105 11.6147 11.6147 12.3514 12.3514 12.4256 12.4256 12.5495 12.5495 18.7177 18.7177 19.7209 19.7209 19.7950 19.7950 20.0730 20.0730 22.6035 22.6035 22.9724 22.9724 k = 0.2745 0.2745-0.0000 ( 3133 PWs) bands (ev): -9.8430 -9.8430 -7.6890 -7.6890 -7.6721 -7.6721 -6.3026 -6.3026 -6.1150 -6.1150 -5.5504 -5.5504 -5.3092 -5.3092 -4.7595 -4.7595 1.7898 1.7898 2.6634 2.6634 2.7058 2.7058 4.4701 4.4701 4.8767 4.8767 5.1148 5.1148 5.3379 5.3379 6.6280 6.6280 6.6918 6.6918 7.2976 7.2976 8.6358 8.6358 8.6578 8.6578 9.0055 9.0055 9.3453 9.3453 9.5053 9.5053 9.9705 9.9705 10.0308 10.0308 10.2390 10.2390 10.5094 10.5094 11.1372 11.1372 11.5974 11.5974 12.3615 12.3615 12.4545 12.4545 12.5737 12.5737 18.6451 18.6451 19.7516 19.7516 19.8278 19.8278 20.1106 20.1106 22.6032 22.6032 22.9681 22.9681 k = 0.2647 0.2647-0.0000 ( 3141 PWs) bands (ev): -9.8999 -9.8999 -7.6551 -7.6551 -7.6380 -7.6380 -6.3353 -6.3353 -6.0507 -6.0507 -5.5534 -5.5534 -5.3110 -5.3110 -4.7417 -4.7417 1.7784 1.7784 2.6375 2.6375 2.6945 2.6945 4.4472 4.4472 4.8389 4.8389 5.1081 5.1081 5.3469 5.3469 6.5987 6.5987 6.6114 6.6114 7.3072 7.3072 8.5979 8.5979 8.7367 8.7367 9.0400 9.0400 9.2885 9.2885 9.5209 9.5209 9.9983 9.9983 10.0378 10.0378 10.2622 10.2622 10.4970 10.4970 11.1642 11.1642 11.5795 11.5795 12.3709 12.3709 12.4832 12.4832 12.5973 12.5973 18.5695 18.5695 19.7859 19.7859 19.8630 19.8630 20.1502 20.1502 22.6050 22.6050 22.9632 22.9632 k = 0.2549 0.2549-0.0000 ( 3129 PWs) bands (ev): -9.9550 -9.9550 -7.6202 -7.6202 -7.6030 -7.6030 -6.3672 -6.3672 -5.9900 -5.9900 -5.5562 -5.5562 -5.3139 -5.3139 -4.7246 -4.7246 1.7708 1.7708 2.6124 2.6124 2.6823 2.6823 4.4207 4.4207 4.8018 4.8018 5.1021 5.1021 5.3482 5.3482 6.5251 6.5251 6.5914 6.5914 7.3216 7.3216 8.5396 8.5396 8.8290 8.8290 9.0631 9.0631 9.2334 9.2334 9.5424 9.5424 10.0246 10.0246 10.0443 10.0443 10.2885 10.2885 10.4823 10.4823 11.1917 11.1917 11.5606 11.5606 12.3798 12.3798 12.5117 12.5117 12.6202 12.6202 18.4912 18.4912 19.8234 19.8234 19.9007 19.9007 20.1919 20.1919 22.6087 22.6087 22.9580 22.9580 k = 0.2451 0.2451-0.0000 ( 3129 PWs) bands (ev): -10.0082 -10.0082 -7.5843 -7.5843 -7.5671 -7.5671 -6.3983 -6.3983 -5.9330 -5.9330 -5.5588 -5.5588 -5.3178 -5.3178 -4.7084 -4.7084 1.7670 1.7670 2.5885 2.5885 2.6693 2.6693 4.3929 4.3929 4.7657 4.7657 5.0962 5.0962 5.3389 5.3389 6.4425 6.4425 6.5974 6.5974 7.3402 7.3402 8.4801 8.4801 8.9138 8.9138 9.0746 9.0746 9.1806 9.1806 9.5717 9.5717 10.0312 10.0312 10.0700 10.0700 10.3159 10.3159 10.4656 10.4656 11.2197 11.2197 11.5404 11.5404 12.3883 12.3883 12.5397 12.5397 12.6424 12.6424 18.4102 18.4102 19.8643 19.8643 19.9407 19.9407 20.2352 20.2352 22.6141 22.6141 22.9528 22.9528 k = 0.2353 0.2353-0.0000 ( 3141 PWs) bands (ev): -10.0594 -10.0594 -7.5475 -7.5475 -7.5304 -7.5304 -6.4285 -6.4285 -5.8800 -5.8800 -5.5612 -5.5612 -5.3229 -5.3229 -4.6928 -4.6928 1.7671 1.7671 2.5658 2.5658 2.6555 2.6555 4.3654 4.3654 4.7308 4.7308 5.0902 5.0902 5.3178 5.3178 6.3600 6.3600 6.6200 6.6200 7.3624 7.3624 8.4197 8.4197 8.9879 8.9879 9.0773 9.0773 9.1306 9.1306 9.6098 9.6098 10.0258 10.0258 10.1077 10.1077 10.3435 10.3435 10.4473 10.4473 11.2483 11.2483 11.5185 11.5185 12.3964 12.3964 12.5669 12.5669 12.6637 12.6637 18.3269 18.3269 19.9083 19.9083 19.9828 19.9828 20.2802 20.2802 22.6206 22.6206 22.9480 22.9480 k = 0.2255 0.2255-0.0000 ( 3143 PWs) bands (ev): -10.1087 -10.1087 -7.5100 -7.5100 -7.4930 -7.4930 -6.4577 -6.4577 -5.8313 -5.8313 -5.5633 -5.5633 -5.3290 -5.3290 -4.6777 -4.6777 1.7711 1.7711 2.5445 2.5445 2.6408 2.6408 4.3395 4.3395 4.6972 4.6972 5.0838 5.0838 5.2855 5.2855 6.2778 6.2778 6.6573 6.6573 7.3877 7.3877 8.3589 8.3589 9.0361 9.0361 9.0812 9.0812 9.0903 9.0903 9.6567 9.6567 10.0161 10.0161 10.1498 10.1498 10.3705 10.3705 10.4279 10.4279 11.2775 11.2775 11.4946 11.4946 12.4045 12.4045 12.5932 12.5932 12.6840 12.6840 18.2414 18.2414 19.9552 19.9552 20.0270 20.0270 20.3266 20.3266 22.6281 22.6281 22.9442 22.9442 k = 0.2157 0.2157-0.0000 ( 3139 PWs) bands (ev): -10.1559 -10.1559 -7.4717 -7.4717 -7.4550 -7.4550 -6.4860 -6.4860 -5.7871 -5.7871 -5.5651 -5.5651 -5.3364 -5.3364 -4.6632 -4.6632 1.7790 1.7790 2.5247 2.5247 2.6254 2.6254 4.3158 4.3158 4.6649 4.6649 5.0768 5.0768 5.2438 5.2438 6.1962 6.1962 6.7064 6.7064 7.4151 7.4151 8.2978 8.2978 9.0311 9.0311 9.0446 9.0446 9.1309 9.1309 9.7118 9.7118 10.0032 10.0032 10.1944 10.1944 10.3959 10.3959 10.4086 10.4086 11.3072 11.3072 11.4684 11.4684 12.4126 12.4126 12.6184 12.6184 12.7034 12.7034 18.1541 18.1541 20.0049 20.0049 20.0733 20.0733 20.3740 20.3740 22.6362 22.6362 22.9415 22.9415 k = 0.2059 0.2059-0.0000 ( 3139 PWs) bands (ev): -10.2012 -10.2012 -7.4328 -7.4328 -7.4164 -7.4164 -6.5132 -6.5132 -5.7474 -5.7474 -5.5666 -5.5666 -5.3448 -5.3448 -4.6491 -4.6491 1.7907 1.7907 2.5065 2.5065 2.6093 2.6093 4.2949 4.2949 4.6341 4.6341 5.0690 5.0690 5.1948 5.1948 6.1150 6.1150 6.7645 6.7645 7.4436 7.4436 8.2368 8.2368 8.9979 8.9979 9.0221 9.0221 9.1766 9.1766 9.7737 9.7737 9.9876 9.9876 10.2397 10.2397 10.3861 10.3861 10.4237 10.4237 11.3372 11.3372 11.4395 11.4395 12.4212 12.4212 12.6425 12.6425 12.7217 12.7217 18.0652 18.0652 20.0571 20.0571 20.1214 20.1214 20.4223 20.4223 22.6443 22.6443 22.9401 22.9401 k = 0.1961 0.1961-0.0000 ( 3139 PWs) bands (ev): -10.2445 -10.2445 -7.3935 -7.3935 -7.3774 -7.3774 -6.5394 -6.5394 -5.7126 -5.7126 -5.5675 -5.5675 -5.3544 -5.3544 -4.6354 -4.6354 1.8062 1.8062 2.4897 2.4897 2.5927 2.5927 4.2770 4.2770 4.6047 4.6047 5.0594 5.0594 5.1418 5.1418 6.0347 6.0347 6.8287 6.8287 7.4722 7.4722 8.1761 8.1761 8.9649 8.9649 9.0009 9.0009 9.2152 9.2152 9.8407 9.8407 9.9700 9.9700 10.2835 10.2835 10.3654 10.3654 10.4502 10.4502 11.3673 11.3673 11.4078 11.4078 12.4305 12.4305 12.6653 12.6653 12.7389 12.7389 17.9751 17.9751 20.1115 20.1115 20.1713 20.1713 20.4711 20.4711 22.6522 22.6522 22.9400 22.9400 k = 0.1863 0.1863-0.0000 ( 3139 PWs) bands (ev): -10.2858 -10.2858 -7.3537 -7.3537 -7.3382 -7.3382 -6.5646 -6.5646 -5.6828 -5.6828 -5.5679 -5.5679 -5.3651 -5.3651 -4.6220 -4.6220 1.8254 1.8254 2.4746 2.4746 2.5758 2.5758 4.2623 4.2623 4.5767 4.5767 5.0429 5.0429 5.0916 5.0916 5.9552 5.9552 6.8963 6.8963 7.4996 7.4996 8.1161 8.1161 8.9374 8.9374 8.9800 8.9800 9.2467 9.2467 9.9108 9.9108 9.9509 9.9509 10.3233 10.3233 10.3452 10.3452 10.4786 10.4786 11.3725 11.3725 11.3977 11.3977 12.4409 12.4409 12.6867 12.6867 12.7550 12.7550 17.8841 17.8841 20.1679 20.1679 20.2227 20.2227 20.5200 20.5200 22.6595 22.6595 22.9411 22.9411 k = 0.1765 0.1765-0.0000 ( 3135 PWs) bands (ev): -10.3250 -10.3250 -7.3138 -7.3138 -7.2987 -7.2987 -6.5885 -6.5885 -5.6582 -5.6582 -5.5673 -5.5673 -5.3770 -5.3770 -4.6089 -4.6089 1.8482 1.8482 2.4609 2.4609 2.5588 2.5588 4.2507 4.2507 4.5501 4.5501 5.0026 5.0026 5.0628 5.0628 5.8766 5.8766 6.9651 6.9651 7.5247 7.5247 8.0570 8.0570 8.9170 8.9170 8.9609 8.9609 9.2718 9.2718 9.9307 9.9307 9.9822 9.9822 10.3237 10.3237 10.3591 10.3591 10.5103 10.5103 11.3345 11.3345 11.4270 11.4270 12.4529 12.4529 12.7068 12.7068 12.7699 12.7699 17.7927 17.7927 20.2260 20.2260 20.2756 20.2756 20.5686 20.5686 22.6660 22.6660 22.9431 22.9431 k = 0.1667 0.1667-0.0000 ( 3135 PWs) bands (ev): -10.3622 -10.3622 -7.2737 -7.2737 -7.2592 -7.2592 -6.6114 -6.6114 -5.6390 -5.6390 -5.5657 -5.5657 -5.3898 -5.3898 -4.5961 -4.5961 1.8743 1.8743 2.4487 2.4487 2.5417 2.5417 4.2421 4.2421 4.5249 4.5249 4.9450 4.9450 5.0502 5.0502 5.7993 5.7993 7.0330 7.0330 7.5462 7.5462 7.9991 7.9991 8.9044 8.9044 8.9452 8.9452 9.2918 9.2918 9.9100 9.9100 10.0525 10.0525 10.3042 10.3042 10.3875 10.3875 10.5454 10.5454 11.2928 11.2928 11.4554 11.4554 12.4667 12.4667 12.7255 12.7255 12.7836 12.7836 17.7012 17.7012 20.2855 20.2855 20.3297 20.3297 20.6165 20.6165 22.6715 22.6715 22.9454 22.9454 k = 0.1569 0.1569-0.0000 ( 3127 PWs) bands (ev): -10.3973 -10.3973 -7.2337 -7.2337 -7.2198 -7.2198 -6.6331 -6.6331 -5.6252 -5.6252 -5.5629 -5.5629 -5.4036 -5.4036 -4.5835 -4.5835 1.9036 1.9036 2.4379 2.4379 2.5249 2.5249 4.2362 4.2362 4.5010 4.5010 4.8838 4.8838 5.0412 5.0412 5.7234 5.7234 7.0983 7.0983 7.5631 7.5631 7.9427 7.9427 8.9004 8.9004 8.9345 8.9345 9.3077 9.3077 9.8894 9.8894 10.1194 10.1194 10.2851 10.2851 10.4113 10.4113 10.5831 10.5831 11.2477 11.2477 11.4824 11.4824 12.4828 12.4828 12.7427 12.7427 12.7962 12.7962 17.6102 17.6102 20.3460 20.3460 20.3849 20.3849 20.6633 20.6633 22.6760 22.6760 22.9473 22.9473 k = 0.1471 0.1471-0.0000 ( 3131 PWs) bands (ev): -10.4304 -10.4304 -7.1940 -7.1940 -7.1807 -7.1807 -6.6536 -6.6536 -5.6162 -5.6162 -5.5593 -5.5593 -5.4183 -5.4183 -4.5713 -4.5713 1.9357 1.9357 2.4284 2.4284 2.5086 2.5086 4.2329 4.2329 4.4784 4.4784 4.8223 4.8223 5.0333 5.0333 5.6490 5.6490 7.1595 7.1595 7.5746 7.5746 7.8881 7.8881 8.9049 8.9049 8.9302 8.9302 9.3203 9.3203 9.8694 9.8694 10.1797 10.1797 10.2669 10.2669 10.4336 10.4336 10.6217 10.6217 11.1989 11.1989 11.5075 11.5075 12.5016 12.5016 12.7586 12.7586 12.8075 12.8075 17.5200 17.5200 20.4071 20.4071 20.4410 20.4410 20.7087 20.7087 22.6794 22.6794 22.9481 22.9481 k = 0.1373 0.1373-0.0000 ( 3121 PWs) bands (ev): -10.4613 -10.4613 -7.1547 -7.1547 -7.1420 -7.1420 -6.6729 -6.6729 -5.6107 -5.6107 -5.5558 -5.5558 -5.4338 -5.4338 -4.5594 -4.5594 1.9703 1.9703 2.4201 2.4201 2.4928 2.4928 4.2318 4.2318 4.4571 4.4571 4.7619 4.7619 5.0261 5.0261 5.5765 5.5765 7.2152 7.2152 7.5805 7.5805 7.8355 7.8355 8.9163 8.9163 8.9351 8.9351 9.3303 9.3303 9.8505 9.8505 10.2291 10.2291 10.2500 10.2500 10.4587 10.4587 10.6597 10.6597 11.1466 11.1466 11.5302 11.5302 12.5232 12.5232 12.7732 12.7732 12.8177 12.8177 17.4313 17.4313 20.4684 20.4684 20.4978 20.4978 20.7523 20.7523 22.6817 22.6817 22.9470 22.9470 k = 0.1275 0.1275-0.0000 ( 3109 PWs) bands (ev): -10.4902 -10.4902 -7.1161 -7.1161 -7.1041 -7.1041 -6.6909 -6.6909 -5.6077 -5.6077 -5.5535 -5.5535 -5.4499 -5.4499 -4.5479 -4.5479 2.0070 2.0070 2.4130 2.4130 2.4779 2.4779 4.2327 4.2327 4.4368 4.4368 4.7034 4.7034 5.0195 5.0195 5.5062 5.5062 7.2647 7.2647 7.5807 7.5807 7.7852 7.7852 8.9307 8.9307 8.9533 8.9533 9.3383 9.3383 9.8333 9.8333 10.2325 10.2325 10.2658 10.2658 10.4908 10.4908 10.6959 10.6959 11.0907 11.0907 11.5501 11.5501 12.5478 12.5478 12.7864 12.7864 12.8268 12.8268 17.3445 17.3445 20.5295 20.5295 20.5548 20.5548 20.7937 20.7937 22.6829 22.6829 22.9434 22.9434 k = 0.1176 0.1176-0.0000 ( 3109 PWs) bands (ev): -10.5170 -10.5170 -7.0784 -7.0784 -7.0670 -7.0670 -6.7077 -6.7077 -5.6062 -5.6062 -5.5527 -5.5527 -5.4664 -5.4664 -4.5369 -4.5369 2.0453 2.0453 2.4070 2.4070 2.4638 2.4638 4.2351 4.2351 4.4177 4.4177 4.6472 4.6472 5.0133 5.0133 5.4383 5.4383 7.3071 7.3071 7.5757 7.5757 7.7374 7.7374 8.9487 8.9487 8.9835 8.9835 9.3447 9.3447 9.8184 9.8184 10.2173 10.2173 10.2855 10.2855 10.5311 10.5311 10.7296 10.7296 11.0315 11.0315 11.5672 11.5672 12.5751 12.5751 12.7984 12.7984 12.8348 12.8348 17.2602 17.2602 20.5899 20.5899 20.6119 20.6119 20.8326 20.8326 22.6829 22.6829 22.9370 22.9370 k = 0.1078 0.1078-0.0000 ( 3107 PWs) bands (ev): -10.5416 -10.5416 -7.0419 -7.0419 -7.0310 -7.0310 -6.7232 -6.7232 -5.6055 -5.6055 -5.5539 -5.5539 -5.4832 -5.4832 -4.5264 -4.5264 2.0846 2.0846 2.4019 2.4019 2.4507 2.4507 4.2388 4.2388 4.3997 4.3997 4.5940 4.5940 5.0077 5.0077 5.3733 5.3733 7.3424 7.3424 7.5663 7.5663 7.6924 7.6924 8.9729 8.9729 9.0219 9.0219 9.3499 9.3499 9.8066 9.8066 10.2030 10.2030 10.2920 10.2920 10.5773 10.5773 10.7603 10.7603 10.9689 10.9689 11.5813 11.5813 12.6048 12.6048 12.8092 12.8092 12.8418 12.8418 17.1790 17.1790 20.6491 20.6491 20.6686 20.6686 20.8688 20.8688 22.6816 22.6816 22.9277 22.9277 k = 0.0980 0.0980-0.0000 ( 3113 PWs) bands (ev): -10.5642 -10.5642 -7.0069 -7.0069 -6.9965 -6.9965 -6.7374 -6.7374 -5.6053 -5.6053 -5.5569 -5.5569 -5.5001 -5.5001 -4.5166 -4.5166 2.1245 2.1245 2.3976 2.3976 2.4387 2.4387 4.2435 4.2435 4.3826 4.3826 4.5441 4.5441 5.0027 5.0027 5.3116 5.3116 7.3707 7.3707 7.5535 7.5535 7.6505 7.6505 9.0033 9.0033 9.0659 9.0659 9.3542 9.3542 9.7986 9.7986 10.1898 10.1898 10.2888 10.2888 10.6256 10.6256 10.7877 10.7877 10.9033 10.9033 11.5925 11.5925 12.6365 12.6365 12.8187 12.8187 12.8478 12.8478 17.1016 17.1016 20.7068 20.7068 20.7244 20.7244 20.9021 20.9021 22.6789 22.6789 22.9160 22.9160 k = 0.0882 0.0882-0.0000 ( 3113 PWs) bands (ev): -10.5846 -10.5846 -6.9737 -6.9737 -6.9636 -6.9636 -6.7503 -6.7503 -5.6054 -5.6054 -5.5615 -5.5615 -5.5168 -5.5168 -4.5074 -4.5074 2.1641 2.1641 2.3941 2.3941 2.4279 2.4279 4.2487 4.2487 4.3666 4.3666 4.4979 4.4979 4.9982 4.9982 5.2537 5.2537 7.3924 7.3924 7.5383 7.5383 7.6118 7.6118 9.0393 9.0393 9.1133 9.1133 9.3580 9.3580 9.7955 9.7955 10.1777 10.1777 10.2786 10.2786 10.6733 10.6733 10.8108 10.8108 10.8361 10.8361 11.6011 11.6011 12.6692 12.6692 12.8272 12.8272 12.8530 12.8530 17.0285 17.0285 20.7623 20.7623 20.7787 20.7787 20.9324 20.9324 22.6745 22.6745 22.9025 22.9025 k = 0.0784 0.0784-0.0000 ( 3123 PWs) bands (ev): -10.6028 -10.6028 -6.9426 -6.9426 -6.9328 -6.9328 -6.7618 -6.7618 -5.6056 -5.6056 -5.5673 -5.5673 -5.5329 -5.5329 -4.4990 -4.4990 2.2028 2.2028 2.3913 2.3913 2.4183 2.4183 4.2542 4.2542 4.3514 4.3514 4.4558 4.4558 4.9942 4.9942 5.2000 5.2000 7.4083 7.4083 7.5217 7.5217 7.5767 7.5767 9.0794 9.0794 9.1620 9.1620 9.3615 9.3615 9.7986 9.7986 10.1668 10.1668 10.2633 10.2633 10.7184 10.7184 10.7628 10.7628 10.8343 10.8343 11.6074 11.6074 12.7021 12.7021 12.8345 12.8345 12.8574 12.8574 16.9606 16.9606 20.8152 20.8152 20.8307 20.8307 20.9594 20.9594 22.6680 22.6680 22.8881 22.8881 k = 0.0686 0.0686-0.0000 ( 3119 PWs) bands (ev): -10.6190 -10.6190 -6.9141 -6.9141 -6.9043 -6.9043 -6.7720 -6.7720 -5.6060 -5.6060 -5.5739 -5.5739 -5.5483 -5.5483 -4.4915 -4.4915 2.2397 2.2397 2.3890 2.3890 2.4099 2.4099 4.2597 4.2597 4.3373 4.3373 4.4182 4.4182 4.9908 4.9908 5.1510 5.1510 7.4194 7.4194 7.5048 7.5048 7.5453 7.5453 9.1218 9.1218 9.2094 9.2094 9.3650 9.3650 9.8093 9.8093 10.1571 10.1571 10.2443 10.2443 10.6888 10.6888 10.7607 10.7607 10.8521 10.8521 11.6118 11.6118 12.7343 12.7343 12.8408 12.8408 12.8612 12.8612 16.8985 16.8985 20.8649 20.8649 20.8796 20.8796 20.9833 20.9833 22.6595 22.6595 22.8739 22.8739 k = 0.0588 0.0588-0.0000 ( 3121 PWs) bands (ev): -10.6330 -10.6330 -6.8884 -6.8884 -6.8785 -6.8785 -6.7808 -6.7808 -5.6063 -5.6063 -5.5810 -5.5810 -5.5626 -5.5626 -4.4848 -4.4848 2.2742 2.2742 2.3872 2.3872 2.4027 2.4027 4.2647 4.2647 4.3242 4.3242 4.3855 4.3855 4.9879 4.9879 5.1074 5.1074 7.4265 7.4265 7.4884 7.4884 7.5179 7.5179 9.1642 9.1642 9.2535 9.2535 9.3690 9.3690 9.8290 9.8290 10.1487 10.1487 10.2227 10.2227 10.6134 10.6134 10.7979 10.7979 10.8672 10.8672 11.6147 11.6147 12.7645 12.7645 12.8462 12.8462 12.8644 12.8644 16.8428 16.8428 20.9106 20.9106 20.9245 20.9245 21.0039 21.0039 22.6490 22.6490 22.8608 22.8608 k = 0.0490 0.0490-0.0000 ( 3121 PWs) bands (ev): -10.6448 -10.6448 -6.8660 -6.8660 -6.8558 -6.8558 -6.7882 -6.7882 -5.6067 -5.6067 -5.5879 -5.5879 -5.5754 -5.5754 -4.4791 -4.4791 2.3052 2.3052 2.3858 2.3858 2.3967 2.3967 4.2690 4.2690 4.3120 4.3120 4.3583 4.3583 4.9855 4.9855 5.0695 5.0695 7.4304 7.4304 7.4734 7.4734 7.4946 7.4946 9.2038 9.2038 9.2925 9.2925 9.3737 9.3737 9.8589 9.8589 10.1415 10.1415 10.2000 10.2000 10.5364 10.5364 10.8302 10.8302 10.8796 10.8796 11.6164 11.6164 12.7918 12.7918 12.8509 12.8509 12.8671 12.8671 16.7943 16.7943 20.9514 20.9514 20.9647 20.9647 21.0214 21.0214 22.6369 22.6369 22.8496 22.8496 k = 0.0392 0.0392-0.0000 ( 3127 PWs) bands (ev): -10.6545 -10.6545 -6.8472 -6.8472 -6.8367 -6.8367 -6.7941 -6.7941 -5.6070 -5.6070 -5.5943 -5.5943 -5.5865 -5.5865 -4.4744 -4.4744 2.3319 2.3319 2.3847 2.3847 2.3919 2.3919 4.2722 4.2722 4.3008 4.3008 4.3370 4.3370 4.9836 4.9836 5.0379 5.0379 7.4316 7.4316 7.4607 7.4607 7.4757 7.4757 9.2376 9.2376 9.3260 9.3260 9.3792 9.3792 9.8993 9.8993 10.1356 10.1356 10.1774 10.1774 10.4583 10.4583 10.8572 10.8572 10.8895 10.8895 11.6174 11.6174 12.8148 12.8148 12.8553 12.8553 12.8694 12.8694 16.7536 16.7536 20.9864 20.9864 20.9991 20.9991 21.0358 21.0358 22.6241 22.6241 22.8406 22.8406 k = 0.0294 0.0294-0.0000 ( 3121 PWs) bands (ev): -10.6621 -10.6621 -6.8326 -6.8326 -6.8213 -6.8213 -6.7983 -6.7983 -5.6072 -5.6072 -5.5998 -5.5998 -5.5955 -5.5955 -4.4707 -4.4707 2.3537 2.3537 2.3838 2.3838 2.3883 2.3883 4.2740 4.2740 4.2905 4.2905 4.3223 4.3223 4.9821 4.9821 5.0129 5.0129 7.4304 7.4304 7.4513 7.4513 7.4613 7.4613 9.2633 9.2633 9.3539 9.3539 9.3851 9.3851 9.9497 9.9497 10.1310 10.1310 10.1568 10.1568 10.3800 10.3800 10.8785 10.8785 10.8970 10.8970 11.6179 11.6179 12.8320 12.8320 12.8602 12.8602 12.8712 12.8712 16.7213 16.7213 21.0144 21.0144 21.0272 21.0272 21.0474 21.0474 22.6121 22.6121 22.8339 22.8339 k = 0.0196 0.0196-0.0000 ( 3119 PWs) bands (ev): -10.6674 -10.6674 -6.8226 -6.8226 -6.8101 -6.8101 -6.8007 -6.8007 -5.6074 -5.6074 -5.6040 -5.6040 -5.6021 -5.6021 -4.4680 -4.4680 2.3696 2.3696 2.3831 2.3831 2.3860 2.3860 4.2745 4.2745 4.2819 4.2819 4.3137 4.3137 4.9811 4.9811 4.9948 4.9948 7.4273 7.4273 7.4460 7.4460 7.4511 7.4511 9.2801 9.2801 9.3759 9.3759 9.3904 9.3904 10.0085 10.0085 10.1276 10.1276 10.1401 10.1401 10.3021 10.3021 10.8939 10.8939 10.9022 10.9022 11.6180 11.6180 12.8423 12.8423 12.8662 12.8662 12.8725 12.8725 16.6978 16.6978 21.0344 21.0344 21.0479 21.0479 21.0563 21.0563 22.6021 22.6021 22.8293 22.8293 k = 0.0098 0.0098-0.0000 ( 3119 PWs) bands (ev): -10.6707 -10.6707 -6.8174 -6.8174 -6.8033 -6.8033 -6.8012 -6.8012 -5.6075 -5.6075 -5.6067 -5.6067 -5.6062 -5.6062 -4.4664 -4.4664 2.3787 2.3787 2.3832 2.3832 2.3848 2.3848 4.2743 4.2743 4.2761 4.2761 4.3096 4.3096 4.9805 4.9805 4.9839 4.9839 7.4241 7.4241 7.4437 7.4437 7.4451 7.4451 9.2892 9.2892 9.3903 9.3903 9.3941 9.3941 10.0730 10.0730 10.1254 10.1254 10.1293 10.1293 10.2266 10.2266 10.9032 10.9032 10.9053 10.9053 11.6181 11.6181 12.8468 12.8468 12.8715 12.8715 12.8733 12.8733 16.6836 16.6836 21.0457 21.0457 21.0607 21.0607 21.0626 21.0626 22.5955 22.5955 22.8267 22.8267 k = 0.0000 0.0000 0.0000 ( 3119 PWs) bands (ev): -10.6718 -10.6718 -6.8160 -6.8160 -6.8010 -6.8010 -6.8010 -6.8010 -5.6076 -5.6076 -5.6075 -5.6075 -5.6075 -5.6075 -4.4658 -4.4658 2.3805 2.3805 2.3845 2.3845 2.3845 2.3845 4.2741 4.2741 4.2741 4.2741 4.3084 4.3084 4.9803 4.9803 4.9803 4.9803 7.4228 7.4228 7.4431 7.4431 7.4431 7.4431 9.2921 9.2921 9.3954 9.3954 9.3954 9.3954 10.1239 10.1239 10.1239 10.1239 10.1274 10.1274 10.1710 10.1710 10.9063 10.9063 10.9063 10.9063 11.6181 11.6181 12.8481 12.8481 12.8736 12.8736 12.8736 12.8736 16.6788 16.6788 21.0492 21.0492 21.0650 21.0650 21.0650 21.0650 22.5932 22.5932 22.8258 22.8258 k = 0.0000 0.0000 0.0000 ( 3119 PWs) bands (ev): -10.6718 -10.6718 -6.8160 -6.8160 -6.8010 -6.8010 -6.8010 -6.8010 -5.6076 -5.6076 -5.6075 -5.6075 -5.6075 -5.6075 -4.4658 -4.4658 2.3805 2.3805 2.3845 2.3845 2.3845 2.3845 4.2741 4.2741 4.2741 4.2741 4.3084 4.3084 4.9803 4.9803 4.9803 4.9803 7.4228 7.4228 7.4431 7.4431 7.4431 7.4431 9.2921 9.2921 9.3954 9.3954 9.3954 9.3954 10.1239 10.1239 10.1239 10.1239 10.1274 10.1274 10.1710 10.1710 10.9063 10.9063 10.9063 10.9063 11.6181 11.6181 12.8481 12.8481 12.8736 12.8736 12.8736 12.8736 16.6788 16.6788 21.0492 21.0492 21.0650 21.0650 21.0650 21.0650 22.5932 22.5932 22.8258 22.8258 k = 0.0081 0.0081 0.0081 ( 3119 PWs) bands (ev): -10.6707 -10.6707 -6.8173 -6.8173 -6.8023 -6.8023 -6.8023 -6.8023 -5.6069 -5.6069 -5.6068 -5.6068 -5.6066 -5.6066 -4.4664 -4.4664 2.3792 2.3792 2.3827 2.3827 2.3848 2.3848 4.2742 4.2742 4.2762 4.2762 4.3096 4.3096 4.9822 4.9822 4.9822 4.9822 7.4241 7.4241 7.4442 7.4442 7.4446 7.4446 9.2892 9.2892 9.3900 9.3900 9.3944 9.3944 10.0733 10.0733 10.1258 10.1258 10.1280 10.1280 10.2274 10.2274 10.9042 10.9042 10.9042 10.9042 11.6181 11.6181 12.8468 12.8468 12.8714 12.8714 12.8734 12.8734 16.6837 16.6837 21.0457 21.0457 21.0613 21.0613 21.0619 21.0619 22.5955 22.5955 22.8267 22.8267 k = 0.0161 0.0161 0.0161 ( 3119 PWs) bands (ev): -10.6674 -10.6674 -6.8212 -6.8212 -6.8063 -6.8063 -6.8062 -6.8062 -5.6049 -5.6049 -5.6048 -5.6048 -5.6037 -5.6037 -4.4680 -4.4680 2.3742 2.3742 2.3773 2.3773 2.3871 2.3871 4.2741 4.2741 4.2825 4.2825 4.3137 4.3137 4.9880 4.9880 4.9882 4.9882 7.4280 7.4280 7.4474 7.4474 7.4492 7.4492 9.2795 9.2795 9.3752 9.3752 9.3913 9.3913 10.0102 10.0102 10.1312 10.1312 10.1330 10.1330 10.3045 10.3045 10.8980 10.8980 10.8980 10.8980 11.6180 11.6180 12.8420 12.8420 12.8661 12.8661 12.8727 12.8727 16.6981 16.6981 21.0352 21.0352 21.0500 21.0500 21.0528 21.0528 22.6022 22.6022 22.8294 22.8294 k = 0.0242 0.0242 0.0242 ( 3119 PWs) bands (ev): -10.6619 -10.6619 -6.8275 -6.8275 -6.8128 -6.8128 -6.8126 -6.8126 -5.6016 -5.6016 -5.6014 -5.6014 -5.5990 -5.5990 -4.4707 -4.4707 2.3654 2.3654 2.3685 2.3685 2.3915 2.3915 4.2725 4.2725 4.2928 4.2928 4.3219 4.3219 4.9976 4.9976 4.9981 4.9981 7.4341 7.4341 7.4526 7.4526 7.4567 7.4567 9.2598 9.2598 9.3551 9.3551 9.3863 9.3863 9.9534 9.9534 10.1399 10.1399 10.1412 10.1412 10.3839 10.3839 10.8876 10.8876 10.8876 10.8876 11.6176 11.6176 12.8312 12.8312 12.8604 12.8604 12.8714 12.8714 16.7219 16.7219 21.0172 21.0172 21.0317 21.0317 21.0387 21.0387 22.6123 22.6123 22.8341 22.8341 k = 0.0323 0.0323 0.0323 ( 3119 PWs) bands (ev): -10.6543 -10.6543 -6.8362 -6.8362 -6.8218 -6.8218 -6.8214 -6.8214 -5.5972 -5.5972 -5.5970 -5.5970 -5.5927 -5.5927 -4.4745 -4.4745 2.3534 2.3534 2.3567 2.3567 2.3978 2.3978 4.2688 4.2688 4.3069 4.3069 4.3347 4.3347 5.0110 5.0110 5.0118 5.0118 7.4415 7.4415 7.4600 7.4600 7.4672 7.4672 9.2262 9.2262 9.3358 9.3358 9.3799 9.3799 9.9042 9.9042 10.1517 10.1517 10.1523 10.1523 10.4634 10.4634 10.8732 10.8732 10.8732 10.8732 11.6167 11.6167 12.8130 12.8130 12.8561 12.8561 12.8697 12.8697 16.7547 16.7547 20.9921 20.9921 21.0069 21.0069 21.0200 21.0200 22.6243 22.6243 22.8412 22.8412 k = 0.0403 0.0403 0.0403 ( 3122 PWs) bands (ev): -10.6444 -10.6444 -6.8471 -6.8471 -6.8331 -6.8331 -6.8325 -6.8325 -5.5918 -5.5918 -5.5915 -5.5915 -5.5849 -5.5849 -4.4793 -4.4793 2.3387 2.3387 2.3422 2.3422 2.4059 2.4059 4.2632 4.2632 4.3245 4.3245 4.3517 4.3517 5.0280 5.0280 5.0293 5.0293 7.4486 7.4486 7.4701 7.4701 7.4804 7.4804 9.1788 9.1788 9.3203 9.3203 9.3723 9.3723 9.8619 9.8619 10.1659 10.1659 10.1661 10.1661 10.5416 10.5416 10.8549 10.8549 10.8550 10.8550 11.6147 11.6147 12.7888 12.7888 12.8527 12.8527 12.8674 12.8674 16.7960 16.7960 20.9606 20.9606 20.9763 20.9763 20.9969 20.9969 22.6363 22.6363 22.8508 22.8508 k = 0.0484 0.0484 0.0484 ( 3122 PWs) bands (ev): -10.6324 -10.6324 -6.8600 -6.8600 -6.8464 -6.8464 -6.8457 -6.8457 -5.5856 -5.5856 -5.5853 -5.5853 -5.5760 -5.5760 -4.4850 -4.4850 2.3217 2.3217 2.3255 2.3255 2.4157 2.4157 4.2561 4.2561 4.3454 4.3454 4.3725 4.3725 5.0487 5.0487 5.0504 5.0504 7.4533 7.4533 7.4836 7.4836 7.4963 7.4963 9.1220 9.1220 9.3081 9.3081 9.3642 9.3642 9.8253 9.8253 10.1814 10.1814 10.1826 10.1826 10.6176 10.6176 10.8331 10.8331 10.8332 10.8332 11.6111 11.6111 12.7604 12.7604 12.8492 12.8492 12.8646 12.8646 16.8452 16.8452 20.9237 20.9237 20.9405 20.9405 20.9697 20.9697 22.6467 22.6467 22.8633 22.8633 k = 0.0565 0.0565 0.0565 ( 3128 PWs) bands (ev): -10.6182 -10.6182 -6.8748 -6.8748 -6.8617 -6.8617 -6.8607 -6.8607 -5.5789 -5.5789 -5.5785 -5.5785 -5.5661 -5.5661 -4.4917 -4.4917 2.3030 2.3030 2.3071 2.3071 2.4273 2.4273 4.2480 4.2480 4.3691 4.3691 4.3964 4.3964 5.0728 5.0728 5.0750 5.0750 7.4542 7.4542 7.5003 7.5003 7.5146 7.5146 9.0611 9.0611 9.2979 9.2979 9.3558 9.3558 9.7931 9.7931 10.1985 10.1985 10.2006 10.2006 10.6906 10.6906 10.8079 10.8079 10.8081 10.8081 11.6052 11.6052 12.7288 12.7288 12.8454 12.8454 12.8610 12.8610 16.9017 16.9017 20.8822 20.8822 20.9004 20.9004 20.9384 20.9384 22.6537 22.6537 22.8784 22.8784 k = 0.0645 0.0645 0.0645 ( 3122 PWs) bands (ev): -10.6018 -10.6018 -6.8912 -6.8912 -6.8786 -6.8786 -6.8774 -6.8774 -5.5719 -5.5719 -5.5714 -5.5714 -5.5557 -5.5557 -4.4993 -4.4993 2.2831 2.2831 2.2875 2.2875 2.4405 2.4405 4.2391 4.2391 4.3954 4.3954 4.4232 4.4232 5.1002 5.1002 5.1030 5.1030 7.4497 7.4497 7.5196 7.5196 7.5352 7.5352 9.0007 9.0007 9.2893 9.2893 9.3478 9.3478 9.7638 9.7638 10.2164 10.2164 10.2195 10.2195 10.7583 10.7583 10.7796 10.7796 10.7820 10.7820 11.5964 11.5964 12.6955 12.6955 12.8410 12.8410 12.8568 12.8568 16.9647 16.9647 20.8372 20.8372 20.8567 20.8567 20.9035 20.9035 22.6566 22.6566 22.8953 22.8953 k = 0.0726 0.0726 0.0726 ( 3116 PWs) bands (ev): -10.5833 -10.5833 -6.9091 -6.9091 -6.8969 -6.8969 -6.8956 -6.8956 -5.5648 -5.5648 -5.5642 -5.5642 -5.5449 -5.5449 -4.5077 -4.5077 2.2626 2.2626 2.2674 2.2674 2.4553 2.4553 4.2299 4.2299 4.4240 4.4240 4.4523 4.4523 5.1307 5.1307 5.1340 5.1340 7.4383 7.4383 7.5410 7.5410 7.5577 7.5577 8.9446 8.9446 9.2822 9.2822 9.3406 9.3406 9.7364 9.7364 10.2344 10.2344 10.2387 10.2387 10.7479 10.7479 10.7488 10.7488 10.8278 10.8278 11.5838 11.5838 12.6615 12.6615 12.8360 12.8360 12.8519 12.8519 17.0336 17.0336 20.7893 20.7893 20.8102 20.8102 20.8650 20.8650 22.6549 22.6549 22.9130 22.9130 k = 0.0806 0.0806 0.0806 ( 3122 PWs) bands (ev): -10.5625 -10.5625 -6.9282 -6.9282 -6.9165 -6.9165 -6.9151 -6.9151 -5.5579 -5.5579 -5.5573 -5.5573 -5.5342 -5.5342 -4.5169 -4.5169 2.2420 2.2420 2.2472 2.2472 2.4717 2.4717 4.2207 4.2207 4.4545 4.4545 4.4834 4.4834 5.1641 5.1641 5.1679 5.1679 7.4182 7.4182 7.5643 7.5643 7.5820 7.5820 8.8960 8.8960 9.2767 9.2767 9.3346 9.3346 9.7102 9.7102 10.2517 10.2517 10.2571 10.2571 10.7158 10.7158 10.7160 10.7160 10.8896 10.8896 11.5668 11.5668 12.6277 12.6277 12.8302 12.8302 12.8461 12.8461 17.1077 17.1077 20.7391 20.7391 20.7613 20.7613 20.8235 20.8235 22.6490 22.6490 22.9303 22.9303 k = 0.0887 0.0887 0.0887 ( 3116 PWs) bands (ev): -10.5397 -10.5397 -6.9483 -6.9483 -6.9370 -6.9370 -6.9355 -6.9355 -5.5515 -5.5515 -5.5508 -5.5508 -5.5240 -5.5240 -4.5267 -4.5267 2.2218 2.2218 2.2275 2.2275 2.4896 2.4896 4.2118 4.2118 4.4869 4.4869 4.5164 4.5164 5.2001 5.2001 5.2044 5.2044 7.3879 7.3879 7.5889 7.5889 7.6076 7.6076 8.8572 8.8572 9.2731 9.2731 9.3302 9.3302 9.6846 9.6846 10.2672 10.2672 10.2738 10.2738 10.6824 10.6824 10.6826 10.6826 10.9475 10.9475 11.5449 11.5449 12.5952 12.5952 12.8236 12.8236 12.8394 12.8394 17.1862 17.1862 20.6873 20.6873 20.7107 20.7107 20.7792 20.7792 22.6391 22.6391 22.9461 22.9461 k = 0.0968 0.0968 0.0968 ( 3116 PWs) bands (ev): -10.5146 -10.5146 -6.9692 -6.9692 -6.9584 -6.9584 -6.9568 -6.9568 -5.5458 -5.5458 -5.5450 -5.5450 -5.5144 -5.5144 -4.5371 -4.5371 2.2026 2.2026 2.2087 2.2087 2.5089 2.5089 4.2034 4.2034 4.5210 4.5210 4.5511 4.5511 5.2384 5.2384 5.2432 5.2432 7.3466 7.3466 7.6145 7.6145 7.6343 7.6343 8.8297 8.8297 9.2717 9.2717 9.3278 9.3278 9.6594 9.6594 10.2793 10.2793 10.2871 10.2871 10.6492 10.6492 10.6499 10.6499 11.0011 11.0011 11.5178 11.5178 12.5646 12.5646 12.8161 12.8161 12.8318 12.8318 17.2684 17.2684 20.6344 20.6344 20.6588 20.6588 20.7326 20.7326 22.6259 22.6259 22.9597 22.9597 k = 0.1048 0.1048 0.1048 ( 3110 PWs) bands (ev): -10.4875 -10.4875 -6.9907 -6.9907 -6.9803 -6.9803 -6.9787 -6.9787 -5.5409 -5.5409 -5.5401 -5.5401 -5.5059 -5.5059 -4.5480 -4.5480 2.1848 2.1848 2.1912 2.1912 2.5296 2.5296 4.1959 4.1959 4.5565 4.5565 4.5872 4.5872 5.2789 5.2789 5.2842 5.2842 7.2941 7.2941 7.6408 7.6408 7.6618 7.6618 8.8140 8.8140 9.2727 9.2727 9.3277 9.3277 9.6343 9.6343 10.2858 10.2858 10.2950 10.2950 10.6187 10.6187 10.6201 10.6201 11.0501 11.0501 11.4857 11.4857 12.5363 12.5363 12.8076 12.8076 12.8232 12.8232 17.3537 17.3537 20.5807 20.5807 20.6061 20.6061 20.6840 20.6840 22.6100 22.6100 22.9708 22.9708 k = 0.1129 0.1129 0.1129 ( 3110 PWs) bands (ev): -10.4582 -10.4582 -7.0126 -7.0126 -7.0027 -7.0027 -7.0011 -7.0011 -5.5373 -5.5373 -5.5364 -5.5364 -5.4988 -5.4988 -4.5594 -4.5594 2.1688 2.1688 2.1756 2.1756 2.5516 2.5516 4.1894 4.1894 4.5935 4.5935 4.6247 4.6247 5.3213 5.3213 5.3269 5.3269 7.2310 7.2310 7.6674 7.6674 7.6896 7.6896 8.8094 8.8094 9.2763 9.2763 9.3302 9.3302 9.6092 9.6092 10.2842 10.2842 10.2946 10.2946 10.5936 10.5936 10.5955 10.5955 11.0939 11.0939 11.4493 11.4493 12.5102 12.5102 12.7981 12.7981 12.8136 12.8136 17.4414 17.4414 20.5267 20.5267 20.5529 20.5529 20.6338 20.6338 22.5918 22.5918 22.9793 22.9793 k = 0.1210 0.1210 0.1210 ( 3116 PWs) bands (ev): -10.4267 -10.4267 -7.0348 -7.0348 -7.0252 -7.0252 -7.0237 -7.0237 -5.5349 -5.5349 -5.5340 -5.5340 -5.4933 -5.4933 -4.5711 -4.5711 2.1550 2.1550 2.1622 2.1622 2.5748 2.5748 4.1842 4.1842 4.6318 4.6318 4.6635 4.6635 5.3652 5.3652 5.3713 5.3713 7.1587 7.1587 7.6941 7.6941 7.7174 7.7174 8.8147 8.8147 9.2827 9.2827 9.3354 9.3354 9.5843 9.5843 10.2720 10.2720 10.2832 10.2832 10.5766 10.5766 10.5789 10.5789 11.1313 11.1313 11.4106 11.4106 12.4863 12.4863 12.7875 12.7875 12.8028 12.8028 17.5310 17.5310 20.4727 20.4727 20.4997 20.4997 20.5824 20.5824 22.5721 22.5721 22.9851 22.9851 k = 0.1290 0.1290 0.1290 ( 3122 PWs) bands (ev): -10.3932 -10.3932 -7.0571 -7.0571 -7.0479 -7.0479 -7.0465 -7.0465 -5.5341 -5.5341 -5.5332 -5.5332 -5.4897 -5.4897 -4.5832 -4.5832 2.1437 2.1437 2.1513 2.1513 2.5991 2.5991 4.1805 4.1805 4.6714 4.6714 4.7036 4.7036 5.4105 5.4105 5.4170 5.4170 7.0788 7.0788 7.7203 7.7203 7.7450 7.7450 8.8280 8.8280 9.2919 9.2919 9.3433 9.3433 9.5597 9.5597 10.2481 10.2481 10.2597 10.2597 10.5691 10.5691 10.5714 10.5714 11.1590 11.1590 11.3738 11.3738 12.4641 12.4641 12.7758 12.7758 12.7910 12.7910 17.6219 17.6219 20.4189 20.4189 20.4466 20.4466 20.5301 20.5301 22.5515 22.5515 22.9885 22.9885 k = 0.1371 0.1371 0.1371 ( 3128 PWs) bands (ev): -10.3575 -10.3575 -7.0794 -7.0794 -7.0704 -7.0704 -7.0692 -7.0692 -5.5350 -5.5350 -5.5340 -5.5340 -5.4883 -5.4883 -4.5956 -4.5956 2.1352 2.1352 2.1432 2.1432 2.6245 2.6245 4.1784 4.1784 4.7124 4.7124 4.7449 4.7449 5.4569 5.4569 5.4637 5.4637 6.9930 6.9930 7.7460 7.7460 7.7720 7.7720 8.8470 8.8470 9.3037 9.3037 9.3539 9.3539 9.5358 9.5358 10.2137 10.2137 10.2254 10.2254 10.5701 10.5701 10.5720 10.5720 11.1693 11.1693 11.3473 11.3473 12.4431 12.4431 12.7629 12.7629 12.7779 12.7779 17.7135 17.7135 20.3657 20.3657 20.3941 20.3941 20.4775 20.4775 22.5303 22.5303 22.9897 22.9897 k = 0.1452 0.1452 0.1452 ( 3122 PWs) bands (ev): -10.3198 -10.3198 -7.1015 -7.1015 -7.0927 -7.0927 -7.0918 -7.0918 -5.5376 -5.5376 -5.5366 -5.5366 -5.4893 -5.4893 -4.6081 -4.6081 2.1299 2.1299 2.1382 2.1382 2.6509 2.6509 4.1779 4.1779 4.7545 4.7545 4.7875 4.7875 5.5042 5.5042 5.5114 5.5114 6.9030 6.9030 7.7709 7.7709 7.7983 7.7983 8.8695 8.8695 9.3180 9.3180 9.3669 9.3669 9.5131 9.5131 10.1714 10.1714 10.1829 10.1829 10.5771 10.5771 10.5786 10.5786 11.1538 11.1538 11.3409 11.3409 12.4226 12.4226 12.7488 12.7488 12.7637 12.7637 17.8052 17.8052 20.3133 20.3133 20.3422 20.3422 20.4249 20.4249 22.5093 22.5093 22.9890 22.9890 k = 0.1532 0.1532 0.1532 ( 3134 PWs) bands (ev): -10.2799 -10.2799 -7.1234 -7.1234 -7.1147 -7.1147 -7.1140 -7.1140 -5.5422 -5.5422 -5.5412 -5.5412 -5.4929 -5.4929 -4.6210 -4.6210 2.1278 2.1278 2.1365 2.1365 2.6782 2.6782 4.1791 4.1791 4.7980 4.7980 4.8312 4.8312 5.5522 5.5522 5.5598 5.5598 6.8106 6.8106 7.7949 7.7949 7.8235 7.8235 8.8927 8.8927 9.3341 9.3341 9.3819 9.3819 9.4923 9.4923 10.1238 10.1238 10.1350 10.1350 10.5879 10.5879 10.5889 10.5889 11.1158 11.1158 11.3524 11.3524 12.4022 12.4022 12.7334 12.7334 12.7481 12.7481 17.8967 17.8967 20.2619 20.2619 20.2913 20.2913 20.3726 20.3726 22.4887 22.4887 22.9864 22.9864 k = 0.1613 0.1613 0.1613 ( 3128 PWs) bands (ev): -10.2380 -10.2380 -7.1448 -7.1448 -7.1362 -7.1362 -7.1359 -7.1359 -5.5488 -5.5488 -5.5477 -5.5477 -5.4991 -5.4991 -4.6341 -4.6341 2.1293 2.1293 2.1383 2.1383 2.7065 2.7065 4.1821 4.1821 4.8426 4.8426 4.8761 4.8761 5.6007 5.6007 5.6087 5.6087 6.7170 6.7170 7.8177 7.8177 7.8477 7.8477 8.9141 8.9141 9.3512 9.3512 9.3979 9.3979 9.4745 9.4745 10.0733 10.0733 10.0842 10.0842 10.6008 10.6008 10.6015 10.6015 11.0659 11.0659 11.3724 11.3724 12.3812 12.3812 12.7167 12.7167 12.7313 12.7313 17.9875 17.9875 20.2118 20.2118 20.2416 20.2416 20.3211 20.3211 22.4690 22.4690 22.9822 22.9822 k = 0.1694 0.1694 0.1694 ( 3128 PWs) bands (ev): -10.1940 -10.1940 -7.1658 -7.1658 -7.1572 -7.1572 -7.1572 -7.1572 -5.5575 -5.5575 -5.5564 -5.5564 -5.5080 -5.5080 -4.6476 -4.6476 2.1344 2.1344 2.1437 2.1437 2.7355 2.7355 4.1867 4.1867 4.8885 4.8885 4.9222 4.9222 5.6495 5.6495 5.6580 5.6580 6.6236 6.6236 7.8395 7.8395 7.8706 7.8706 8.9308 8.9308 9.3682 9.3682 9.4138 9.4138 9.4608 9.4608 10.0222 10.0222 10.0328 10.0328 10.6146 10.6146 10.6150 10.6150 11.0111 11.0111 11.3952 11.3952 12.3591 12.3591 12.6987 12.6987 12.7131 12.7131 18.0770 18.0770 20.1631 20.1631 20.1933 20.1933 20.2706 20.2706 22.4505 22.4505 22.9765 22.9765 k = 0.1774 0.1774 0.1774 ( 3131 PWs) bands (ev): -10.1480 -10.1480 -7.1862 -7.1862 -7.1779 -7.1779 -7.1775 -7.1775 -5.5683 -5.5683 -5.5672 -5.5672 -5.5198 -5.5198 -4.6616 -4.6616 2.1433 2.1433 2.1529 2.1529 2.7653 2.7653 4.1927 4.1927 4.9356 4.9356 4.9694 4.9694 5.6985 5.6985 5.7076 5.7076 6.5316 6.5316 7.8602 7.8602 7.8925 7.8925 8.9403 8.9403 9.3830 9.3830 9.4276 9.4276 9.4524 9.4524 9.9730 9.9730 9.9834 9.9834 10.6286 10.6286 10.6288 10.6288 10.9549 10.9549 11.4183 11.4183 12.3358 12.3358 12.6794 12.6794 12.6936 12.6936 18.1648 18.1648 20.1161 20.1161 20.1466 20.1466 20.2216 20.2216 22.4335 22.4335 22.9694 22.9694 k = 0.1855 0.1855 0.1855 ( 3131 PWs) bands (ev): -10.1000 -10.1000 -7.2059 -7.2059 -7.1979 -7.1979 -7.1970 -7.1970 -5.5814 -5.5814 -5.5803 -5.5803 -5.5344 -5.5344 -4.6762 -4.6762 2.1560 2.1560 2.1659 2.1659 2.7959 2.7959 4.2001 4.2001 4.9838 4.9838 5.0178 5.0178 5.7475 5.7475 5.7572 5.7572 6.4420 6.4420 7.8800 7.8800 7.9132 7.9132 8.9403 8.9403 9.3932 9.3932 9.4364 9.4364 9.4502 9.4502 9.9285 9.9285 9.9390 9.9390 10.6422 10.6422 10.6424 10.6424 10.8991 10.8991 11.4409 11.4409 12.3108 12.3108 12.6587 12.6587 12.6727 12.6727 18.2507 18.2507 20.0708 20.0708 20.1016 20.1016 20.1744 20.1744 22.4181 22.4181 22.9611 22.9611 k = 0.1935 0.1935 0.1935 ( 3137 PWs) bands (ev): -10.0499 -10.0499 -7.2248 -7.2248 -7.2171 -7.2171 -7.2157 -7.2157 -5.5966 -5.5966 -5.5955 -5.5955 -5.5517 -5.5517 -4.6916 -4.6916 2.1727 2.1727 2.1828 2.1828 2.8271 2.8271 4.2085 4.2085 5.0332 5.0332 5.0673 5.0673 5.7963 5.7963 5.8068 5.8068 6.3557 6.3557 7.8989 7.8989 7.9330 7.9330 8.9296 8.9296 9.3953 9.3953 9.4366 9.4366 9.4542 9.4542 9.8924 9.8924 9.9032 9.9032 10.6551 10.6551 10.6553 10.6553 10.8453 10.8453 11.4624 11.4624 12.2840 12.2840 12.6366 12.6366 12.6504 12.6504 18.3342 18.3342 20.0276 20.0276 20.0585 20.0585 20.1294 20.1294 22.4046 22.4046 22.9516 22.9516 k = 0.2016 0.2016 0.2016 ( 3137 PWs) bands (ev): -9.9979 -9.9979 -7.2428 -7.2428 -7.2354 -7.2354 -7.2335 -7.2335 -5.6140 -5.6140 -5.6129 -5.6129 -5.5717 -5.5717 -4.7079 -4.7079 2.1932 2.1932 2.2036 2.2036 2.8590 2.8590 4.2177 4.2177 5.0837 5.0837 5.1179 5.1179 5.8449 5.8449 5.8562 5.8562 6.2738 6.2738 7.9172 7.9172 7.9519 7.9519 8.9081 8.9081 9.3851 9.3851 9.4244 9.4244 9.4639 9.4639 9.8681 9.8681 9.8798 9.8798 10.6671 10.6671 10.6674 10.6674 10.7943 10.7943 11.4828 11.4828 12.2555 12.2555 12.6131 12.6131 12.6268 12.6268 18.4150 18.4150 19.9865 19.9865 20.0176 20.0176 20.0868 20.0868 22.3931 22.3931 22.9409 22.9409 k = 0.2097 0.2097 0.2097 ( 3131 PWs) bands (ev): -9.9438 -9.9438 -7.2600 -7.2600 -7.2528 -7.2528 -7.2504 -7.2504 -5.6336 -5.6336 -5.6324 -5.6324 -5.5942 -5.5942 -4.7254 -4.7254 2.2177 2.2177 2.2283 2.2283 2.8917 2.8917 4.2272 4.2272 5.1352 5.1352 5.1695 5.1695 5.8930 5.8930 5.9054 5.9054 6.1972 6.1972 7.9350 7.9350 7.9702 7.9702 8.8766 8.8766 9.3605 9.3605 9.3977 9.3977 9.4778 9.4778 9.8577 9.8577 9.8707 9.8707 10.6782 10.6782 10.6785 10.6785 10.7469 10.7469 11.5021 11.5021 12.2251 12.2251 12.5882 12.5882 12.6017 12.6017 18.4928 18.4928 19.9477 19.9477 19.9790 19.9790 20.0469 20.0469 22.3836 22.3836 22.9291 22.9291 k = 0.2177 0.2177 0.2177 ( 3125 PWs) bands (ev): -9.8879 -9.8879 -7.2762 -7.2762 -7.2692 -7.2692 -7.2663 -7.2663 -5.6553 -5.6553 -5.6541 -5.6541 -5.6192 -5.6192 -4.7443 -4.7443 2.2461 2.2461 2.2569 2.2569 2.9249 2.9249 4.2366 4.2366 5.1878 5.1878 5.2221 5.2221 5.9400 5.9400 5.9543 5.9543 6.1270 6.1270 7.9525 7.9525 7.9880 7.9880 8.8361 8.8361 9.3218 9.3218 9.3571 9.3571 9.4939 9.4939 9.8606 9.8606 9.8750 9.8750 10.6874 10.6874 10.6881 10.6881 10.7047 10.7047 11.5202 11.5202 12.1931 12.1931 12.5620 12.5620 12.5752 12.5752 18.5675 18.5675 19.9115 19.9115 19.9429 19.9429 20.0101 20.0101 22.3762 22.3762 22.9162 22.9162 k = 0.2258 0.2258 0.2258 ( 3125 PWs) bands (ev): -9.8300 -9.8300 -7.2914 -7.2914 -7.2846 -7.2846 -7.2811 -7.2811 -5.6791 -5.6791 -5.6778 -5.6778 -5.6465 -5.6465 -4.7648 -4.7648 2.2784 2.2784 2.2893 2.2893 2.9589 2.9589 4.2454 4.2454 5.2413 5.2413 5.2757 5.2757 5.9840 5.9840 6.0026 6.0026 6.0659 6.0659 7.9699 7.9699 8.0055 8.0055 8.7880 8.7880 9.2714 9.2714 9.3052 9.3052 9.5107 9.5107 9.8741 9.8741 9.8897 9.8897 10.6629 10.6629 10.6970 10.6970 10.6989 10.6989 11.5372 11.5372 12.1596 12.1596 12.5343 12.5343 12.5474 12.5474 18.6386 18.6386 19.8779 19.8779 19.9093 19.9093 19.9765 19.9765 22.3709 22.3709 22.9022 22.9022 k = 0.2339 0.2339 0.2339 ( 3128 PWs) bands (ev): -9.7702 -9.7702 -7.3054 -7.3054 -7.2988 -7.2988 -7.2948 -7.2948 -5.7049 -5.7049 -5.7036 -5.7036 -5.6759 -5.6759 -4.7871 -4.7871 2.3144 2.3144 2.3254 2.3254 2.9935 2.9935 4.2533 4.2533 5.2957 5.2957 5.3301 5.3301 5.9924 5.9924 6.0470 6.0470 6.0504 6.0504 7.9874 7.9874 8.0228 8.0228 8.7331 8.7331 9.2125 9.2125 9.2454 9.2454 9.5267 9.5267 9.8949 9.8949 9.9115 9.9115 10.6283 10.6283 10.7047 10.7047 10.7064 10.7064 11.5530 11.5530 12.1248 12.1248 12.5052 12.5052 12.5181 12.5181 18.7062 18.7062 19.8471 19.8471 19.8785 19.8785 19.9465 19.9465 22.3676 22.3676 22.8872 22.8872 k = 0.2419 0.2419 0.2419 ( 3134 PWs) bands (ev): -9.7085 -9.7085 -7.3183 -7.3183 -7.3119 -7.3119 -7.3074 -7.3074 -5.7327 -5.7327 -5.7312 -5.7312 -5.7073 -5.7073 -4.8115 -4.8115 2.3540 2.3540 2.3652 2.3652 3.0288 3.0288 4.2596 4.2596 5.3509 5.3509 5.3852 5.3852 5.9498 5.9498 6.0863 6.0863 6.0975 6.0975 8.0050 8.0050 8.0399 8.0399 8.6723 8.6723 9.1478 9.1478 9.1802 9.1802 9.5411 9.5411 9.9202 9.9202 9.9374 9.9374 10.5972 10.5972 10.7113 10.7113 10.7133 10.7133 11.5678 11.5678 12.0889 12.0889 12.4747 12.4747 12.4874 12.4874 18.7700 18.7700 19.8192 19.8192 19.8506 19.8506 19.9201 19.9201 22.3661 22.3661 22.8711 22.8711 k = 0.2500 0.2500 0.2500 ( 3133 PWs) bands (ev): -9.6449 -9.6449 -7.3301 -7.3301 -7.3238 -7.3238 -7.3188 -7.3188 -5.7623 -5.7623 -5.7607 -5.7607 -5.7404 -5.7404 -4.8381 -4.8381 2.3973 2.3973 2.4086 2.4086 3.0648 3.0648 4.2640 4.2640 5.4068 5.4068 5.4411 5.4411 5.9101 5.9101 6.1301 6.1301 6.1439 6.1439 8.0227 8.0227 8.0570 8.0570 8.6065 8.6065 9.0793 9.0793 9.1117 9.1117 9.5535 9.5535 9.9477 9.9477 9.9653 9.9653 10.5697 10.5697 10.7168 10.7168 10.7191 10.7191 11.5816 11.5816 12.0524 12.0524 12.4428 12.4428 12.4553 12.4553 18.8301 18.8301 19.7944 19.7944 19.8256 19.8256 19.8976 19.8976 22.3665 22.3665 22.8540 22.8540 k = 0.2581 0.2581 0.2581 ( 3133 PWs) bands (ev): -9.5795 -9.5795 -7.3406 -7.3406 -7.3345 -7.3345 -7.3290 -7.3290 -5.7936 -5.7936 -5.7919 -5.7919 -5.7751 -5.7751 -4.8671 -4.8671 2.4439 2.4439 2.4553 2.4553 3.1014 3.1014 4.2661 4.2661 5.4633 5.4633 5.4976 5.4976 5.8783 5.8783 6.1738 6.1738 6.1894 6.1894 8.0405 8.0405 8.0737 8.0737 8.5363 8.5363 9.0088 9.0088 9.0415 9.0415 9.5638 9.5638 9.9758 9.9758 9.9935 9.9935 10.5449 10.5449 10.7213 10.7213 10.7239 10.7239 11.5943 11.5943 12.0155 12.0155 12.4096 12.4096 12.4219 12.4219 18.8865 18.8865 19.7727 19.7727 19.8037 19.8037 19.8790 19.8790 22.3685 22.3685 22.8360 22.8360 k = 0.2661 0.2661 0.2661 ( 3142 PWs) bands (ev): -9.5123 -9.5123 -7.3499 -7.3499 -7.3439 -7.3439 -7.3379 -7.3379 -5.8266 -5.8266 -5.8247 -5.8247 -5.8113 -5.8113 -4.8987 -4.8987 2.4938 2.4938 2.5052 2.5052 3.1388 3.1388 4.2657 4.2657 5.5204 5.5204 5.5545 5.5545 5.8551 5.8551 6.2166 6.2166 6.2339 6.2339 8.0580 8.0580 8.0899 8.0899 8.4622 8.4622 8.9377 8.9377 8.9712 8.9712 9.5720 9.5720 10.0031 10.0031 10.0209 10.0209 10.5222 10.5222 10.7248 10.7248 10.7278 10.7278 11.6059 11.6059 11.9786 11.9786 12.3751 12.3751 12.3871 12.3871 18.9393 18.9393 19.7542 19.7542 19.7850 19.7850 19.8643 19.8643 22.3719 22.3719 22.8169 22.8169 k = 0.2742 0.2742 0.2742 ( 3142 PWs) bands (ev): -9.4434 -9.4434 -7.3578 -7.3578 -7.3519 -7.3519 -7.3456 -7.3456 -5.8612 -5.8612 -5.8590 -5.8590 -5.8486 -5.8486 -4.9331 -4.9331 2.5469 2.5469 2.5583 2.5583 3.1769 3.1769 4.2628 4.2628 5.5778 5.5778 5.6118 5.6118 5.8407 5.8407 6.2584 6.2584 6.2774 6.2774 8.0746 8.0746 8.1048 8.1048 8.3848 8.3848 8.8675 8.8675 8.9020 8.9020 9.5783 9.5783 10.0289 10.0289 10.0466 10.0466 10.5007 10.5007 10.7274 10.7274 10.7307 10.7307 11.6164 11.6164 11.9420 11.9420 12.3392 12.3392 12.3511 12.3511 18.9888 18.9888 19.7391 19.7391 19.7695 19.7695 19.8535 19.8535 22.3766 22.3766 22.7971 22.7971 k = 0.2823 0.2823 0.2823 ( 3136 PWs) bands (ev): -9.3727 -9.3727 -7.3645 -7.3645 -7.3587 -7.3587 -7.3520 -7.3520 -5.8972 -5.8972 -5.8946 -5.8946 -5.8870 -5.8870 -4.9703 -4.9703 2.6028 2.6028 2.6142 2.6142 3.2157 3.2157 4.2575 4.2575 5.6355 5.6355 5.6693 5.6693 5.8348 5.8348 6.2990 6.2990 6.3198 6.3198 8.0893 8.0893 8.1174 8.1174 8.3046 8.3046 8.7999 8.7999 8.8359 8.8359 9.5832 9.5832 10.0524 10.0524 10.0700 10.0700 10.4797 10.4797 10.7291 10.7291 10.7327 10.7327 11.6256 11.6256 11.9062 11.9062 12.3022 12.3022 12.3138 12.3138 19.0353 19.0353 19.7272 19.7272 19.7573 19.7573 19.8464 19.8464 22.3822 22.3822 22.7765 22.7765 k = 0.2903 0.2903 0.2903 ( 3136 PWs) bands (ev): -9.3003 -9.3003 -7.3698 -7.3698 -7.3641 -7.3641 -7.3570 -7.3570 -5.9347 -5.9347 -5.9315 -5.9315 -5.9262 -5.9262 -5.0105 -5.0105 2.6615 2.6615 2.6729 2.6729 3.2551 3.2551 4.2500 4.2500 5.6933 5.6933 5.7267 5.7267 5.8372 5.8372 6.3384 6.3384 6.3609 6.3609 8.1003 8.1003 8.1261 8.1261 8.2222 8.2222 8.7371 8.7371 8.7749 8.7749 9.5870 9.5870 10.0731 10.0731 10.0905 10.0905 10.4583 10.4583 10.7298 10.7298 10.7337 10.7337 11.6334 11.6334 11.8714 11.8714 12.2640 12.2640 12.2753 12.2753 19.0791 19.0791 19.7186 19.7186 19.7483 19.7483 19.8428 19.8428 22.3886 22.3886 22.7552 22.7552 k = 0.2984 0.2984 0.2984 ( 3124 PWs) bands (ev): -9.2262 -9.2262 -7.3737 -7.3737 -7.3681 -7.3681 -7.3608 -7.3608 -5.9735 -5.9735 -5.9695 -5.9695 -5.9660 -5.9660 -5.0537 -5.0537 2.7228 2.7228 2.7341 2.7341 3.2953 3.2953 4.2407 4.2407 5.7511 5.7511 5.7837 5.7837 5.8476 5.8476 6.3764 6.3764 6.4008 6.4008 8.1044 8.1044 8.1284 8.1284 8.1387 8.1387 8.6821 8.6821 8.7219 8.7219 9.5901 9.5901 10.0907 10.0907 10.1079 10.1079 10.4359 10.4359 10.7295 10.7295 10.7336 10.7336 11.6397 11.6397 11.8380 11.8380 12.2247 12.2247 12.2358 12.2358 19.1207 19.1207 19.7134 19.7134 19.7426 19.7426 19.8424 19.8424 22.3954 22.3954 22.7335 22.7335 k = 0.3065 0.3065 0.3065 ( 3124 PWs) bands (ev): -9.1505 -9.1505 -7.3762 -7.3762 -7.3708 -7.3708 -7.3632 -7.3632 -6.0136 -6.0136 -6.0086 -6.0086 -6.0063 -6.0063 -5.1001 -5.1001 2.7864 2.7864 2.7975 2.7975 3.3360 3.3360 4.2300 4.2300 5.8087 5.8087 5.8383 5.8383 5.8668 5.8668 6.4131 6.4131 6.4394 6.4394 8.0507 8.0507 8.1021 8.1021 8.1214 8.1214 8.6387 8.6387 8.6802 8.6802 9.5929 9.5929 10.1050 10.1050 10.1219 10.1219 10.4121 10.4121 10.7280 10.7280 10.7323 10.7323 11.6440 11.6440 11.8063 11.8063 12.1844 12.1844 12.1952 12.1952 19.1607 19.1607 19.7114 19.7114 19.7400 19.7400 19.8448 19.8448 22.4023 22.4023 22.7114 22.7114 k = 0.3145 0.3145 0.3145 ( 3127 PWs) bands (ev): -9.0733 -9.0733 -7.3774 -7.3774 -7.3720 -7.3720 -7.3642 -7.3642 -6.0547 -6.0547 -6.0484 -6.0484 -6.0470 -6.0470 -5.1495 -5.1495 2.8520 2.8520 2.8631 2.8631 3.3774 3.3774 4.2183 4.2183 5.8660 5.8660 5.8792 5.8792 5.9054 5.9054 6.4484 6.4484 6.4766 6.4766 7.9643 7.9643 8.0846 8.0846 8.1023 8.1023 8.6103 8.6103 8.6529 8.6529 9.5957 9.5957 10.1160 10.1160 10.1325 10.1325 10.3865 10.3865 10.7253 10.7253 10.7297 10.7297 11.6461 11.6461 11.7769 11.7769 12.1432 12.1432 12.1538 12.1538 19.1994 19.1994 19.7125 19.7125 19.7404 19.7404 19.8495 19.8495 22.4091 22.4091 22.6893 22.6893 k = 0.3226 0.3226 0.3226 ( 3139 PWs) bands (ev): -8.9944 -8.9944 -7.3771 -7.3771 -7.3719 -7.3719 -7.3639 -7.3639 -6.0965 -6.0965 -6.0890 -6.0890 -6.0881 -6.0881 -5.2021 -5.2021 2.9196 2.9196 2.9305 2.9305 3.4193 3.4193 4.2062 4.2062 5.9096 5.9096 5.9226 5.9226 5.9590 5.9590 6.4823 6.4823 6.5125 6.5125 7.8769 7.8769 8.0528 8.0528 8.0697 8.0697 8.5991 8.5991 8.6418 8.6418 9.5988 9.5988 10.1236 10.1236 10.1397 10.1397 10.3589 10.3589 10.7210 10.7210 10.7255 10.7255 11.6453 11.6453 11.7501 11.7501 12.1012 12.1012 12.1115 12.1115 19.2375 19.2375 19.7165 19.7165 19.7438 19.7438 19.8562 19.8562 22.4155 22.4155 22.6673 22.6673 k = 0.3306 0.3306 0.3306 ( 3145 PWs) bands (ev): -8.9141 -8.9141 -7.3754 -7.3754 -7.3703 -7.3703 -7.3622 -7.3622 -6.1388 -6.1388 -6.1302 -6.1302 -6.1297 -6.1297 -5.2578 -5.2578 2.9887 2.9887 2.9994 2.9994 3.4616 3.4616 4.1941 4.1941 5.9422 5.9422 5.9784 5.9784 6.0139 6.0139 6.5148 6.5148 6.5470 6.5470 7.7892 7.7892 8.0076 8.0076 8.0245 8.0245 8.6044 8.6044 8.6461 8.6461 9.6024 9.6024 10.1280 10.1280 10.1438 10.1438 10.3295 10.3295 10.7150 10.7150 10.7195 10.7195 11.6412 11.6412 11.7266 11.7266 12.0585 12.0585 12.0686 12.0686 19.2755 19.2755 19.7235 19.7235 19.7499 19.7499 19.8645 19.8645 22.4211 22.4211 22.6459 22.6459 k = 0.3387 0.3387 0.3387 ( 3145 PWs) bands (ev): -8.8324 -8.8324 -7.3723 -7.3723 -7.3672 -7.3672 -7.3591 -7.3591 -6.1815 -6.1815 -6.1719 -6.1719 -6.1716 -6.1716 -5.3165 -5.3165 3.0592 3.0592 3.0697 3.0697 3.5044 3.5044 4.1824 4.1824 5.9778 5.9778 6.0333 6.0333 6.0682 6.0682 6.5459 6.5459 6.5801 6.5801 7.7016 7.7016 7.9515 7.9515 7.9692 7.9692 8.6237 8.6237 8.6636 8.6636 9.6067 9.6067 10.1295 10.1295 10.1448 10.1448 10.2982 10.2982 10.7071 10.7071 10.7114 10.7114 11.6329 11.6329 11.7069 11.7069 12.0154 12.0154 12.0251 12.0251 19.3137 19.3137 19.7331 19.7331 19.7586 19.7586 19.8739 19.8739 22.4256 22.4256 22.6252 22.6252 k = 0.3468 0.3468 0.3468 ( 3139 PWs) bands (ev): -8.7492 -8.7492 -7.3678 -7.3678 -7.3628 -7.3628 -7.3547 -7.3547 -6.2243 -6.2243 -6.2139 -6.2139 -6.2138 -6.2138 -5.3783 -5.3783 3.1308 3.1308 3.1410 3.1410 3.5474 3.5474 4.1714 4.1714 6.0161 6.0161 6.0868 6.0868 6.1214 6.1214 6.5759 6.5759 6.6119 6.6119 7.6145 7.6145 7.8879 7.8879 7.9067 7.9067 8.6539 8.6539 8.6917 8.6917 9.6119 9.6119 10.1282 10.1282 10.1431 10.1431 10.2652 10.2652 10.6968 10.6968 10.7011 10.7011 11.6206 11.6206 11.6910 11.6910 11.9720 11.9720 11.9814 11.9814 19.3526 19.3526 19.7451 19.7451 19.7697 19.7697 19.8842 19.8842 22.4287 22.4287 22.6058 22.6058 k = 0.3548 0.3548 0.3548 ( 3136 PWs) bands (ev): -8.6647 -8.6647 -7.3619 -7.3619 -7.3569 -7.3569 -7.3488 -7.3488 -6.2671 -6.2671 -6.2563 -6.2563 -6.2562 -6.2562 -5.4430 -5.4430 3.2032 3.2032 3.2130 3.2130 3.5906 3.5906 4.1614 4.1614 6.0562 6.0562 6.1388 6.1388 6.1729 6.1729 6.6046 6.6046 6.6425 6.6425 7.5283 7.5283 7.8193 7.8193 7.8393 7.8393 8.6925 8.6925 8.7281 8.7281 9.6181 9.6181 10.1245 10.1245 10.1389 10.1389 10.2310 10.2310 10.6840 10.6840 10.6881 10.6881 11.6053 11.6053 11.6775 11.6775 11.9285 11.9285 11.9375 11.9375 19.3923 19.3923 19.7593 19.7593 19.7828 19.7828 19.8951 19.8951 22.4300 22.4300 22.5880 22.5880 k = 0.3629 0.3629 0.3629 ( 3136 PWs) bands (ev): -8.5789 -8.5789 -7.3545 -7.3545 -7.3496 -7.3496 -7.3417 -7.3417 -6.3098 -6.3098 -6.2987 -6.2987 -6.2986 -6.2986 -5.5106 -5.5106 3.2760 3.2760 3.2855 3.2855 3.6338 3.6338 4.1526 4.1526 6.0976 6.0976 6.1890 6.1890 6.2226 6.2226 6.6323 6.6323 6.6718 6.6718 7.4432 7.4432 7.7478 7.7478 7.7691 7.7691 8.7375 8.7375 8.7710 8.7710 9.6252 9.6252 10.1187 10.1187 10.1326 10.1326 10.1958 10.1958 10.6685 10.6685 10.6723 10.6723 11.5886 11.5886 11.6650 11.6650 11.8851 11.8851 11.8938 11.8938 19.4331 19.4331 19.7753 19.7753 19.7977 19.7977 19.9062 19.9062 22.4293 22.4293 22.5722 22.5722 k = 0.3710 0.3710 0.3710 ( 3133 PWs) bands (ev): -8.4919 -8.4919 -7.3458 -7.3458 -7.3409 -7.3409 -7.3332 -7.3332 -6.3524 -6.3524 -6.3412 -6.3412 -6.3409 -6.3409 -5.5810 -5.5810 3.3489 3.3489 3.3581 3.3581 3.6770 3.6770 4.1449 4.1449 6.1396 6.1396 6.2370 6.2370 6.2700 6.2700 6.6590 6.6590 6.6999 6.6999 7.3597 7.3597 7.6749 7.6749 7.6974 7.6974 8.7879 8.7879 8.8192 8.8192 9.6334 9.6334 10.1109 10.1109 10.1246 10.1246 10.1603 10.1603 10.6499 10.6499 10.6534 10.6534 11.5716 11.5716 11.6522 11.6522 11.8420 11.8420 11.8503 11.8503 19.4750 19.4750 19.7928 19.7928 19.8140 19.8140 19.9173 19.9173 22.4263 22.4263 22.5588 22.5588 k = 0.3790 0.3790 0.3790 ( 3139 PWs) bands (ev): -8.4037 -8.4037 -7.3356 -7.3356 -7.3308 -7.3308 -7.3233 -7.3233 -6.3946 -6.3946 -6.3835 -6.3835 -6.3831 -6.3831 -5.6540 -5.6540 3.4216 3.4216 3.4304 3.4304 3.7198 3.7198 4.1386 4.1386 6.1816 6.1816 6.2826 6.2826 6.3147 6.3147 6.6850 6.6850 6.7270 6.7270 7.2780 7.2780 7.6016 7.6016 7.6253 7.6253 8.8424 8.8424 8.8717 8.8717 9.6427 9.6427 10.1010 10.1010 10.1151 10.1151 10.1251 10.1251 10.6282 10.6282 10.6313 10.6313 11.5549 11.5549 11.6386 11.6386 11.7996 11.7996 11.8075 11.8075 19.5179 19.5179 19.8116 19.8116 19.8315 19.8315 19.9283 19.9283 22.4212 22.4212 22.5478 22.5478 k = 0.3871 0.3871 0.3871 ( 3139 PWs) bands (ev): -8.3145 -8.3145 -7.3242 -7.3242 -7.3194 -7.3194 -7.3121 -7.3121 -6.4364 -6.4364 -6.4255 -6.4255 -6.4251 -6.4251 -5.7295 -5.7295 3.4937 3.4937 3.5020 3.5020 3.7622 3.7622 4.1337 4.1337 6.2232 6.2232 6.3254 6.3254 6.3565 6.3565 6.7102 6.7102 6.7531 6.7531 7.1987 7.1987 7.5290 7.5290 7.5539 7.5539 8.9006 8.9006 8.9279 8.9279 9.6530 9.6530 10.0833 10.0833 10.0969 10.0969 10.1046 10.1046 10.6031 10.6031 10.6058 10.6058 11.5390 11.5390 11.6239 11.6239 11.7581 11.7581 11.7656 11.7656 19.5619 19.5619 19.8311 19.8311 19.8497 19.8497 19.9391 19.9391 22.4141 22.4141 22.5391 22.5391 k = 0.3952 0.3952 0.3952 ( 3151 PWs) bands (ev): -8.2243 -8.2243 -7.3113 -7.3113 -7.3066 -7.3066 -7.2997 -7.2997 -6.4776 -6.4776 -6.4671 -6.4671 -6.4666 -6.4666 -5.8073 -5.8073 3.5647 3.5647 3.5726 3.5726 3.8039 3.8039 4.1299 4.1299 6.2637 6.2637 6.3652 6.3652 6.3948 6.3948 6.7348 6.7348 6.7782 6.7782 7.1220 7.1220 7.4577 7.4577 7.4837 7.4837 8.9617 8.9617 8.9872 8.9872 9.6642 9.6642 10.0510 10.0510 10.0831 10.0831 10.0932 10.0932 10.5746 10.5746 10.5768 10.5768 11.5239 11.5239 11.6079 11.6079 11.7178 11.7178 11.7249 11.7249 19.6066 19.6066 19.8511 19.8511 19.8684 19.8684 19.9494 19.9494 22.4057 22.4057 22.5323 22.5323 k = 0.4032 0.4032 0.4032 ( 3145 PWs) bands (ev): -8.1331 -8.1331 -7.2973 -7.2973 -7.2925 -7.2925 -7.2860 -7.2860 -6.5182 -6.5182 -6.5082 -6.5082 -6.5077 -6.5077 -5.8874 -5.8874 3.6342 3.6342 3.6416 3.6416 3.8446 3.8446 4.1274 4.1274 6.3029 6.3029 6.4015 6.4015 6.4295 6.4295 6.7588 6.7588 6.8024 6.8024 7.0485 7.0485 7.3885 7.3885 7.4157 7.4157 9.0254 9.0254 9.0491 9.0491 9.6762 9.6762 10.0174 10.0174 10.0712 10.0712 10.0814 10.0814 10.5426 10.5426 10.5443 10.5443 11.5099 11.5099 11.5908 11.5908 11.6790 11.6790 11.6856 11.6856 19.6518 19.6518 19.8713 19.8713 19.8871 19.8871 19.9592 19.9592 22.3965 22.3965 22.5269 22.5269 k = 0.4113 0.4113 0.4113 ( 3142 PWs) bands (ev): -8.0411 -8.0411 -7.2819 -7.2819 -7.2772 -7.2772 -7.2711 -7.2711 -6.5581 -6.5581 -6.5487 -6.5487 -6.5481 -6.5481 -5.9695 -5.9695 3.7017 3.7017 3.7086 3.7086 3.8841 3.8841 4.1260 4.1260 6.3401 6.3401 6.4341 6.4341 6.4601 6.4601 6.7820 6.7820 6.8256 6.8256 6.9786 6.9786 7.3221 7.3221 7.3504 7.3504 9.0913 9.0913 9.1133 9.1133 9.6888 9.6888 9.9849 9.9849 10.0595 10.0595 10.0693 10.0693 10.5070 10.5070 10.5081 10.5081 11.4969 11.4969 11.5728 11.5728 11.6420 11.6420 11.6482 11.6482 19.6970 19.6970 19.8912 19.8912 19.9057 19.9057 19.9685 19.9685 22.3870 22.3870 22.5226 22.5226 k = 0.4194 0.4194 0.4194 ( 3136 PWs) bands (ev): -7.9484 -7.9484 -7.2655 -7.2655 -7.2607 -7.2607 -7.2552 -7.2552 -6.5971 -6.5971 -6.5884 -6.5884 -6.5878 -6.5878 -6.0534 -6.0534 3.7667 3.7667 3.7730 3.7730 3.9220 3.9220 4.1254 4.1254 6.3752 6.3752 6.4627 6.4627 6.4864 6.4864 6.8038 6.8038 6.8477 6.8477 6.9134 6.9134 7.2593 7.2593 7.2887 7.2887 9.1590 9.1590 9.1794 9.1794 9.7019 9.7019 9.9540 9.9540 10.0478 10.0478 10.0574 10.0574 10.4679 10.4679 10.4683 10.4683 11.4851 11.4851 11.5542 11.5542 11.6072 11.6072 11.6129 11.6129 19.7419 19.7419 19.9105 19.9105 19.9236 19.9236 19.9771 19.9771 22.3775 22.3775 22.5189 22.5189 k = 0.4274 0.4274 0.4274 ( 3130 PWs) bands (ev): -7.8551 -7.8551 -7.2480 -7.2480 -7.2431 -7.2431 -7.2382 -7.2382 -6.6350 -6.6350 -6.6271 -6.6271 -6.6265 -6.6265 -6.1391 -6.1391 3.8285 3.8285 3.8342 3.8342 3.9580 3.9580 4.1256 4.1256 6.4078 6.4078 6.4872 6.4872 6.5084 6.5084 6.8183 6.8183 6.8590 6.8590 6.8687 6.8687 7.2006 7.2006 7.2313 7.2313 9.2280 9.2280 9.2469 9.2469 9.7151 9.7151 9.9251 9.9251 10.0365 10.0365 10.0457 10.0457 10.4251 10.4251 10.4254 10.4254 11.4743 11.4743 11.5354 11.5354 11.5748 11.5748 11.5800 11.5800 19.7857 19.7857 19.9289 19.9289 19.9408 19.9408 19.9850 19.9850 22.3682 22.3682 22.5159 22.5159 k = 0.4355 0.4355 0.4355 ( 3136 PWs) bands (ev): -7.7614 -7.7614 -7.2296 -7.2296 -7.2246 -7.2246 -7.2203 -7.2203 -6.6717 -6.6717 -6.6647 -6.6647 -6.6641 -6.6641 -6.2262 -6.2262 3.8865 3.8865 3.8917 3.8917 3.9918 3.9918 4.1264 4.1264 6.4376 6.4376 6.5075 6.5075 6.5259 6.5259 6.7854 6.7854 6.8557 6.8557 6.8881 6.8881 7.1469 7.1469 7.1789 7.1789 9.2981 9.2981 9.3156 9.3156 9.7283 9.7283 9.8985 9.8985 10.0257 10.0257 10.0346 10.0346 10.3784 10.3784 10.3795 10.3795 11.4646 11.4646 11.5168 11.5168 11.5450 11.5450 11.5498 11.5498 19.8279 19.8279 19.9461 19.9461 19.9567 19.9567 19.9922 19.9922 22.3593 22.3593 22.5132 22.5132 k = 0.4435 0.4435 0.4435 ( 3139 PWs) bands (ev): -7.6674 -7.6674 -7.2105 -7.2105 -7.2053 -7.2053 -7.2016 -7.2016 -6.7070 -6.7070 -6.7009 -6.7009 -6.7003 -6.7003 -6.3145 -6.3145 3.9401 3.9401 3.9447 3.9447 4.0230 4.0230 4.1276 4.1276 6.4643 6.4643 6.5235 6.5235 6.5391 6.5391 6.7356 6.7356 6.8732 6.8732 6.9058 6.9058 7.0988 7.0988 7.1323 7.1323 9.3690 9.3690 9.3851 9.3851 9.7411 9.7411 9.8746 9.8746 10.0156 10.0156 10.0242 10.0242 10.3286 10.3286 10.3304 10.3304 11.4561 11.4561 11.4987 11.4987 11.5183 11.5183 11.5225 11.5225 19.8678 19.8678 19.9619 19.9619 19.9714 19.9714 19.9987 19.9987 22.3506 22.3506 22.5108 22.5108 k = 0.4516 0.4516 0.4516 ( 3139 PWs) bands (ev): -7.5733 -7.5733 -7.1909 -7.1909 -7.1856 -7.1856 -7.1826 -7.1826 -6.7404 -6.7404 -6.7354 -6.7354 -6.7348 -6.7348 -6.4038 -6.4038 3.9885 3.9885 3.9926 3.9926 4.0511 4.0511 4.1291 4.1291 6.4878 6.4878 6.5354 6.5354 6.5483 6.5483 6.6898 6.6898 6.8908 6.8908 6.9212 6.9212 7.0570 7.0570 7.0923 7.0923 9.4400 9.4400 9.4548 9.4548 9.7532 9.7532 9.8534 9.8534 10.0065 10.0065 10.0148 10.0148 10.2758 10.2758 10.2785 10.2785 11.4486 11.4486 11.4817 11.4817 11.4947 11.4947 11.4984 11.4984 19.9046 19.9046 19.9759 19.9759 19.9844 19.9844 20.0044 20.0044 22.3422 22.3422 22.5083 22.5083 k = 0.4597 0.4597 0.4597 ( 3139 PWs) bands (ev): -7.4795 -7.4795 -7.1714 -7.1714 -7.1657 -7.1657 -7.1634 -7.1634 -6.7718 -6.7718 -6.7677 -6.7677 -6.7672 -6.7672 -6.4936 -6.4936 4.0311 4.0311 4.0347 4.0347 4.0758 4.0758 4.1306 4.1306 6.5079 6.5079 6.5435 6.5435 6.5539 6.5539 6.6497 6.6497 6.9066 6.9066 6.9338 6.9338 7.0219 7.0219 7.0597 7.0597 9.5109 9.5109 9.5245 9.5245 9.7641 9.7641 9.8352 9.8352 9.9985 9.9985 10.0066 10.0066 10.2206 10.2206 10.2242 10.2242 11.4423 11.4423 11.4663 11.4663 11.4745 11.4745 11.4777 11.4777 19.9375 19.9375 19.9881 19.9881 19.9957 19.9957 20.0093 20.0093 22.3340 22.3340 22.5062 22.5062 k = 0.4677 0.4677 0.4677 ( 3139 PWs) bands (ev): -7.3866 -7.3866 -7.1525 -7.1525 -7.1464 -7.1464 -7.1448 -7.1448 -6.8003 -6.8003 -6.7973 -6.7973 -6.7969 -6.7969 -6.5833 -6.5833 4.0671 4.0671 4.0702 4.0702 4.0967 4.0967 4.1321 4.1321 6.5244 6.5244 6.5485 6.5485 6.5565 6.5565 6.6161 6.6161 6.9202 6.9202 6.9427 6.9427 6.9937 6.9937 7.0352 7.0352 9.5808 9.5808 9.5932 9.5932 9.7736 9.7736 9.8202 9.8202 9.9918 9.9918 9.9995 9.9995 10.1635 10.1635 10.1680 10.1680 11.4370 11.4370 11.4528 11.4528 11.4581 11.4581 11.4606 11.4606 19.9656 19.9656 19.9983 19.9983 20.0052 20.0052 20.0135 20.0135 22.3261 22.3261 22.5049 22.5049 k = 0.4758 0.4758 0.4758 ( 3133 PWs) bands (ev): -7.2958 -7.2958 -7.1352 -7.1352 -7.1285 -7.1285 -7.1275 -7.1275 -6.8250 -6.8250 -6.8231 -6.8231 -6.8228 -6.8228 -6.6718 -6.6718 4.0958 4.0958 4.0987 4.0987 4.1133 4.1133 4.1335 4.1335 6.5373 6.5373 6.5511 6.5511 6.5571 6.5571 6.5895 6.5895 6.9312 6.9312 6.9472 6.9472 6.9722 6.9722 7.0193 7.0193 9.6485 9.6485 9.6600 9.6600 9.7813 9.7813 9.8086 9.8086 9.9864 9.9864 9.9939 9.9939 10.1056 10.1056 10.1112 10.1112 11.4326 11.4326 11.4417 11.4417 11.4454 11.4454 11.4471 11.4471 19.9881 19.9881 20.0065 20.0065 20.0126 20.0126 20.0170 20.0170 22.3189 22.3189 22.5041 22.5042 k = 0.4839 0.4839 0.4839 ( 3127 PWs) bands (ev): -7.2096 -7.2096 -7.1207 -7.1207 -7.1135 -7.1135 -7.1130 -7.1130 -6.8447 -6.8447 -6.8437 -6.8437 -6.8436 -6.8436 -6.7563 -6.7563 4.1167 4.1167 4.1194 4.1194 4.1256 4.1256 4.1346 4.1346 6.5463 6.5463 6.5521 6.5521 6.5565 6.5565 6.5706 6.5706 6.9392 6.9392 6.9477 6.9477 6.9573 6.9573 7.0111 7.0111 9.7116 9.7116 9.7223 9.7223 9.7868 9.7868 9.8008 9.8008 9.9825 9.9825 9.9895 9.9895 10.0493 10.0493 10.0562 10.0562 11.4287 11.4287 11.4341 11.4341 11.4366 11.4366 11.4374 11.4374 20.0035 20.0035 20.0133 20.0133 20.0181 20.0181 20.0198 20.0198 22.3130 22.3130 22.5037 22.5037 k = 0.4919 0.4919 0.4919 ( 3112 PWs) bands (ev): -7.1369 -7.1369 -7.1103 -7.1103 -7.1032 -7.1032 -7.1031 -7.1031 -6.8576 -6.8576 -6.8574 -6.8574 -6.8573 -6.8573 -6.8286 -6.8286 4.1287 4.1287 4.1321 4.1321 4.1333 4.1333 4.1356 4.1356 6.5511 6.5511 6.5523 6.5523 6.5546 6.5546 6.5609 6.5609 6.9441 6.9441 6.9464 6.9464 6.9486 6.9486 7.0081 7.0081 9.7623 9.7623 9.7737 9.7737 9.7906 9.7906 9.7972 9.7972 9.9801 9.9801 9.9854 9.9854 10.0012 10.0012 10.0106 10.0106 11.4252 11.4252 11.4305 11.4305 11.4313 11.4313 11.4316 11.4316 20.0106 20.0106 20.0197 20.0197 20.0214 20.0214 20.0218 20.0218 22.3092 22.3092 22.5035 22.5035 k = 0.5000 0.5000 0.5000 ( 3112 PWs) bands (ev): -7.1102 -7.1102 -7.0995 -7.0995 -7.0995 -7.0995 -7.0995 -7.0995 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 4.1320 4.1320 4.1363 4.1363 4.1363 4.1363 4.1363 4.1363 6.5523 6.5523 6.5523 6.5523 6.5523 6.5523 6.5596 6.5596 6.9457 6.9457 6.9457 6.9457 6.9457 6.9457 7.0074 7.0074 9.7798 9.7798 9.7966 9.7966 9.7966 9.7966 9.7966 9.7966 9.9793 9.9793 9.9793 9.9793 9.9793 9.9793 9.9945 9.9945 11.4237 11.4237 11.4296 11.4296 11.4296 11.4296 11.4296 11.4296 20.0122 20.0122 20.0224 20.0224 20.0224 20.0224 20.0224 20.0224 22.3078 22.3078 22.5034 22.5034 k = 0.5000 0.5000 0.5000 ( 3112 PWs) bands (ev): -7.1102 -7.1102 -7.0995 -7.0995 -7.0995 -7.0995 -7.0995 -7.0995 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 4.1320 4.1320 4.1363 4.1363 4.1363 4.1363 4.1363 4.1363 6.5523 6.5523 6.5523 6.5523 6.5523 6.5523 6.5596 6.5596 6.9457 6.9457 6.9457 6.9457 6.9457 6.9457 7.0074 7.0074 9.7798 9.7798 9.7966 9.7966 9.7966 9.7966 9.7966 9.7966 9.9793 9.9793 9.9793 9.9793 9.9793 9.9793 9.9945 9.9945 11.4237 11.4237 11.4296 11.4296 11.4296 11.4296 11.4296 11.4296 20.0122 20.0122 20.0224 20.0224 20.0224 20.0224 20.0224 20.0224 22.3078 22.3078 22.5034 22.5034 k = 0.4902 0.5000 0.4902 ( 3112 PWs) bands (ev): -7.1286 -7.1286 -7.1227 -7.1227 -7.1031 -7.1031 -7.0988 -7.0988 -6.8616 -6.8616 -6.8616 -6.8616 -6.8393 -6.8393 -6.8388 -6.8388 4.1288 4.1288 4.1321 4.1321 4.1340 4.1340 4.1350 4.1350 6.5511 6.5511 6.5526 6.5526 6.5545 6.5545 6.5606 6.5606 6.9445 6.9445 6.9462 6.9462 6.9484 6.9484 7.0080 7.0080 9.7637 9.7637 9.7753 9.7753 9.7897 9.7897 9.7951 9.7951 9.9816 9.9816 9.9867 9.9867 9.9996 9.9996 10.0094 10.0094 11.4252 11.4252 11.4306 11.4306 11.4311 11.4311 11.4316 11.4316 20.0106 20.0106 20.0199 20.0199 20.0210 20.0210 20.0219 20.0219 22.3092 22.3092 22.5030 22.5030 k = 0.4804 0.5000 0.4804 ( 3130 PWs) bands (ev): -7.1807 -7.1807 -7.1763 -7.1763 -7.1018 -7.1018 -7.0967 -7.0967 -6.8597 -6.8597 -6.8597 -6.8597 -6.7858 -6.7858 -6.7846 -6.7846 4.1170 4.1170 4.1197 4.1197 4.1292 4.1292 4.1309 4.1309 6.5476 6.5476 6.5502 6.5502 6.5610 6.5610 6.5665 6.5665 6.9410 6.9410 6.9471 6.9471 6.9564 6.9564 7.0108 7.0108 9.7166 9.7166 9.7269 9.7269 9.7838 9.7838 9.7910 9.7910 9.9882 9.9882 9.9954 9.9954 10.0449 10.0449 10.0522 10.0522 11.4292 11.4292 11.4336 11.4336 11.4361 11.4361 11.4375 11.4375 20.0049 20.0049 20.0122 20.0122 20.0177 20.0177 20.0202 20.0202 22.3130 22.3130 22.5018 22.5018 k = 0.4706 0.5000 0.4706 ( 3134 PWs) bands (ev): -7.2455 -7.2455 -7.2418 -7.2418 -7.0984 -7.0984 -7.0932 -7.0932 -6.8567 -6.8567 -6.8567 -6.8567 -6.7198 -6.7198 -6.7180 -6.7180 4.0966 4.0966 4.0994 4.0994 4.1224 4.1224 4.1242 4.1242 6.5414 6.5414 6.5443 6.5443 6.5710 6.5710 6.5777 6.5777 6.9356 6.9356 6.9470 6.9470 6.9700 6.9700 7.0175 7.0175 9.6571 9.6571 9.6677 9.6677 9.7777 9.7777 9.7848 9.7848 9.9985 9.9985 10.0066 10.0066 10.0985 10.0985 10.1046 10.1046 11.4351 11.4351 11.4387 11.4387 11.4451 11.4451 11.4472 11.4472 19.9939 19.9939 19.9998 19.9998 20.0140 20.0140 20.0174 20.0174 22.3190 22.3190 22.5000 22.5000 k = 0.4608 0.5000 0.4608 ( 3134 PWs) bands (ev): -7.3151 -7.3151 -7.3119 -7.3119 -7.0936 -7.0936 -7.0883 -7.0883 -6.8524 -6.8524 -6.8524 -6.8524 -6.6487 -6.6487 -6.6465 -6.6465 4.0685 4.0685 4.0714 4.0714 4.1133 4.1133 4.1151 4.1151 6.5324 6.5324 6.5352 6.5352 6.5836 6.5836 6.5925 6.5925 6.9289 6.9289 6.9445 6.9445 6.9893 6.9893 7.0303 7.0303 9.5930 9.5930 9.6042 9.6042 9.7705 9.7705 9.7773 9.7773 10.0120 10.0120 10.0207 10.0207 10.1538 10.1538 10.1590 10.1590 11.4428 11.4428 11.4457 11.4457 11.4581 11.4581 11.4606 11.4606 19.9779 19.9779 19.9829 19.9829 20.0097 20.0097 20.0135 20.0135 22.3263 22.3263 22.4976 22.4976 k = 0.4510 0.5000 0.4510 ( 3138 PWs) bands (ev): -7.3867 -7.3867 -7.3838 -7.3838 -7.0873 -7.0873 -7.0820 -7.0820 -6.8469 -6.8469 -6.8469 -6.8469 -6.5753 -6.5753 -6.5727 -6.5727 4.0332 4.0332 4.0365 4.0365 4.1019 4.1019 4.1035 4.1035 6.5204 6.5204 6.5228 6.5228 6.5976 6.5976 6.6095 6.6095 6.9217 6.9217 6.9397 6.9397 7.0147 7.0147 7.0501 7.0501 9.5270 9.5270 9.5387 9.5387 9.7628 9.7628 9.7692 9.7692 10.0278 10.0278 10.0371 10.0371 10.2086 10.2086 10.2128 10.2128 11.4525 11.4525 11.4549 11.4549 11.4745 11.4745 11.4773 11.4773 19.9577 19.9577 19.9619 19.9619 20.0047 20.0047 20.0086 20.0086 22.3341 22.3341 22.4948 22.4948 k = 0.4412 0.5000 0.4412 ( 3138 PWs) bands (ev): -7.4589 -7.4589 -7.4563 -7.4563 -7.0796 -7.0796 -7.0743 -7.0743 -6.8402 -6.8402 -6.8402 -6.8402 -6.5009 -6.5009 -6.4981 -6.4981 3.9914 3.9914 3.9951 3.9951 4.0884 4.0884 4.0899 4.0899 6.5049 6.5049 6.5071 6.5071 6.6114 6.6114 6.6271 6.6271 6.9152 6.9152 6.9338 6.9338 7.0461 7.0461 7.0769 7.0769 9.4602 9.4602 9.4726 9.4726 9.7551 9.7551 9.7609 9.7609 10.0456 10.0456 10.0554 10.0554 10.2616 10.2616 10.2649 10.2649 11.4643 11.4643 11.4661 11.4661 11.4941 11.4941 11.4971 11.4971 19.9338 19.9338 19.9373 19.9373 19.9987 19.9987 20.0025 20.0025 22.3418 22.3418 22.4919 22.4919 k = 0.4314 0.5000 0.4314 ( 3138 PWs) bands (ev): -7.5312 -7.5312 -7.5288 -7.5288 -7.0706 -7.0706 -7.0653 -7.0653 -6.8323 -6.8323 -6.8323 -6.8323 -6.4262 -6.4262 -6.4231 -6.4231 3.9438 3.9438 3.9480 3.9480 4.0729 4.0729 4.0742 4.0742 6.4857 6.4857 6.4877 6.4877 6.6236 6.6236 6.6437 6.6437 6.9105 6.9105 6.9285 6.9285 7.0834 7.0834 7.1101 7.1101 9.3934 9.3934 9.4066 9.4066 9.7477 9.7477 9.7531 9.7531 10.0647 10.0647 10.0750 10.0750 10.3121 10.3121 10.3145 10.3145 11.4781 11.4781 11.4794 11.4794 11.5165 11.5165 11.5196 11.5196 19.9069 19.9069 19.9096 19.9096 19.9918 19.9918 19.9954 19.9954 22.3489 22.3489 22.4892 22.4892 k = 0.4216 0.5000 0.4216 ( 3136 PWs) bands (ev): -7.6032 -7.6032 -7.6009 -7.6009 -7.0601 -7.0601 -7.0549 -7.0549 -6.8233 -6.8233 -6.8232 -6.8232 -6.3516 -6.3516 -6.3483 -6.3483 3.8910 3.8910 3.8957 3.8957 4.0559 4.0559 4.0569 4.0569 6.4626 6.4626 6.4646 6.4646 6.6328 6.6328 6.6576 6.6576 6.9089 6.9089 6.9255 6.9255 7.1263 7.1263 7.1493 7.1493 9.3275 9.3275 9.3414 9.3414 9.7409 9.7409 9.7458 9.7458 10.0849 10.0849 10.0957 10.0957 10.3595 10.3595 10.3610 10.3610 11.4940 11.4940 11.4947 11.4947 11.5413 11.5413 11.5445 11.5445 19.8775 19.8775 19.8796 19.8796 19.9839 19.9839 19.9872 19.9872 22.3551 22.3551 22.4868 22.4868 k = 0.4118 0.5000 0.4118 ( 3130 PWs) bands (ev): -7.6747 -7.6747 -7.6725 -7.6725 -7.0484 -7.0484 -7.0431 -7.0431 -6.8131 -6.8131 -6.8130 -6.8130 -6.2774 -6.2774 -6.2739 -6.2739 3.8336 3.8336 3.8389 3.8389 4.0374 4.0374 4.0382 4.0382 6.4356 6.4356 6.4378 6.4378 6.6382 6.6382 6.6674 6.6674 6.9113 6.9113 6.9262 6.9262 7.1741 7.1741 7.1937 7.1937 9.2629 9.2629 9.2776 9.2776 9.7350 9.7350 9.7394 9.7394 10.1058 10.1058 10.1171 10.1171 10.4034 10.4034 10.4041 10.4041 11.5119 11.5119 11.5121 11.5121 11.5682 11.5682 11.5715 11.5715 19.8461 19.8461 19.8477 19.8477 19.9750 19.9750 19.9780 19.9780 22.3609 22.3609 22.4850 22.4850 k = 0.4020 0.5000 0.4020 ( 3138 PWs) bands (ev): -7.7454 -7.7454 -7.7434 -7.7434 -7.0353 -7.0353 -7.0301 -7.0301 -6.8018 -6.8018 -6.8016 -6.8016 -6.2039 -6.2039 -6.2002 -6.2002 3.7723 3.7723 3.7781 3.7781 4.0178 4.0178 4.0184 4.0184 6.4047 6.4047 6.4072 6.4072 6.6392 6.6392 6.6722 6.6722 6.9183 6.9183 6.9316 6.9316 7.2258 7.2258 7.2425 7.2425 9.2004 9.2004 9.2159 9.2159 9.7300 9.7300 9.7339 9.7339 10.1272 10.1272 10.1389 10.1389 10.4434 10.4434 10.4436 10.4436 11.5313 11.5313 11.5317 11.5317 11.5967 11.5967 11.6001 11.6001 19.8134 19.8134 19.8144 19.8144 19.9651 19.9651 19.9678 19.9678 22.3662 22.3662 22.4841 22.4841 k = 0.3922 0.5000 0.3922 ( 3142 PWs) bands (ev): -7.8152 -7.8152 -7.8134 -7.8134 -7.0209 -7.0209 -7.0157 -7.0157 -6.7893 -6.7893 -6.7892 -6.7892 -6.1313 -6.1313 -6.1273 -6.1273 3.7075 3.7075 3.7138 3.7138 3.9975 3.9975 3.9977 3.9977 6.3701 6.3701 6.3730 6.3730 6.6361 6.6361 6.6718 6.6718 6.9297 6.9297 6.9420 6.9420 7.2804 7.2804 7.2944 7.2944 9.1407 9.1407 9.1571 9.1571 9.7261 9.7261 9.7295 9.7295 10.1488 10.1488 10.1609 10.1609 10.4786 10.4786 10.4797 10.4797 11.5523 11.5523 11.5533 11.5533 11.6267 11.6267 11.6302 11.6302 19.7800 19.7800 19.7805 19.7805 19.9543 19.9543 19.9566 19.9566 22.3717 22.3717 22.4843 22.4843 k = 0.3824 0.5000 0.3824 ( 3146 PWs) bands (ev): -7.8841 -7.8841 -7.8824 -7.8824 -7.0052 -7.0052 -7.0001 -7.0001 -6.7758 -6.7758 -6.7756 -6.7756 -6.0597 -6.0597 -6.0555 -6.0555 3.6398 3.6398 3.6466 3.6466 3.9767 3.9767 3.9767 3.9767 6.3321 6.3321 6.3357 6.3357 6.6297 6.6297 6.6669 6.6669 6.9448 6.9448 6.9568 6.9568 7.3366 7.3366 7.3483 7.3483 9.0846 9.0846 9.1019 9.1019 9.7233 9.7233 9.7263 9.7263 10.1705 10.1705 10.1830 10.1830 10.5097 10.5097 10.5115 10.5115 11.5749 11.5749 11.5764 11.5764 11.6579 11.6579 11.6614 11.6614 19.7463 19.7463 19.7464 19.7464 19.9426 19.9426 19.9446 19.9446 22.3777 22.3777 22.4858 22.4858 k = 0.3725 0.5000 0.3725 ( 3140 PWs) bands (ev): -7.9519 -7.9519 -7.9503 -7.9503 -6.9883 -6.9883 -6.9832 -6.9832 -6.7613 -6.7613 -6.7610 -6.7610 -5.9893 -5.9893 -5.9850 -5.9850 3.5695 3.5695 3.5769 3.5769 3.9555 3.9555 3.9558 3.9558 6.2912 6.2912 6.2954 6.2954 6.6205 6.6205 6.6584 6.6584 6.9628 6.9628 6.9750 6.9750 7.3930 7.3930 7.4028 7.4028 9.0331 9.0331 9.0513 9.0513 9.7216 9.7216 9.7242 9.7242 10.1919 10.1919 10.2048 10.2048 10.5364 10.5364 10.5391 10.5391 11.5988 11.5988 11.6008 11.6008 11.6900 11.6900 11.6936 11.6936 19.7127 19.7127 19.7129 19.7129 19.9301 19.9301 19.9317 19.9317 22.3843 22.3843 22.4887 22.4887 k = 0.3627 0.5000 0.3627 ( 3148 PWs) bands (ev): -8.0186 -8.0186 -8.0171 -8.0171 -6.9702 -6.9702 -6.9651 -6.9651 -6.7457 -6.7457 -6.7454 -6.7454 -5.9204 -5.9204 -5.9158 -5.9158 3.4970 3.4970 3.5049 3.5049 3.9345 3.9345 3.9352 3.9352 6.2477 6.2477 6.2526 6.2526 6.6094 6.6094 6.6472 6.6472 6.9828 6.9828 6.9955 6.9955 7.4483 7.4483 7.4565 7.4565 8.9873 8.9873 9.0065 9.0065 9.7210 9.7210 9.7233 9.7233 10.2129 10.2129 10.2261 10.2261 10.5588 10.5588 10.5622 10.5622 11.6237 11.6237 11.6261 11.6261 11.7230 11.7230 11.7265 11.7265 19.6797 19.6797 19.6801 19.6801 19.9168 19.9168 19.9180 19.9180 22.3919 22.3919 22.4932 22.4932 k = 0.3529 0.5000 0.3529 ( 3148 PWs) bands (ev): -8.0841 -8.0841 -8.0827 -8.0827 -6.9508 -6.9508 -6.9457 -6.9457 -6.7291 -6.7291 -6.7288 -6.7288 -5.8530 -5.8530 -5.8483 -5.8483 3.4228 3.4228 3.4312 3.4312 3.9140 3.9140 3.9150 3.9150 6.2021 6.2021 6.2078 6.2078 6.5969 6.5969 6.6342 6.6342 7.0041 7.0041 7.0175 7.0175 7.5009 7.5009 7.5077 7.5077 8.9485 8.9485 8.9686 8.9686 9.7216 9.7216 9.7235 9.7235 10.2332 10.2332 10.2468 10.2468 10.5771 10.5771 10.5812 10.5812 11.6492 11.6492 11.6519 11.6519 11.7566 11.7566 11.7600 11.7600 19.6478 19.6478 19.6484 19.6484 19.9028 19.9028 19.9037 19.9037 22.4006 22.4006 22.4992 22.4992 k = 0.3431 0.5000 0.3431 ( 3140 PWs) bands (ev): -8.1483 -8.1483 -8.1470 -8.1470 -6.9303 -6.9303 -6.9253 -6.9253 -6.7116 -6.7116 -6.7112 -6.7112 -5.7874 -5.7874 -5.7825 -5.7825 3.3470 3.3470 3.3558 3.3558 3.8944 3.8944 3.8958 3.8958 6.1548 6.1548 6.1614 6.1614 6.5834 6.5834 6.6200 6.6200 7.0258 7.0258 7.0399 7.0399 7.5494 7.5494 7.5552 7.5552 8.9179 8.9179 8.9390 8.9390 9.7231 9.7231 9.7248 9.7248 10.2525 10.2525 10.2664 10.2664 10.5912 10.5912 10.5960 10.5960 11.6750 11.6750 11.6779 11.6779 11.7908 11.7908 11.7941 11.7941 19.6175 19.6175 19.6182 19.6182 19.8882 19.8882 19.8888 19.8888 22.4105 22.4105 22.5069 22.5069 k = 0.3333 0.5000 0.3333 ( 3150 PWs) bands (ev): -8.2112 -8.2112 -8.2099 -8.2099 -6.9087 -6.9087 -6.9037 -6.9037 -6.6932 -6.6932 -6.6927 -6.6927 -5.7237 -5.7237 -5.7186 -5.7186 3.2701 3.2701 3.2793 3.2793 3.8760 3.8760 3.8777 3.8777 6.1064 6.1064 6.1137 6.1137 6.5692 6.5692 6.6049 6.6049 7.0473 7.0473 7.0621 7.0621 7.5924 7.5924 7.5973 7.5973 8.8969 8.8969 8.9190 8.9190 9.7257 9.7257 9.7271 9.7271 10.2706 10.2706 10.2848 10.2848 10.6016 10.6016 10.6069 10.6069 11.7007 11.7007 11.7036 11.7036 11.8255 11.8255 11.8286 11.8286 19.5889 19.5889 19.5897 19.5897 19.8730 19.8730 19.8733 19.8733 22.4216 22.4216 22.5162 22.5162 k = 0.3235 0.5000 0.3235 ( 3146 PWs) bands (ev): -8.2727 -8.2727 -8.2715 -8.2715 -6.8861 -6.8861 -6.8810 -6.8810 -6.6739 -6.6739 -6.6733 -6.6733 -5.6621 -5.6621 -5.6568 -5.6568 3.1921 3.1921 3.2017 3.2017 3.8591 3.8591 3.8611 3.8611 6.0571 6.0571 6.0653 6.0653 6.5546 6.5546 6.5893 6.5893 7.0678 7.0678 7.0833 7.0833 7.6289 7.6289 7.6330 7.6330 8.8865 8.8865 8.9096 8.9096 9.7291 9.7291 9.7304 9.7304 10.2873 10.2873 10.3017 10.3017 10.6085 10.6085 10.6144 10.6144 11.7258 11.7258 11.7287 11.7287 11.8607 11.8607 11.8636 11.8636 19.5623 19.5623 19.5631 19.5631 19.8573 19.8573 19.8574 19.8574 22.4338 22.4338 22.5270 22.5270 k = 0.3137 0.5000 0.3137 ( 3150 PWs) bands (ev): -8.3327 -8.3327 -8.3316 -8.3316 -6.8624 -6.8624 -6.8574 -6.8574 -6.6538 -6.6538 -6.6531 -6.6531 -5.6027 -5.6027 -5.5973 -5.5973 3.1134 3.1134 3.1233 3.1233 3.8440 3.8440 3.8464 3.8464 6.0074 6.0074 6.0163 6.0163 6.5397 6.5397 6.5733 6.5733 7.0866 7.0866 7.1025 7.1025 7.6583 7.6583 7.6618 7.6618 8.8876 8.8876 8.9115 8.9115 9.7332 9.7332 9.7344 9.7344 10.3021 10.3021 10.3167 10.3167 10.6123 10.6123 10.6187 10.6187 11.7501 11.7501 11.7528 11.7528 11.8962 11.8962 11.8989 11.8989 19.5379 19.5379 19.5387 19.5387 19.8411 19.8411 19.8413 19.8413 22.4471 22.4471 22.5392 22.5392 k = 0.3039 0.5000 0.3039 ( 3158 PWs) bands (ev): -8.3913 -8.3913 -8.3903 -8.3903 -6.8377 -6.8377 -6.8327 -6.8327 -6.6329 -6.6329 -6.6321 -6.6321 -5.5456 -5.5456 -5.5400 -5.5400 3.0343 3.0343 3.0444 3.0444 3.8310 3.8310 3.8337 3.8337 5.9575 5.9575 5.9672 5.9672 6.5247 6.5247 6.5571 6.5571 7.1028 7.1028 7.1191 7.1191 7.6808 7.6808 7.6838 7.6838 8.9002 8.9002 8.9248 8.9248 9.7378 9.7378 9.7391 9.7391 10.3148 10.3148 10.3296 10.3296 10.6136 10.6136 10.6204 10.6204 11.7733 11.7733 11.7758 11.7758 11.9321 11.9321 11.9345 11.9345 19.5159 19.5159 19.5165 19.5165 19.8246 19.8246 19.8249 19.8249 22.4613 22.4613 22.5527 22.5527 k = 0.2941 0.5000 0.2941 ( 3138 PWs) bands (ev): -8.4484 -8.4484 -8.4474 -8.4474 -6.8121 -6.8121 -6.8071 -6.8071 -6.6113 -6.6113 -6.6104 -6.6104 -5.4910 -5.4910 -5.4853 -5.4853 2.9548 2.9548 2.9652 2.9652 3.8203 3.8203 3.8233 3.8233 5.9078 5.9078 5.9182 5.9182 6.5096 6.5096 6.5410 6.5410 7.1156 7.1156 7.1321 7.1321 7.6971 7.6971 7.6997 7.6997 8.9239 8.9239 8.9490 8.9490 9.7428 9.7428 9.7443 9.7443 10.3253 10.3253 10.3400 10.3400 10.6130 10.6130 10.6202 10.6202 11.7952 11.7952 11.7975 11.7975 11.9683 11.9683 11.9703 11.9703 19.4962 19.4962 19.4968 19.4968 19.8080 19.8080 19.8085 19.8085 22.4763 22.4763 22.5673 22.5673 k = 0.2843 0.5000 0.2843 ( 3138 PWs) bands (ev): -8.5039 -8.5039 -8.5030 -8.5030 -6.7857 -6.7857 -6.7807 -6.7807 -6.5890 -6.5890 -6.5879 -6.5879 -5.4391 -5.4391 -5.4332 -5.4332 2.8753 2.8753 2.8859 2.8859 3.8121 3.8121 3.8155 3.8155 5.8584 5.8584 5.8695 5.8695 6.4946 6.4946 6.5248 6.5248 7.1242 7.1242 7.1406 7.1406 7.7087 7.7087 7.7111 7.7111 8.9575 8.9575 8.9830 8.9830 9.7479 9.7479 9.7498 9.7498 10.3332 10.3332 10.3476 10.3476 10.6110 10.6110 10.6184 10.6184 11.8157 11.8157 11.8177 11.8177 12.0044 12.0044 12.0062 12.0062 19.4789 19.4789 19.4793 19.4793 19.7914 19.7914 19.7919 19.7919 22.4918 22.4918 22.5828 22.5828 k = 0.2745 0.5000 0.2745 ( 3142 PWs) bands (ev): -8.5579 -8.5579 -8.5570 -8.5570 -6.7585 -6.7585 -6.7535 -6.7535 -6.5661 -6.5661 -6.5648 -6.5648 -5.3899 -5.3899 -5.3839 -5.3839 2.7959 2.7959 2.8066 2.8066 3.8066 3.8066 3.8104 3.8104 5.8096 5.8096 5.8215 5.8215 6.4797 6.4797 6.5088 6.5088 7.1277 7.1277 7.1437 7.1437 7.7174 7.7174 7.7198 7.7198 8.9995 8.9995 9.0252 9.0252 9.7528 9.7528 9.7552 9.7552 10.3384 10.3384 10.3525 10.3525 10.6082 10.6082 10.6159 10.6159 11.8348 11.8348 11.8364 11.8364 12.0405 12.0405 12.0421 12.0421 19.4640 19.4640 19.4642 19.4642 19.7747 19.7747 19.7752 19.7752 22.5078 22.5078 22.5988 22.5988 k = 0.2647 0.5000 0.2647 ( 3130 PWs) bands (ev): -8.6102 -8.6102 -8.6094 -8.6094 -6.7306 -6.7306 -6.7255 -6.7255 -6.5425 -6.5425 -6.5411 -6.5411 -5.3435 -5.3435 -5.3374 -5.3374 2.7168 2.7168 2.7276 2.7276 3.8041 3.8041 3.8082 3.8082 5.7615 5.7615 5.7741 5.7741 6.4650 6.4650 6.4929 6.4929 7.1256 7.1256 7.1410 7.1410 7.7249 7.7249 7.7275 7.7275 9.0481 9.0481 9.0740 9.0740 9.7571 9.7571 9.7602 9.7602 10.3411 10.3411 10.3546 10.3546 10.6054 10.6054 10.6131 10.6131 11.8524 11.8524 11.8537 11.8537 12.0765 12.0765 12.0778 12.0778 19.4513 19.4513 19.4514 19.4514 19.7582 19.7582 19.7587 19.7587 22.5239 22.5239 22.6153 22.6153 k = 0.2549 0.5000 0.2549 ( 3136 PWs) bands (ev): -8.6608 -8.6608 -8.6601 -8.6601 -6.7021 -6.7021 -6.6970 -6.6970 -6.5185 -6.5185 -6.5169 -6.5169 -5.3000 -5.3000 -5.2938 -5.2938 2.6383 2.6383 2.6491 2.6491 3.8046 3.8046 3.8091 3.8091 5.7144 5.7144 5.7277 5.7277 6.4504 6.4504 6.4772 6.4772 7.1175 7.1175 7.1321 7.1321 7.7326 7.7326 7.7356 7.7356 9.1015 9.1015 9.1274 9.1274 9.7604 9.7604 9.7645 9.7645 10.3416 10.3416 10.3542 10.3542 10.6027 10.6027 10.6105 10.6105 11.8685 11.8685 11.8696 11.8696 12.1121 12.1121 12.1133 12.1133 19.4406 19.4406 19.4408 19.4408 19.7419 19.7419 19.7424 19.7424 22.5399 22.5399 22.6320 22.6320 k = 0.2451 0.5000 0.2451 ( 3140 PWs) bands (ev): -8.7097 -8.7097 -8.7091 -8.7091 -6.6730 -6.6730 -6.6679 -6.6679 -6.4939 -6.4939 -6.4921 -6.4921 -5.2596 -5.2596 -5.2533 -5.2533 2.5605 2.5605 2.5713 2.5713 3.8083 3.8083 3.8132 3.8132 5.6683 5.6683 5.6824 5.6824 6.4361 6.4361 6.4617 6.4617 7.1036 7.1036 7.1172 7.1172 7.7415 7.7415 7.7452 7.7452 9.1580 9.1580 9.1838 9.1838 9.7622 9.7622 9.7675 9.7675 10.3404 10.3404 10.3520 10.3520 10.6007 10.6007 10.6084 10.6084 11.8833 11.8833 11.8841 11.8841 12.1472 12.1472 12.1483 12.1483 19.4319 19.4319 19.4322 19.4322 19.7259 19.7259 19.7263 19.7263 22.5557 22.5557 22.6485 22.6485 k = 0.2353 0.5000 0.2353 ( 3140 PWs) bands (ev): -8.7570 -8.7570 -8.7563 -8.7563 -6.6436 -6.6436 -6.6384 -6.6384 -6.4689 -6.4689 -6.4669 -6.4669 -5.2222 -5.2222 -5.2159 -5.2159 2.4836 2.4836 2.4943 2.4943 3.8153 3.8153 3.8206 3.8206 5.6233 5.6233 5.6382 5.6382 6.4220 6.4220 6.4464 6.4464 7.0844 7.0844 7.0969 7.0969 7.7521 7.7521 7.7565 7.7565 9.2161 9.2161 9.2417 9.2417 9.7620 9.7620 9.7687 9.7687 10.3383 10.3383 10.3488 10.3488 10.5994 10.5994 10.6072 10.6072 11.8968 11.8968 11.8973 11.8973 12.1818 12.1818 12.1828 12.1828 19.4249 19.4249 19.4254 19.4254 19.7102 19.7102 19.7105 19.7105 22.5711 22.5711 22.6648 22.6648 k = 0.2255 0.5000 0.2255 ( 3144 PWs) bands (ev): -8.8025 -8.8025 -8.8019 -8.8019 -6.6138 -6.6138 -6.6086 -6.6086 -6.4435 -6.4435 -6.4412 -6.4412 -5.1879 -5.1879 -5.1815 -5.1815 2.4079 2.4079 2.4185 2.4185 3.8255 3.8255 3.8313 3.8313 5.5797 5.5797 5.5953 5.5953 6.4081 6.4081 6.4312 6.4312 7.0606 7.0606 7.0720 7.0720 7.7643 7.7643 7.7694 7.7694 9.2744 9.2744 9.2996 9.2996 9.7593 9.7593 9.7676 9.7676 10.3361 10.3361 10.3456 10.3456 10.5991 10.5991 10.6071 10.6071 11.9092 11.9092 11.9094 11.9094 12.2157 12.2157 12.2166 12.2166 19.4195 19.4195 19.4202 19.4202 19.6949 19.6949 19.6952 19.6952 22.5860 22.5860 22.6806 22.6806 k = 0.2157 0.5000 0.2157 ( 3148 PWs) bands (ev): -8.8462 -8.8462 -8.8456 -8.8456 -6.5839 -6.5839 -6.5786 -6.5786 -6.4178 -6.4178 -6.4152 -6.4152 -5.1568 -5.1568 -5.1503 -5.1503 2.3335 2.3335 2.3440 2.3440 3.8390 3.8390 3.8453 3.8453 5.5373 5.5373 5.5537 5.5537 6.3943 6.3943 6.4162 6.4162 7.0332 7.0332 7.0437 7.0437 7.7776 7.7776 7.7834 7.7834 9.3318 9.3318 9.3564 9.3564 9.7538 9.7538 9.7638 9.7638 10.3345 10.3345 10.3431 10.3431 10.6000 10.6000 10.6083 10.6083 11.9204 11.9204 11.9205 11.9205 12.2488 12.2488 12.2497 12.2497 19.4155 19.4155 19.4163 19.4163 19.6802 19.6802 19.6803 19.6803 22.6002 22.6002 22.6958 22.6958 k = 0.2059 0.5000 0.2059 ( 3152 PWs) bands (ev): -8.8881 -8.8881 -8.8876 -8.8876 -6.5540 -6.5540 -6.5486 -6.5486 -6.3917 -6.3917 -6.3889 -6.3889 -5.1288 -5.1288 -5.1223 -5.1223 2.2606 2.2606 2.2709 2.2709 3.8558 3.8558 3.8627 3.8627 5.4963 5.4963 5.5135 5.5135 6.3806 6.3806 6.4012 6.4012 7.0033 7.0033 7.0129 7.0129 7.7915 7.7915 7.7978 7.7978 9.3873 9.3873 9.4110 9.4110 9.7452 9.7452 9.7570 9.7570 10.3338 10.3338 10.3419 10.3419 10.6026 10.6026 10.6114 10.6114 11.9306 11.9306 11.9307 11.9307 12.2811 12.2811 12.2820 12.2820 19.4126 19.4126 19.4136 19.4136 19.6660 19.6660 19.6660 19.6660 22.6138 22.6138 22.7103 22.7103 k = 0.1961 0.5000 0.1961 ( 3140 PWs) bands (ev): -8.9282 -8.9282 -8.9277 -8.9277 -6.5241 -6.5241 -6.5187 -6.5187 -6.3653 -6.3653 -6.3623 -6.3623 -5.1038 -5.1038 -5.0973 -5.0973 2.1895 2.1895 2.1996 2.1996 3.8758 3.8758 3.8832 3.8832 5.4568 5.4568 5.4748 5.4748 6.3669 6.3669 6.3862 6.3862 6.9719 6.9719 6.9808 6.9808 7.8054 7.8054 7.8121 7.8121 9.4400 9.4400 9.4625 9.4625 9.7338 9.7338 9.7473 9.7473 10.3340 10.3340 10.3419 10.3419 10.6076 10.6076 10.6170 10.6170 11.9398 11.9398 11.9401 11.9401 12.3124 12.3124 12.3134 12.3134 19.4106 19.4106 19.4117 19.4117 19.6524 19.6524 19.6524 19.6524 22.6266 22.6266 22.7241 22.7241 k = 0.1863 0.5000 0.1863 ( 3144 PWs) bands (ev): -8.9664 -8.9664 -8.9660 -8.9660 -6.4946 -6.4946 -6.4891 -6.4891 -6.3387 -6.3387 -6.3354 -6.3354 -5.0819 -5.0819 -5.0755 -5.0755 2.1203 2.1203 2.1301 2.1301 3.8989 3.8989 3.9069 3.9069 5.4188 5.4188 5.4376 5.4376 6.3530 6.3530 6.3709 6.3709 6.9398 6.9398 6.9482 6.9482 7.8184 7.8184 7.8253 7.8253 9.4893 9.4893 9.5102 9.5102 9.7199 9.7199 9.7351 9.7351 10.3343 10.3343 10.3425 10.3425 10.6158 10.6158 10.6259 10.6259 11.9483 11.9483 11.9487 11.9487 12.3427 12.3427 12.3437 12.3437 19.4092 19.4092 19.4105 19.4105 19.6394 19.6394 19.6394 19.6394 22.6388 22.6388 22.7371 22.7371 k = 0.1765 0.5000 0.1765 ( 3148 PWs) bands (ev): -9.0029 -9.0029 -9.0025 -9.0025 -6.4654 -6.4654 -6.4599 -6.4599 -6.3119 -6.3119 -6.3084 -6.3084 -5.0631 -5.0631 -5.0566 -5.0566 2.0532 2.0532 2.0628 2.0628 3.9250 3.9250 3.9336 3.9336 5.3823 5.3823 5.4019 5.4019 6.3388 6.3388 6.3553 6.3553 6.9081 6.9081 6.9161 6.9161 7.8299 7.8299 7.8369 7.8369 9.5344 9.5344 9.5533 9.5533 9.7046 9.7046 9.7213 9.7213 10.3337 10.3337 10.3424 10.3424 10.6283 10.6283 10.6389 10.6389 11.9561 11.9561 11.9566 11.9566 12.3719 12.3719 12.3729 12.3729 19.4082 19.4082 19.4098 19.4098 19.6272 19.6272 19.6272 19.6272 22.6504 22.6504 22.7493 22.7493 k = 0.1667 0.5000 0.1667 ( 3150 PWs) bands (ev): -9.0374 -9.0374 -9.0370 -9.0370 -6.4369 -6.4369 -6.4314 -6.4314 -6.2849 -6.2849 -6.2811 -6.2811 -5.0471 -5.0471 -5.0407 -5.0407 1.9885 1.9885 1.9977 1.9977 3.9538 3.9538 3.9630 3.9630 5.3473 5.3473 5.3677 5.3677 6.3241 6.3241 6.3390 6.3390 6.8775 6.8775 6.8853 6.8853 7.8392 7.8392 7.8461 7.8461 9.5746 9.5746 9.5909 9.5909 9.6895 9.6895 9.7079 9.7079 10.3312 10.3312 10.3404 10.3404 10.6459 10.6459 10.6568 10.6568 11.9632 11.9632 11.9639 11.9639 12.3998 12.3998 12.4009 12.4009 19.4075 19.4075 19.4092 19.4092 19.6156 19.6156 19.6157 19.6157 22.6614 22.6614 22.7609 22.7609 k = 0.1569 0.5000 0.1569 ( 3142 PWs) bands (ev): -9.0700 -9.0700 -9.0697 -9.0697 -6.4092 -6.4092 -6.4037 -6.4037 -6.2578 -6.2578 -6.2538 -6.2538 -5.0339 -5.0339 -5.0276 -5.0276 1.9263 1.9263 1.9351 1.9351 3.9851 3.9851 3.9951 3.9951 5.3139 5.3139 5.3350 5.3350 6.3087 6.3087 6.3221 6.3221 6.8487 6.8487 6.8565 6.8565 7.8458 7.8458 7.8524 7.8524 9.6074 9.6074 9.6201 9.6201 9.6780 9.6780 9.6985 9.6985 10.3256 10.3256 10.3353 10.3353 10.6690 10.6690 10.6798 10.6798 11.9698 11.9698 11.9706 11.9706 12.4266 12.4266 12.4277 12.4277 19.4069 19.4069 19.4088 19.4088 19.6049 19.6049 19.6050 19.6050 22.6722 22.6722 22.7720 22.7720 k = 0.1471 0.5000 0.1471 ( 3138 PWs) bands (ev): -9.1008 -9.1008 -9.1005 -9.1005 -6.3825 -6.3825 -6.3770 -6.3770 -6.2307 -6.2307 -6.2265 -6.2265 -5.0234 -5.0234 -5.0172 -5.0172 1.8668 1.8668 1.8752 1.8752 4.0187 4.0187 4.0294 4.0294 5.2820 5.2820 5.3039 5.3039 6.2924 6.2924 6.3042 6.3042 6.8223 6.8223 6.8302 6.8302 7.8491 7.8491 7.8553 7.8553 9.6244 9.6244 9.6344 9.6344 9.6794 9.6794 9.7009 9.7009 10.3166 10.3166 10.3264 10.3264 10.6973 10.6973 10.7077 10.7077 11.9760 11.9760 11.9767 11.9767 12.4520 12.4520 12.4532 12.4532 19.4062 19.4062 19.4084 19.4084 19.5948 19.5948 19.5952 19.5952 22.6826 22.6826 22.7827 22.7827 k = 0.1373 0.5000 0.1373 ( 3142 PWs) bands (ev): -9.1296 -9.1296 -9.1293 -9.1293 -6.3568 -6.3568 -6.3515 -6.3515 -6.2036 -6.2036 -6.1993 -6.1993 -5.0153 -5.0153 -5.0093 -5.0093 1.8101 1.8101 1.8182 1.8182 4.0542 4.0542 4.0656 4.0656 5.2517 5.2517 5.2743 5.2743 6.2752 6.2752 6.2853 6.2853 6.7989 6.7989 6.8069 6.8069 7.8488 7.8488 7.8544 7.8544 9.6223 9.6223 9.6329 9.6329 9.6984 9.6984 9.7172 9.7172 10.3039 10.3039 10.3137 10.3137 10.7300 10.7300 10.7396 10.7396 11.9816 11.9816 11.9824 11.9824 12.4760 12.4760 12.4773 12.4773 19.4053 19.4053 19.4078 19.4078 19.5855 19.5855 19.5861 19.5861 22.6930 22.6930 22.7930 22.7930 k = 0.1275 0.5000 0.1275 ( 3146 PWs) bands (ev): -9.1565 -9.1565 -9.1562 -9.1562 -6.3325 -6.3325 -6.3273 -6.3273 -6.1767 -6.1767 -6.1723 -6.1723 -5.0096 -5.0096 -5.0038 -5.0038 1.7566 1.7566 1.7641 1.7641 4.0913 4.0913 4.1034 4.1034 5.2230 5.2230 5.2462 5.2462 6.2569 6.2569 6.2654 6.2654 6.7789 6.7789 6.7871 6.7871 7.8447 7.8447 7.8495 7.8495 9.6147 9.6147 9.6258 9.6258 9.7225 9.7225 9.7384 9.7384 10.2877 10.2877 10.2973 10.2973 10.7660 10.7660 10.7745 10.7745 11.9868 11.9868 11.9876 11.9876 12.4986 12.4986 12.4999 12.4999 19.4043 19.4043 19.4071 19.4071 19.5769 19.5769 19.5778 19.5778 22.7033 22.7033 22.8032 22.8032 k = 0.1176 0.5000 0.1176 ( 3138 PWs) bands (ev): -9.1814 -9.1814 -9.1812 -9.1812 -6.3095 -6.3095 -6.3045 -6.3045 -6.1501 -6.1501 -6.1458 -6.1458 -5.0059 -5.0059 -5.0003 -5.0003 1.7062 1.7062 1.7133 1.7133 4.1297 4.1297 4.1424 4.1424 5.1958 5.1958 5.2196 5.2196 6.2377 6.2377 6.2446 6.2446 6.7624 6.7624 6.7708 6.7708 7.8366 7.8366 7.8407 7.8407 9.6081 9.6081 9.6192 9.6192 9.7458 9.7458 9.7594 9.7594 10.2684 10.2684 10.2777 10.2777 10.8039 10.8039 10.8114 10.8114 11.9916 11.9916 11.9924 11.9924 12.5197 12.5197 12.5211 12.5211 19.4032 19.4032 19.4062 19.4062 19.5690 19.5690 19.5701 19.5701 22.7139 22.7139 22.8134 22.8134 k = 0.1078 0.5000 0.1078 ( 3136 PWs) bands (ev): -9.2044 -9.2044 -9.2042 -9.2042 -6.2881 -6.2881 -6.2833 -6.2833 -6.1240 -6.1240 -6.1198 -6.1198 -5.0041 -5.0041 -4.9988 -4.9988 1.6593 1.6593 1.6659 1.6659 4.1687 4.1687 4.1821 4.1821 5.1702 5.1702 5.1944 5.1944 6.2175 6.2175 6.2230 6.2230 6.7496 6.7496 6.7582 6.7582 7.8249 7.8249 7.8281 7.8281 9.6047 9.6047 9.6152 9.6152 9.7672 9.7672 9.7788 9.7788 10.2464 10.2464 10.2553 10.2553 10.8428 10.8428 10.8492 10.8492 11.9960 11.9960 11.9968 11.9968 12.5393 12.5393 12.5406 12.5406 19.4019 19.4019 19.4051 19.4051 19.5617 19.5617 19.5631 19.5631 22.7248 22.7248 22.8236 22.8236 k = 0.0980 0.5000 0.0980 ( 3132 PWs) bands (ev): -9.2254 -9.2254 -9.2253 -9.2253 -6.2682 -6.2682 -6.2638 -6.2638 -6.0987 -6.0987 -6.0947 -6.0947 -5.0040 -5.0040 -4.9989 -4.9989 1.6159 1.6159 1.6220 1.6220 4.2080 4.2080 4.2220 4.2220 5.1462 5.1462 5.1706 5.1706 6.1968 6.1968 6.2010 6.2010 6.7404 6.7404 6.7489 6.7489 7.8098 7.8098 7.8121 7.8121 9.6050 9.6050 9.6147 9.6147 9.7863 9.7863 9.7961 9.7961 10.2222 10.2222 10.2307 10.2307 10.8813 10.8813 10.8867 10.8867 12.0000 12.0000 12.0008 12.0008 12.5573 12.5573 12.5586 12.5586 19.4005 19.4005 19.4039 19.4039 19.5550 19.5550 19.5567 19.5567 22.7360 22.7360 22.8340 22.8340 k = 0.0882 0.5000 0.0882 ( 3136 PWs) bands (ev): -9.2445 -9.2445 -9.2443 -9.2443 -6.2500 -6.2500 -6.2460 -6.2460 -6.0745 -6.0745 -6.0707 -6.0707 -5.0051 -5.0051 -5.0004 -5.0004 1.5762 1.5762 1.5817 1.5817 4.2470 4.2470 4.2614 4.2614 5.1239 5.1239 5.1483 5.1483 6.1759 6.1759 6.1788 6.1788 6.7345 6.7345 6.7429 6.7429 7.7918 7.7918 7.7933 7.7933 9.6093 9.6093 9.6180 9.6180 9.8032 9.8032 9.8114 9.8114 10.1962 10.1962 10.2042 10.2042 10.9187 10.9187 10.9231 10.9231 12.0037 12.0037 12.0044 12.0044 12.5736 12.5736 12.5749 12.5749 19.3991 19.3991 19.4026 19.4026 19.5488 19.5488 19.5508 19.5508 22.7478 22.7478 22.8446 22.8446 k = 0.0784 0.5000 0.0784 ( 3140 PWs) bands (ev): -9.2616 -9.2616 -9.2614 -9.2614 -6.2336 -6.2336 -6.2299 -6.2299 -6.0516 -6.0516 -6.0480 -6.0480 -5.0073 -5.0073 -5.0029 -5.0029 1.5403 1.5403 1.5453 1.5453 4.2851 4.2851 4.2998 4.2998 5.1033 5.1033 5.1273 5.1273 6.1552 6.1552 6.1572 6.1572 6.7315 6.7315 6.7397 6.7397 7.7718 7.7718 7.7725 7.7725 9.6174 9.6174 9.6251 9.6251 9.8178 9.8178 9.8245 9.8245 10.1689 10.1689 10.1764 10.1764 10.9541 10.9541 10.9577 10.9577 12.0069 12.0069 12.0076 12.0076 12.5884 12.5884 12.5896 12.5896 19.3977 19.3977 19.4013 19.4013 19.5432 19.5432 19.5453 19.5453 22.7601 22.7601 22.8553 22.8553 k = 0.0686 0.5000 0.0686 ( 3134 PWs) bands (ev): -9.2766 -9.2766 -9.2765 -9.2765 -6.2189 -6.2189 -6.2157 -6.2157 -6.0303 -6.0303 -6.0270 -6.0270 -5.0102 -5.0102 -5.0062 -5.0062 1.5084 1.5084 1.5128 1.5128 4.3218 4.3218 4.3363 4.3363 5.0845 5.0845 5.1077 5.1077 6.1353 6.1353 6.1364 6.1364 6.7310 6.7310 6.7388 6.7388 7.7505 7.7505 7.7506 7.7506 9.6291 9.6291 9.6357 9.6357 9.8302 9.8302 9.8356 9.8356 10.1410 10.1410 10.1479 10.1479 10.9868 10.9868 10.9897 10.9897 12.0098 12.0098 12.0104 12.0104 12.6014 12.6014 12.6025 12.6025 19.3966 19.3966 19.4001 19.4001 19.5381 19.5381 19.5403 19.5403 22.7731 22.7731 22.8660 22.8660 k = 0.0588 0.5000 0.0588 ( 3138 PWs) bands (ev): -9.2897 -9.2897 -9.2896 -9.2896 -6.2061 -6.2061 -6.2033 -6.2033 -6.0110 -6.0110 -6.0081 -6.0081 -5.0135 -5.0135 -5.0100 -5.0100 1.4806 1.4806 1.4843 1.4843 4.3562 4.3562 4.3703 4.3703 5.0677 5.0677 5.0896 5.0896 6.1165 6.1165 6.1170 6.1170 6.7326 6.7326 6.7398 6.7398 7.7285 7.7285 7.7290 7.7290 9.6437 9.6437 9.6493 9.6493 9.8404 9.8404 9.8446 9.8446 10.1130 10.1130 10.1193 10.1193 11.0162 11.0162 11.0185 11.0185 12.0123 12.0123 12.0129 12.0129 12.6127 12.6127 12.6138 12.6138 19.3956 19.3956 19.3990 19.3990 19.5335 19.5335 19.5358 19.5358 22.7867 22.7867 22.8764 22.8764 k = 0.0490 0.5000 0.0490 ( 3150 PWs) bands (ev): -9.3008 -9.3008 -9.3007 -9.3007 -6.1951 -6.1951 -6.1928 -6.1928 -5.9939 -5.9939 -5.9914 -5.9914 -5.0169 -5.0169 -5.0139 -5.0139 1.4569 1.4569 1.4601 1.4601 4.3877 4.3877 4.4009 4.4009 5.0531 5.0531 5.0731 5.0731 6.0996 6.0996 6.0997 6.0997 6.7355 6.7355 6.7419 6.7419 7.7074 7.7074 7.7082 7.7082 9.6607 9.6607 9.6652 9.6652 9.8482 9.8482 9.8513 9.8513 10.0859 10.0859 10.0915 10.0915 11.0419 11.0419 11.0437 11.0437 12.0145 12.0145 12.0149 12.0149 12.6224 12.6224 12.6233 12.6233 19.3948 19.3948 19.3978 19.3978 19.5296 19.5296 19.5317 19.5317 22.8009 22.8009 22.8858 22.8858 k = 0.0392 0.5000 0.0392 ( 3138 PWs) bands (ev): -9.3098 -9.3098 -9.3098 -9.3098 -6.1861 -6.1861 -6.1842 -6.1842 -5.9794 -5.9794 -5.9774 -5.9774 -5.0202 -5.0202 -5.0177 -5.0177 1.4374 1.4374 1.4400 1.4400 4.4155 4.4155 4.4272 4.4272 5.0410 5.0410 5.0583 5.0583 6.0847 6.0847 6.0849 6.0849 6.7392 6.7392 6.7446 6.7446 7.6884 7.6884 7.6893 7.6893 9.6789 9.6789 9.6824 9.6824 9.8538 9.8538 9.8558 9.8558 10.0607 10.0607 10.0656 10.0656 11.0636 11.0636 11.0648 11.0648 12.0162 12.0162 12.0166 12.0166 12.6303 12.6303 12.6310 12.6310 19.3943 19.3943 19.3969 19.3969 19.5264 19.5264 19.5282 19.5282 22.8157 22.8157 22.8933 22.8933 k = 0.0294 0.5000 0.0294 ( 3138 PWs) bands (ev): -9.3169 -9.3169 -9.3168 -9.3168 -6.1789 -6.1789 -6.1775 -6.1775 -5.9677 -5.9677 -5.9662 -5.9662 -5.0229 -5.0229 -5.0210 -5.0210 1.4223 1.4223 1.4242 1.4242 4.4388 4.4388 4.4484 4.4484 5.0317 5.0317 5.0456 5.0456 6.0726 6.0726 6.0729 6.0729 6.7431 6.7431 6.7473 6.7473 7.6724 7.6724 7.6733 7.6733 9.6970 9.6970 9.6996 9.6996 9.8568 9.8568 9.8580 9.8580 10.0387 10.0387 10.0427 10.0427 11.0807 11.0807 11.0816 11.0816 12.0176 12.0176 12.0179 12.0179 12.6365 12.6365 12.6371 12.6371 19.3940 19.3940 19.3961 19.3961 19.5238 19.5238 19.5253 19.5253 22.8309 22.8309 22.8971 22.8971 k = 0.0196 0.5000 0.0196 ( 3154 PWs) bands (ev): -9.3219 -9.3219 -9.3219 -9.3219 -6.1738 -6.1738 -6.1728 -6.1728 -5.9591 -5.9591 -5.9581 -5.9581 -5.0250 -5.0250 -5.0237 -5.0237 1.4116 1.4116 1.4129 1.4129 4.4567 4.4567 4.4636 4.4636 5.0256 5.0256 5.0354 5.0354 6.0637 6.0637 6.0640 6.0640 6.7465 6.7465 6.7494 6.7494 7.6603 7.6603 7.6610 7.6610 9.7132 9.7132 9.7149 9.7149 9.8576 9.8576 9.8581 9.8581 10.0216 10.0216 10.0245 10.0245 11.0931 11.0931 11.0937 11.0937 12.0186 12.0186 12.0188 12.0188 12.6409 12.6409 12.6413 12.6413 19.3939 19.3939 19.3953 19.3953 19.5220 19.5220 19.5231 19.5231 22.8464 22.8464 22.8952 22.8952 k = 0.0098 0.5000 0.0098 ( 3174 PWs) bands (ev): -9.3249 -9.3249 -9.3249 -9.3249 -6.1706 -6.1706 -6.1701 -6.1701 -5.9538 -5.9538 -5.9532 -5.9532 -5.0262 -5.0262 -5.0255 -5.0255 1.4052 1.4052 1.4059 1.4059 4.4686 4.4686 4.4722 4.4722 5.0229 5.0229 5.0279 5.0279 6.0583 6.0583 6.0585 6.0585 6.7491 6.7491 6.7506 6.7506 7.6529 7.6529 7.6533 7.6533 9.7248 9.7248 9.7257 9.7257 9.8570 9.8570 9.8572 9.8572 10.0110 10.0110 10.0125 10.0125 11.1007 11.1007 11.1009 11.1009 12.0192 12.0192 12.0193 12.0193 12.6436 12.6436 12.6438 12.6438 19.3940 19.3940 19.3947 19.3947 19.5210 19.5210 19.5216 19.5216 22.8616 22.8616 22.8876 22.8876 k = 0.0000 0.5000-0.0000 ( 3178 PWs) bands (ev): -9.3259 -9.3259 -9.3259 -9.3259 -6.1693 -6.1693 -6.1693 -6.1693 -5.9518 -5.9518 -5.9518 -5.9518 -5.0264 -5.0264 -5.0264 -5.0264 1.4033 1.4033 1.4033 1.4033 4.4739 4.4739 4.4739 4.4739 5.0237 5.0237 5.0237 5.0237 6.0566 6.0566 6.0566 6.0566 6.7505 6.7505 6.7505 6.7505 7.6505 7.6505 7.6505 7.6505 9.7294 9.7294 9.7294 9.7294 9.8565 9.8565 9.8565 9.8565 10.0078 10.0078 10.0078 10.0078 11.1033 11.1033 11.1033 11.1033 12.0194 12.0194 12.0194 12.0194 12.6445 12.6445 12.6445 12.6445 19.3943 19.3943 19.3943 19.3943 19.5209 19.5209 19.5209 19.5209 22.8758 22.8758 22.8758 22.8758 k = 0.5000 0.5000-0.0000 ( 3136 PWs) bands (ev): -8.0902 -8.0902 -8.0902 -8.0902 -8.0898 -8.0898 -8.0898 -8.0898 -5.4320 -5.4320 -5.4320 -5.4320 -5.4234 -5.4234 -5.4234 -5.4234 2.9220 2.9220 2.9220 2.9220 2.9390 2.9390 2.9390 2.9390 5.9974 5.9974 5.9974 5.9974 6.0200 6.0200 6.0200 6.0200 8.0718 8.0718 8.0718 8.0718 8.0792 8.0792 8.0792 8.0792 9.0123 9.0123 9.0123 9.0123 9.0234 9.0234 9.0234 9.0234 10.5035 10.5035 10.5035 10.5035 10.5077 10.5077 10.5077 10.5077 12.0511 12.0511 12.0511 12.0511 12.0552 12.0552 12.0552 12.0552 19.6023 19.6023 19.6023 19.6023 19.6062 19.6062 19.6062 19.6062 23.0444 23.0444 23.0444 23.0444 k = 0.5000 0.5000 0.0139 ( 3152 PWs) bands (ev): -8.0894 -8.0894 -8.0892 -8.0892 -8.0889 -8.0889 -8.0889 -8.0889 -5.4340 -5.4340 -5.4337 -5.4337 -5.4252 -5.4252 -5.4252 -5.4252 2.9239 2.9239 2.9243 2.9243 2.9408 2.9408 2.9413 2.9413 5.9979 5.9979 5.9990 5.9990 6.0211 6.0211 6.0212 6.0212 8.0678 8.0678 8.0714 8.0714 8.0768 8.0768 8.0771 8.0771 9.0119 9.0119 9.0132 9.0132 9.0231 9.0231 9.0240 9.0240 10.5039 10.5039 10.5040 10.5040 10.5078 10.5078 10.5084 10.5084 12.0502 12.0502 12.0503 12.0503 12.0541 12.0541 12.0548 12.0548 19.6018 19.6018 19.6030 19.6030 19.6058 19.6058 19.6068 19.6068 23.0388 23.0388 23.0470 23.0470 k = 0.5000 0.5000 0.0278 ( 3152 PWs) bands (ev): -8.0867 -8.0867 -8.0863 -8.0863 -8.0862 -8.0862 -8.0861 -8.0861 -5.4398 -5.4398 -5.4391 -5.4391 -5.4309 -5.4309 -5.4308 -5.4308 2.9300 2.9300 2.9307 2.9307 2.9468 2.9468 2.9477 2.9477 6.0007 6.0007 6.0029 6.0029 6.0244 6.0244 6.0246 6.0246 8.0593 8.0593 8.0665 8.0665 8.0700 8.0700 8.0705 8.0705 9.0118 9.0118 9.0144 9.0144 9.0233 9.0233 9.0250 9.0250 10.5052 10.5052 10.5052 10.5052 10.5088 10.5088 10.5099 10.5099 12.0479 12.0479 12.0481 12.0481 12.0515 12.0515 12.0528 12.0528 19.6018 19.6018 19.6040 19.6040 19.6059 19.6059 19.6077 19.6077 23.0306 23.0306 23.0469 23.0469 k = 0.5000 0.5000 0.0417 ( 3152 PWs) bands (ev): -8.0822 -8.0822 -8.0816 -8.0816 -8.0816 -8.0816 -8.0815 -8.0815 -5.4492 -5.4492 -5.4481 -5.4481 -5.4402 -5.4402 -5.4401 -5.4401 2.9403 2.9403 2.9413 2.9413 2.9568 2.9568 2.9582 2.9582 6.0057 6.0057 6.0089 6.0089 6.0299 6.0299 6.0303 6.0303 8.0465 8.0465 8.0572 8.0572 8.0588 8.0588 8.0596 8.0596 9.0122 9.0122 9.0160 9.0160 9.0239 9.0239 9.0265 9.0265 10.5073 10.5073 10.5073 10.5073 10.5105 10.5105 10.5122 10.5122 12.0441 12.0441 12.0443 12.0443 12.0473 12.0473 12.0493 12.0493 19.6021 19.6021 19.6055 19.6055 19.6063 19.6063 19.6090 19.6090 23.0196 23.0196 23.0439 23.0439 k = 0.5000 0.5000 0.0556 ( 3148 PWs) bands (ev): -8.0759 -8.0759 -8.0751 -8.0751 -8.0751 -8.0751 -8.0751 -8.0751 -5.4622 -5.4622 -5.4608 -5.4608 -5.4531 -5.4531 -5.4530 -5.4530 2.9546 2.9546 2.9559 2.9559 2.9709 2.9709 2.9728 2.9728 6.0128 6.0128 6.0171 6.0171 6.0377 6.0377 6.0381 6.0381 8.0293 8.0293 8.0433 8.0433 8.0435 8.0435 8.0442 8.0442 9.0132 9.0132 9.0183 9.0183 9.0251 9.0251 9.0285 9.0285 10.5100 10.5100 10.5100 10.5100 10.5129 10.5129 10.5150 10.5150 12.0387 12.0387 12.0390 12.0390 12.0416 12.0416 12.0442 12.0442 19.6029 19.6029 19.6071 19.6071 19.6073 19.6073 19.6107 19.6107 23.0060 23.0060 23.0383 23.0383 k = 0.5000 0.5000 0.0694 ( 3156 PWs) bands (ev): -8.0678 -8.0678 -8.0669 -8.0669 -8.0668 -8.0668 -8.0667 -8.0667 -5.4788 -5.4788 -5.4771 -5.4771 -5.4696 -5.4696 -5.4695 -5.4695 2.9729 2.9729 2.9745 2.9745 2.9889 2.9889 2.9912 2.9912 6.0221 6.0221 6.0274 6.0274 6.0476 6.0476 6.0481 6.0481 8.0080 8.0080 8.0235 8.0235 8.0245 8.0245 8.0256 8.0256 9.0150 9.0150 9.0212 9.0212 9.0271 9.0271 9.0312 9.0312 10.5131 10.5131 10.5132 10.5132 10.5157 10.5157 10.5183 10.5183 12.0317 12.0317 12.0321 12.0321 12.0343 12.0343 12.0375 12.0375 19.6042 19.6042 19.6085 19.6085 19.6097 19.6097 19.6128 19.6128 22.9900 22.9900 23.0302 23.0302 k = 0.5000 0.5000 0.0833 ( 3140 PWs) bands (ev): -8.0578 -8.0578 -8.0568 -8.0568 -8.0567 -8.0567 -8.0566 -8.0566 -5.4988 -5.4988 -5.4968 -5.4968 -5.4896 -5.4896 -5.4895 -5.4895 2.9950 2.9950 2.9970 2.9970 3.0107 3.0107 3.0135 3.0135 6.0334 6.0334 6.0398 6.0398 6.0596 6.0596 6.0603 6.0603 7.9825 7.9825 7.9996 7.9996 8.0007 8.0007 8.0034 8.0034 9.0176 9.0176 9.0250 9.0250 9.0299 9.0299 9.0348 9.0348 10.5165 10.5165 10.5167 10.5167 10.5188 10.5188 10.5219 10.5219 12.0231 12.0231 12.0236 12.0236 12.0254 12.0254 12.0292 12.0292 19.6062 19.6062 19.6104 19.6104 19.6126 19.6126 19.6156 19.6156 22.9717 22.9717 23.0196 23.0196 k = 0.5000 0.5000 0.0972 ( 3132 PWs) bands (ev): -8.0460 -8.0460 -8.0449 -8.0449 -8.0448 -8.0448 -8.0446 -8.0446 -5.5222 -5.5222 -5.5199 -5.5199 -5.5130 -5.5130 -5.5128 -5.5128 3.0209 3.0209 3.0231 3.0231 3.0362 3.0362 3.0393 3.0393 6.0469 6.0469 6.0542 6.0542 6.0737 6.0737 6.0745 6.0745 7.9531 7.9531 7.9718 7.9718 7.9728 7.9728 7.9772 7.9772 9.0214 9.0214 9.0298 9.0298 9.0339 9.0339 9.0394 9.0394 10.5199 10.5199 10.5202 10.5202 10.5220 10.5220 10.5256 10.5256 12.0130 12.0130 12.0135 12.0135 12.0149 12.0149 12.0193 12.0193 19.6088 19.6088 19.6131 19.6131 19.6163 19.6163 19.6191 19.6191 22.9513 22.9513 23.0067 23.0067 k = 0.5000 0.5000 0.1111 ( 3140 PWs) bands (ev): -8.0324 -8.0324 -8.0311 -8.0311 -8.0311 -8.0311 -8.0308 -8.0308 -5.5488 -5.5488 -5.5462 -5.5462 -5.5397 -5.5397 -5.5395 -5.5395 3.0502 3.0502 3.0527 3.0527 3.0651 3.0651 3.0687 3.0687 6.0623 6.0623 6.0706 6.0706 6.0898 6.0898 6.0907 6.0907 7.9200 7.9200 7.9401 7.9401 7.9410 7.9410 7.9471 7.9471 9.0263 9.0263 9.0358 9.0358 9.0390 9.0390 9.0452 9.0452 10.5231 10.5231 10.5236 10.5236 10.5249 10.5249 10.5289 10.5289 12.0012 12.0012 12.0017 12.0017 12.0028 12.0028 12.0076 12.0076 19.6123 19.6123 19.6166 19.6166 19.6207 19.6207 19.6232 19.6232 22.9289 22.9289 22.9917 22.9917 k = 0.5000 0.5000 0.1250 ( 3140 PWs) bands (ev): -8.0170 -8.0170 -8.0156 -8.0156 -8.0156 -8.0156 -8.0152 -8.0152 -5.5786 -5.5786 -5.5757 -5.5757 -5.5694 -5.5694 -5.5692 -5.5692 3.0829 3.0829 3.0856 3.0856 3.0974 3.0974 3.1012 3.1012 6.0796 6.0796 6.0888 6.0888 6.1079 6.1079 6.1088 6.1088 7.8835 7.8835 7.9050 7.9050 7.9057 7.9057 7.9134 7.9134 9.0326 9.0326 9.0430 9.0430 9.0455 9.0455 9.0523 9.0523 10.5259 10.5259 10.5266 10.5266 10.5275 10.5275 10.5319 10.5319 11.9877 11.9877 11.9881 11.9881 11.9890 11.9890 11.9942 11.9942 19.6167 19.6167 19.6210 19.6210 19.6260 19.6260 19.6283 19.6283 22.9049 22.9049 22.9749 22.9749 k = 0.5000 0.5000 0.1389 ( 3148 PWs) bands (ev): -7.9999 -7.9999 -7.9983 -7.9983 -7.9983 -7.9983 -7.9979 -7.9979 -5.6112 -5.6112 -5.6081 -5.6081 -5.6022 -5.6022 -5.6019 -5.6019 3.1188 3.1188 3.1216 3.1216 3.1327 3.1327 3.1369 3.1369 6.0987 6.0987 6.1088 6.1088 6.1277 6.1277 6.1287 6.1287 7.8437 7.8437 7.8665 7.8665 7.8669 7.8669 7.8764 7.8764 9.0404 9.0404 9.0517 9.0517 9.0535 9.0535 9.0607 9.0607 10.5280 10.5280 10.5288 10.5288 10.5293 10.5293 10.5341 10.5341 11.9725 11.9725 11.9729 11.9729 11.9734 11.9734 11.9791 11.9791 19.6223 19.6223 19.6265 19.6265 19.6323 19.6323 19.6344 19.6344 22.8794 22.8794 22.9564 22.9564 k = 0.5000 0.5000 0.1528 ( 3148 PWs) bands (ev): -7.9809 -7.9809 -7.9793 -7.9793 -7.9792 -7.9792 -7.9787 -7.9787 -5.6467 -5.6467 -5.6434 -5.6434 -5.6378 -5.6378 -5.6375 -5.6375 3.1575 3.1575 3.1605 3.1605 3.1709 3.1709 3.1753 3.1753 6.1195 6.1195 6.1305 6.1305 6.1493 6.1493 6.1502 6.1502 7.8010 7.8010 7.8251 7.8251 7.8252 7.8252 7.8363 7.8363 9.0498 9.0498 9.0619 9.0619 9.0631 9.0631 9.0708 9.0708 10.5291 10.5291 10.5302 10.5302 10.5304 10.5304 10.5355 10.5355 11.9556 11.9556 11.9559 11.9559 11.9563 11.9563 11.9623 11.9623 19.6290 19.6290 19.6332 19.6332 19.6397 19.6397 19.6417 19.6417 22.8527 22.8527 22.9366 22.9366 k = 0.5000 0.5000 0.1667 ( 3124 PWs) bands (ev): -7.9602 -7.9602 -7.9584 -7.9584 -7.9583 -7.9583 -7.9578 -7.9578 -5.6849 -5.6849 -5.6813 -5.6813 -5.6760 -5.6760 -5.6757 -5.6757 3.1988 3.1988 3.2020 3.2020 3.2117 3.2117 3.2163 3.2163 6.1419 6.1419 6.1537 6.1537 6.1725 6.1725 6.1734 6.1734 7.7557 7.7557 7.7807 7.7807 7.7811 7.7811 7.7936 7.7936 9.0610 9.0610 9.0737 9.0737 9.0744 9.0744 9.0825 9.0825 10.5292 10.5292 10.5303 10.5303 10.5305 10.5305 10.5357 10.5357 11.9371 11.9371 11.9373 11.9373 11.9375 11.9375 11.9437 11.9437 19.6371 19.6371 19.6412 19.6412 19.6485 19.6485 19.6502 19.6502 22.8250 22.8250 22.9155 22.9155 k = 0.5000 0.5000 0.1806 ( 3144 PWs) bands (ev): -7.9378 -7.9378 -7.9358 -7.9358 -7.9358 -7.9358 -7.9352 -7.9352 -5.7255 -5.7255 -5.7217 -5.7217 -5.7167 -5.7167 -5.7164 -5.7164 3.2426 3.2426 3.2458 3.2458 3.2548 3.2548 3.2597 3.2597 6.1657 6.1657 6.1783 6.1783 6.1971 6.1971 6.1979 6.1979 7.7081 7.7081 7.7338 7.7338 7.7347 7.7347 7.7484 7.7484 9.0738 9.0738 9.0871 9.0871 9.0874 9.0874 9.0958 9.0958 10.5279 10.5279 10.5288 10.5288 10.5295 10.5295 10.5345 10.5345 11.9169 11.9169 11.9169 11.9169 11.9170 11.9170 11.9234 11.9234 19.6465 19.6465 19.6505 19.6505 19.6584 19.6584 19.6599 19.6599 22.7964 22.7964 22.8934 22.8934 k = 0.5000 0.5000 0.1944 ( 3144 PWs) bands (ev): -7.9137 -7.9137 -7.9116 -7.9116 -7.9114 -7.9114 -7.9109 -7.9109 -5.7684 -5.7684 -5.7644 -5.7644 -5.7597 -5.7597 -5.7595 -5.7595 3.2884 3.2884 3.2916 3.2916 3.3000 3.3000 3.3050 3.3050 6.1909 6.1909 6.2042 6.2042 6.2230 6.2230 6.2237 6.2237 7.6587 7.6587 7.6850 7.6850 7.6863 7.6863 7.7012 7.7012 9.0885 9.0885 9.1022 9.1022 9.1023 9.1023 9.1108 9.1108 10.5251 10.5251 10.5259 10.5259 10.5269 10.5269 10.5319 10.5319 11.8950 11.8950 11.8950 11.8950 11.8952 11.8952 11.9015 11.9015 19.6575 19.6575 19.6613 19.6613 19.6698 19.6698 19.6711 19.6711 22.7672 22.7672 22.8705 22.8705 k = 0.5000 0.5000 0.2083 ( 3144 PWs) bands (ev): -7.8878 -7.8878 -7.8856 -7.8856 -7.8854 -7.8854 -7.8848 -7.8848 -5.8134 -5.8134 -5.8093 -5.8093 -5.8049 -5.8049 -5.8046 -5.8046 3.3360 3.3360 3.3392 3.3392 3.3470 3.3470 3.3521 3.3521 6.2171 6.2171 6.2310 6.2310 6.2499 6.2499 6.2506 6.2506 7.6078 7.6078 7.6344 7.6344 7.6364 7.6364 7.6525 7.6525 9.1050 9.1050 9.1188 9.1188 9.1193 9.1193 9.1277 9.1277 10.5206 10.5206 10.5214 10.5214 10.5225 10.5225 10.5275 10.5275 11.8714 11.8714 11.8715 11.8715 11.8719 11.8719 11.8781 11.8781 19.6699 19.6699 19.6735 19.6735 19.6826 19.6826 19.6837 19.6837 22.7376 22.7376 22.8471 22.8471 k = 0.5000 0.5000 0.2222 ( 3144 PWs) bands (ev): -7.8603 -7.8603 -7.8579 -7.8579 -7.8578 -7.8578 -7.8571 -7.8571 -5.8604 -5.8604 -5.8561 -5.8561 -5.8520 -5.8520 -5.8518 -5.8518 3.3852 3.3852 3.3883 3.3883 3.3955 3.3955 3.4007 3.4007 6.2442 6.2442 6.2588 6.2588 6.2777 6.2777 6.2782 6.2782 7.5557 7.5557 7.5827 7.5827 7.5853 7.5853 7.6025 7.6025 9.1233 9.1233 9.1373 9.1373 9.1380 9.1380 9.1463 9.1463 10.5142 10.5142 10.5149 10.5149 10.5163 10.5163 10.5213 10.5213 11.8465 11.8465 11.8466 11.8466 11.8472 11.8472 11.8532 11.8532 19.6840 19.6840 19.6873 19.6873 19.6968 19.6968 19.6977 19.6977 22.7077 22.7077 22.8233 22.8233 k = 0.5000 0.5000 0.2361 ( 3144 PWs) bands (ev): -7.8312 -7.8312 -7.8285 -7.8285 -7.8284 -7.8284 -7.8278 -7.8278 -5.9091 -5.9091 -5.9047 -5.9047 -5.9009 -5.9009 -5.9007 -5.9007 3.4355 3.4355 3.4385 3.4385 3.4451 3.4451 3.4503 3.4503 6.2721 6.2721 6.2871 6.2871 6.3062 6.3062 6.3065 6.3065 7.5029 7.5029 7.5301 7.5301 7.5334 7.5334 7.5518 7.5518 9.1436 9.1436 9.1577 9.1577 9.1586 9.1586 9.1668 9.1668 10.5058 10.5058 10.5065 10.5065 10.5081 10.5081 10.5131 10.5131 11.8202 11.8202 11.8205 11.8205 11.8212 11.8212 11.8270 11.8270 19.6995 19.6995 19.7025 19.7025 19.7125 19.7125 19.7131 19.7131 22.6778 22.6778 22.7993 22.7993 k = 0.5000 0.5000 0.2500 ( 3136 PWs) bands (ev): -7.8004 -7.8004 -7.7976 -7.7976 -7.7975 -7.7975 -7.7968 -7.7968 -5.9594 -5.9594 -5.9549 -5.9549 -5.9514 -5.9514 -5.9512 -5.9512 3.4868 3.4868 3.4896 3.4896 3.4957 3.4957 3.5009 3.5009 6.3004 6.3004 6.3158 6.3158 6.3350 6.3350 6.3351 6.3351 7.4498 7.4498 7.4770 7.4770 7.4810 7.4810 7.5007 7.5007 9.1657 9.1657 9.1799 9.1799 9.1810 9.1810 9.1891 9.1891 10.4954 10.4954 10.4960 10.4960 10.4977 10.4977 10.5028 10.5028 11.7928 11.7928 11.7932 11.7932 11.7942 11.7942 11.7996 11.7996 19.7166 19.7166 19.7192 19.7192 19.7295 19.7295 19.7299 19.7299 22.6480 22.6480 22.7753 22.7753 k = 0.5000 0.5000 0.2639 ( 3152 PWs) bands (ev): -7.7680 -7.7680 -7.7650 -7.7650 -7.7649 -7.7649 -7.7642 -7.7642 -6.0112 -6.0112 -6.0066 -6.0066 -6.0034 -6.0034 -6.0031 -6.0031 3.5385 3.5385 3.5412 3.5412 3.5468 3.5468 3.5518 3.5518 6.3288 6.3288 6.3445 6.3445 6.3636 6.3636 6.3639 6.3639 7.3968 7.3968 7.4239 7.4239 7.4286 7.4286 7.4497 7.4497 9.1898 9.1898 9.2040 9.2040 9.2052 9.2052 9.2132 9.2132 10.4826 10.4826 10.4832 10.4832 10.4849 10.4849 10.4902 10.4902 11.7645 11.7645 11.7652 11.7652 11.7662 11.7662 11.7713 11.7713 19.7350 19.7350 19.7371 19.7371 19.7477 19.7477 19.7480 19.7480 22.6184 22.6184 22.7515 22.7515 k = 0.5000 0.5000 0.2778 ( 3152 PWs) bands (ev): -7.7341 -7.7341 -7.7309 -7.7309 -7.7308 -7.7308 -7.7301 -7.7301 -6.0642 -6.0642 -6.0595 -6.0595 -6.0566 -6.0566 -6.0563 -6.0563 3.5906 3.5906 3.5929 3.5929 3.5981 3.5981 3.6030 3.6030 6.3571 6.3571 6.3730 6.3730 6.3918 6.3918 6.3926 6.3926 7.3444 7.3444 7.3713 7.3713 7.3767 7.3767 7.3993 7.3993 9.2158 9.2158 9.2301 9.2301 9.2313 9.2313 9.2392 9.2392 10.4675 10.4675 10.4681 10.4681 10.4698 10.4698 10.4753 10.4753 11.7355 11.7355 11.7365 11.7365 11.7376 11.7376 11.7424 11.7424 19.7546 19.7546 19.7562 19.7562 19.7670 19.7670 19.7672 19.7672 22.5893 22.5893 22.7279 22.7279 k = 0.5000 0.5000 0.2917 ( 3152 PWs) bands (ev): -7.6987 -7.6987 -7.6953 -7.6953 -7.6952 -7.6952 -7.6945 -7.6945 -6.1182 -6.1182 -6.1135 -6.1135 -6.1108 -6.1108 -6.1106 -6.1106 3.6424 3.6424 3.6444 3.6444 3.6492 3.6492 3.6540 3.6540 6.3849 6.3849 6.4010 6.4010 6.4193 6.4193 6.4206 6.4206 7.2930 7.2930 7.3196 7.3196 7.3257 7.3257 7.3499 7.3499 9.2436 9.2436 9.2580 9.2580 9.2593 9.2593 9.2671 9.2671 10.4500 10.4500 10.4505 10.4505 10.4521 10.4521 10.4579 10.4579 11.7062 11.7062 11.7074 11.7074 11.7086 11.7086 11.7130 11.7130 19.7754 19.7754 19.7764 19.7764 19.7874 19.7874 19.7874 19.7874 22.5607 22.5607 22.7048 22.7048 k = 0.5000 0.5000 0.3056 ( 3152 PWs) bands (ev): -7.6618 -7.6618 -7.6582 -7.6582 -7.6581 -7.6581 -7.6573 -7.6573 -6.1731 -6.1731 -6.1684 -6.1684 -6.1660 -6.1660 -6.1657 -6.1657 3.6938 3.6938 3.6954 3.6954 3.6999 3.6999 3.7044 3.7044 6.4119 6.4119 6.4279 6.4279 6.4457 6.4457 6.4475 6.4475 7.2432 7.2432 7.2694 7.2694 7.2761 7.2761 7.3021 7.3021 9.2734 9.2734 9.2878 9.2878 9.2891 9.2891 9.2968 9.2968 10.4299 10.4299 10.4304 10.4304 10.4319 10.4319 10.4380 10.4380 11.6767 11.6767 11.6783 11.6783 11.6795 11.6795 11.6835 11.6835 19.7971 19.7971 19.7974 19.7974 19.8084 19.8084 19.8084 19.8084 22.5329 22.5329 22.6824 22.6824 k = 0.5000 0.5000 0.3194 ( 3156 PWs) bands (ev): -7.6235 -7.6235 -7.6196 -7.6196 -7.6195 -7.6195 -7.6188 -7.6188 -6.2287 -6.2287 -6.2240 -6.2240 -6.2218 -6.2218 -6.2216 -6.2216 3.7443 3.7443 3.7455 3.7455 3.7497 3.7497 3.7539 3.7539 6.4377 6.4377 6.4535 6.4535 6.4706 6.4706 6.4729 6.4729 7.1956 7.1956 7.2211 7.2211 7.2283 7.2283 7.2565 7.2565 9.3051 9.3051 9.3195 9.3195 9.3208 9.3208 9.3283 9.3283 10.4073 10.4073 10.4078 10.4078 10.4090 10.4090 10.4155 10.4155 11.6475 11.6475 11.6495 11.6495 11.6506 11.6506 11.6543 11.6543 19.8190 19.8190 19.8195 19.8195 19.8300 19.8300 19.8301 19.8301 22.5060 22.5060 22.6606 22.6606 k = 0.5000 0.5000 0.3333 ( 3140 PWs) bands (ev): -7.5838 -7.5838 -7.5797 -7.5797 -7.5796 -7.5796 -7.5789 -7.5789 -6.2849 -6.2849 -6.2802 -6.2802 -6.2783 -6.2783 -6.2781 -6.2781 3.7935 3.7935 3.7942 3.7942 3.7983 3.7983 3.8022 3.8022 6.4618 6.4618 6.4772 6.4772 6.4934 6.4934 6.4962 6.4962 7.1508 7.1508 7.1753 7.1753 7.1829 7.1829 7.2135 7.2135 9.3387 9.3387 9.3531 9.3531 9.3543 9.3543 9.3617 9.3617 10.3821 10.3821 10.3826 10.3826 10.3835 10.3835 10.3904 10.3904 11.6189 11.6189 11.6212 11.6212 11.6224 11.6224 11.6256 11.6256 19.8409 19.8409 19.8422 19.8422 19.8518 19.8518 19.8520 19.8520 22.4801 22.4801 22.6398 22.6398 k = 0.5000 0.5000 0.3472 ( 3148 PWs) bands (ev): -7.5428 -7.5428 -7.5385 -7.5385 -7.5384 -7.5384 -7.5377 -7.5377 -6.3414 -6.3414 -6.3368 -6.3368 -6.3351 -6.3351 -6.3349 -6.3349 3.8411 3.8411 3.8413 3.8413 3.8452 3.8452 3.8487 3.8487 6.4838 6.4838 6.4986 6.4986 6.5137 6.5137 6.5170 6.5170 7.1095 7.1095 7.1326 7.1326 7.1405 7.1405 7.1738 7.1738 9.3740 9.3740 9.3884 9.3884 9.3895 9.3895 9.3967 9.3967 10.3542 10.3542 10.3547 10.3547 10.3553 10.3553 10.3627 10.3627 11.5911 11.5911 11.5939 11.5939 11.5950 11.5950 11.5978 11.5978 19.8628 19.8628 19.8650 19.8650 19.8737 19.8737 19.8738 19.8738 22.4553 22.4553 22.6199 22.6199 k = 0.5000 0.5000 0.3611 ( 3148 PWs) bands (ev): -7.5007 -7.5007 -7.4960 -7.4960 -7.4959 -7.4959 -7.4953 -7.4953 -6.3982 -6.3982 -6.3936 -6.3936 -6.3921 -6.3921 -6.3919 -6.3919 3.8863 3.8863 3.8866 3.8866 3.8901 3.8901 3.8932 3.8932 6.5033 6.5033 6.5172 6.5172 6.5310 6.5310 6.5346 6.5346 7.0722 7.0722 7.0937 7.0937 7.1016 7.1016 7.1380 7.1380 9.4111 9.4111 9.4254 9.4254 9.4264 9.4264 9.4335 9.4335 10.3238 10.3238 10.3243 10.3243 10.3244 10.3244 10.3325 10.3325 11.5646 11.5646 11.5678 11.5678 11.5688 11.5688 11.5712 11.5712 19.8843 19.8843 19.8875 19.8875 19.8952 19.8952 19.8954 19.8954 22.4319 22.4319 22.6012 22.6012 k = 0.5000 0.5000 0.3750 ( 3136 PWs) bands (ev): -7.4574 -7.4574 -7.4524 -7.4524 -7.4523 -7.4523 -7.4517 -7.4517 -6.4549 -6.4549 -6.4504 -6.4504 -6.4491 -6.4491 -6.4490 -6.4490 3.9287 3.9287 3.9296 3.9296 3.9325 3.9325 3.9352 3.9352 6.5198 6.5198 6.5326 6.5326 6.5450 6.5450 6.5485 6.5485 7.0397 7.0397 7.0592 7.0592 7.0668 7.0668 7.1066 7.1066 9.4498 9.4498 9.4640 9.4640 9.4650 9.4650 9.4718 9.4718 10.2910 10.2910 10.2911 10.2911 10.2914 10.2914 10.2999 10.2999 11.5397 11.5397 11.5433 11.5433 11.5442 11.5442 11.5462 11.5462 19.9053 19.9053 19.9095 19.9095 19.9161 19.9161 19.9163 19.9163 22.4101 22.4101 22.5838 22.5838 k = 0.5000 0.5000 0.3889 ( 3140 PWs) bands (ev): -7.4131 -7.4131 -7.4079 -7.4079 -7.4078 -7.4078 -7.4072 -7.4072 -6.5114 -6.5114 -6.5071 -6.5071 -6.5060 -6.5060 -6.5058 -6.5058 3.9682 3.9682 3.9697 3.9697 3.9720 3.9720 3.9743 3.9743 6.5331 6.5331 6.5444 6.5444 6.5554 6.5554 6.5585 6.5585 7.0124 7.0124 7.0294 7.0294 7.0364 7.0364 7.0799 7.0799 9.4900 9.4900 9.5042 9.5042 9.5050 9.5050 9.5115 9.5115 10.2554 10.2554 10.2558 10.2558 10.2562 10.2562 10.2649 10.2649 11.5166 11.5166 11.5207 11.5207 11.5214 11.5214 11.5230 11.5230 19.9253 19.9253 19.9305 19.9305 19.9359 19.9359 19.9361 19.9361 22.3899 22.3899 22.5678 22.5678 k = 0.5000 0.5000 0.4028 ( 3148 PWs) bands (ev): -7.3681 -7.3681 -7.3625 -7.3625 -7.3624 -7.3624 -7.3619 -7.3619 -6.5674 -6.5674 -6.5633 -6.5633 -6.5623 -6.5623 -6.5622 -6.5622 4.0044 4.0044 4.0064 4.0064 4.0082 4.0082 4.0100 4.0100 6.5429 6.5429 6.5525 6.5525 6.5622 6.5622 6.5644 6.5644 6.9906 6.9906 7.0048 7.0048 7.0109 7.0109 7.0581 7.0581 9.5315 9.5315 9.5456 9.5456 9.5463 9.5463 9.5525 9.5525 10.2177 10.2177 10.2185 10.2185 10.2189 10.2189 10.2279 10.2279 11.4957 11.4957 11.5001 11.5001 11.5007 11.5007 11.5020 11.5020 19.9439 19.9439 19.9500 19.9500 19.9544 19.9544 19.9546 19.9546 22.3716 22.3716 22.5533 22.5533 k = 0.5000 0.5000 0.4167 ( 3148 PWs) bands (ev): -7.3226 -7.3226 -7.3165 -7.3165 -7.3164 -7.3164 -7.3160 -7.3160 -6.6225 -6.6225 -6.6187 -6.6187 -6.6179 -6.6179 -6.6178 -6.6178 4.0367 4.0367 4.0393 4.0393 4.0406 4.0406 4.0420 4.0420 6.5495 6.5495 6.5571 6.5571 6.5658 6.5658 6.5665 6.5665 6.9742 6.9742 6.9853 6.9853 6.9903 6.9903 7.0411 7.0411 9.5739 9.5739 9.5880 9.5880 9.5886 9.5886 9.5944 9.5944 10.1782 10.1782 10.1795 10.1795 10.1798 10.1798 10.1892 10.1892 11.4771 11.4771 11.4819 11.4819 11.4824 11.4824 11.4833 11.4833 19.9608 19.9608 19.9680 19.9680 19.9713 19.9713 19.9715 19.9715 22.3553 22.3553 22.5405 22.5405 k = 0.5000 0.5000 0.4306 ( 3148 PWs) bands (ev): -7.2770 -7.2770 -7.2704 -7.2704 -7.2703 -7.2703 -7.2700 -7.2700 -6.6764 -6.6764 -6.6729 -6.6729 -6.6723 -6.6723 -6.6722 -6.6722 4.0649 4.0649 4.0679 4.0679 4.0689 4.0689 4.0699 4.0699 6.5531 6.5531 6.5588 6.5588 6.5656 6.5656 6.5667 6.5667 6.9625 6.9625 6.9706 6.9706 6.9744 6.9744 7.0285 7.0285 9.6169 9.6169 9.6310 9.6310 9.6315 9.6315 9.6367 9.6367 10.1376 10.1376 10.1392 10.1392 10.1395 10.1395 10.1494 10.1494 11.4610 11.4610 11.4662 11.4662 11.4665 11.4665 11.4672 11.4672 19.9758 19.9758 19.9838 19.9838 19.9862 19.9862 19.9863 19.9863 22.3411 22.3411 22.5294 22.5294 k = 0.5000 0.5000 0.4444 ( 3148 PWs) bands (ev): -7.2320 -7.2320 -7.2248 -7.2248 -7.2247 -7.2247 -7.2244 -7.2244 -6.7282 -6.7282 -6.7252 -6.7252 -6.7248 -6.7248 -6.7247 -6.7247 4.0886 4.0886 4.0920 4.0920 4.0926 4.0926 4.0933 4.0933 6.5544 6.5544 6.5582 6.5582 6.5628 6.5628 6.5657 6.5657 6.9548 6.9548 6.9602 6.9602 6.9628 6.9628 7.0196 7.0196 9.6598 9.6598 9.6740 9.6740 9.6743 9.6743 9.6789 9.6789 10.0964 10.0964 10.0983 10.0983 10.0985 10.0985 10.1091 10.1091 11.4477 11.4477 11.4531 11.4531 11.4534 11.4534 11.4538 11.4538 19.9885 19.9885 19.9972 19.9972 19.9989 19.9989 19.9989 19.9989 22.3293 22.3293 22.5202 22.5202 k = 0.5000 0.5000 0.4583 ( 3140 PWs) bands (ev): -7.1889 -7.1889 -7.1809 -7.1809 -7.1809 -7.1809 -7.1807 -7.1807 -6.7766 -6.7766 -6.7742 -6.7742 -6.7739 -6.7739 -6.7739 -6.7739 4.1074 4.1074 4.1112 4.1112 4.1115 4.1115 4.1119 4.1119 6.5542 6.5542 6.5565 6.5565 6.5591 6.5591 6.5637 6.5637 6.9501 6.9501 6.9531 6.9531 6.9547 6.9547 7.0136 7.0136 9.7013 9.7013 9.7158 9.7158 9.7161 9.7161 9.7197 9.7197 10.0562 10.0562 10.0580 10.0580 10.0582 10.0582 10.0697 10.0697 11.4373 11.4373 11.4429 11.4429 11.4430 11.4430 11.4433 11.4433 19.9987 19.9987 20.0081 20.0081 20.0090 20.0090 20.0090 20.0090 22.3200 22.3200 22.5129 22.5129 k = 0.5000 0.5000 0.4722 ( 3124 PWs) bands (ev): -7.1504 -7.1504 -7.1414 -7.1414 -7.1414 -7.1414 -7.1412 -7.1412 -6.8189 -6.8189 -6.8175 -6.8175 -6.8173 -6.8173 -6.8173 -6.8173 4.1210 4.1210 4.1251 4.1251 4.1252 4.1252 4.1254 4.1254 6.5534 6.5534 6.5544 6.5544 6.5556 6.5556 6.5617 6.5617 6.9474 6.9474 6.9488 6.9488 6.9495 6.9495 7.0099 7.0099 9.7391 9.7391 9.7543 9.7543 9.7544 9.7544 9.7568 9.7568 10.0193 10.0193 10.0207 10.0207 10.0208 10.0208 10.0336 10.0336 11.4298 11.4298 11.4355 11.4355 11.4356 11.4356 11.4357 11.4357 20.0062 20.0062 20.0160 20.0160 20.0164 20.0164 20.0164 20.0164 22.3132 22.3132 22.5077 22.5078 k = 0.5000 0.5000 0.4861 ( 3112 PWs) bands (ev): -7.1215 -7.1215 -7.1114 -7.1114 -7.1114 -7.1114 -7.1113 -7.1113 -6.8502 -6.8502 -6.8497 -6.8497 -6.8496 -6.8496 -6.8496 -6.8496 4.1293 4.1293 4.1335 4.1335 4.1335 4.1335 4.1336 4.1336 6.5526 6.5526 6.5529 6.5529 6.5532 6.5532 6.5601 6.5601 6.9461 6.9461 6.9465 6.9465 6.9466 6.9466 7.0080 7.0080 9.7681 9.7681 9.7843 9.7843 9.7844 9.7844 9.7852 9.7852 9.9907 9.9907 9.9913 9.9913 9.9913 9.9913 10.0057 10.0057 11.4252 11.4252 11.4311 11.4311 11.4311 11.4311 11.4311 11.4311 20.0107 20.0107 20.0208 20.0208 20.0209 20.0209 20.0209 20.0209 22.3092 22.3092 22.5045 22.5045 k = 0.5000 0.5000 0.5000 ( 3112 PWs) bands (ev): -7.1102 -7.1102 -7.0995 -7.0995 -7.0995 -7.0995 -7.0995 -7.0995 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 -6.8622 4.1320 4.1320 4.1363 4.1363 4.1363 4.1363 4.1363 4.1363 6.5523 6.5523 6.5523 6.5523 6.5523 6.5523 6.5596 6.5596 6.9457 6.9457 6.9457 6.9457 6.9457 6.9457 7.0074 7.0074 9.7798 9.7798 9.7966 9.7966 9.7966 9.7966 9.7966 9.7966 9.9793 9.9793 9.9793 9.9793 9.9793 9.9793 9.9945 9.9945 11.4237 11.4237 11.4296 11.4296 11.4296 11.4296 11.4296 11.4296 20.0122 20.0122 20.0224 20.0224 20.0224 20.0224 20.0224 20.0224 22.3078 22.3078 22.5034 22.5034 Writing output data file GeO2.save init_run : 0.06s CPU 0.17s WALL ( 1 calls) electrons : 223.02s CPU 226.28s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 223.02s CPU 226.27s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.01s CPU 0.01s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.05s WALL ( 278 calls) cegterg : 209.77s CPU 212.63s WALL ( 370 calls) Called by sum_band: Called by *egterg: h_psi : 90.28s CPU 91.89s WALL ( 6290 calls) s_psi : 4.66s CPU 4.73s WALL ( 6290 calls) g_psi : 0.23s CPU 0.22s WALL ( 5642 calls) cdiaghg : 105.81s CPU 107.19s WALL ( 5920 calls) cegterg:over : 8.25s CPU 8.25s WALL ( 5642 calls) cegterg:upda : 6.38s CPU 6.51s WALL ( 5642 calls) cegterg:last : 3.04s CPU 3.02s WALL ( 927 calls) cdiaghg:chol : 6.14s CPU 6.25s WALL ( 5920 calls) cdiaghg:inve : 4.88s CPU 4.73s WALL ( 5920 calls) cdiaghg:para : 8.37s CPU 8.63s WALL ( 11840 calls) Called by h_psi: h_psi:vloc : 77.78s CPU 79.17s WALL ( 6290 calls) h_psi:vnl : 12.19s CPU 12.47s WALL ( 6290 calls) add_vuspsi : 4.98s CPU 5.27s WALL ( 6290 calls) General routines calbec : 7.18s CPU 7.18s WALL ( 6290 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 73.08s CPU 74.26s WALL ( 989704 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.19s CPU 0.20s WALL ( 556 calls) Parallel routines fft_scatter : 26.24s CPU 26.94s WALL ( 989727 calls) PWSCF : 3m58.74s CPU 4m12.80s WALL This run was terminated on: 18:57:46 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=